A0A087XHP5_POEFO Loading...

Exportin-4

AlphaFold DB , UniProt , Accession A0A087XHP5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,155 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
1M34.9Very low50.9Low198 Ų198101 Ų10198%0.97561%0.606SS**  086.70-165.8-173.2-154.400108R1105M1-R1105 PolarHBondContact SD-NH1 3.1Å
2M25.9Very low53.9Low191 Ų19193.9 Ų93.994%0.94156%0.562SS**  trans-176.280.1161.7-104.8-168.8-173.500107.2
3M30.3Very low56.6Low153 Ų15393.5 Ų93.575%0.75456%0.561SS**  trans-149.572.3154.7-95.4-162.4174.200105.3
4A29.6Very low59.2Low96 Ų9692.6 Ų92.679%0.79355%0.548SS*.  trans-92.3118.2165.300000106.7
5A37.4Very low61.5Low106 Ų10686.6 Ų86.688%0.87651%0.512SS*.  trans55.161.9164.300000117.4
6V45.7Very low63.5Low63 Ų6384.1 Ų84.138%0.38249%0.494SS..  trans-83.8126.2155.4178.20000106.7E10 V11V6-E10 HydrophobicContact CG1-CB 3.41Å; V6-E10 VanDerWaalsContact CG1-CB 3.41Å; V6-E10 HydrophobicContact CG1-CG 4.43Å; V6-E10 VanDerWaalsContact CG1-OE2 3.32Å; V6-E10 WeakPolarHBondContact CG1-OE2 3.47Å; V6-V11 HydrophobicContact CB-CG2 4.17Å; V6-V11 HydrophobicContact CG1-CG2 3.6Å
7G58.5Low65.3Low36 Ų3682.8 Ų82.837%0.37149%0.49SS..  trans-62.6147.1178.800000110.6P9 E10 V11G7-P9 WeakPolarHBondContact O-CD 3.46Å; G7-E10 PolarHBondContact N-OE2 2.64Å; G7-E10 PolarHBondContact O-N 3.37Å; G7-V11 PolarHBondContact O-N 3.49Å
8A63.3Low66.9Low37 Ų3778.5 Ų78.531%0.30647%0.465SS..Hα-helixtrans-45.8-34.6174.700000114.8I12A8-I12 WeakPolarHBondContact O-CD1 3.42Å; A8-I12 WeakPolarHBondContact O-CG1 3.33Å; A8-I12 PolarHBondContact O-N 3.3Å
9P72.3Confident68.3Low87 Ų8774.4 Ų74.457%0.56544%0.441SS*.Hα-helixtrans-67-35.6176.7-21.233.6000115.1G7 T13G7-P9 WeakPolarHBondContact O-CD 3.46Å; P9-T13 PolarHBondContact O-N 3.02Å; P9-T13 PolarHBondContact O-OG1 3.1Å
10E79.1Confident69.6Low123 Ų12377.9 Ų77.958%0.57545%0.45SS*.Hα-helixtrans-71-39.4-178.8-73.3169.8165.500110.5V6 G7 T13 Q14V6-E10 HydrophobicContact CG1-CB 3.41Å; V6-E10 VanDerWaalsContact CG1-CB 3.41Å; V6-E10 HydrophobicContact CG1-CG 4.43Å; V6-E10 VanDerWaalsContact CG1-OE2 3.32Å; V6-E10 WeakPolarHBondContact CG1-OE2 3.47Å; G7-E10 PolarHBondContact N-OE2 2.64Å; G7-E10 PolarHBondContact O-N 3.37Å; E10-T13 PolarHBondContact O-N 3.46Å; E10-Q14 PolarHBondContact O-N 3.31Å; E10-Q14 VanDerWaalsContact O-N 3.07Å
11V82.4Confident70.8Confident21 Ų2176.1 Ų76.113%0.12744%0.441CS..Hα-helixtrans-63.1-45.7174.3-178.30000111.2V6 G7 T13 Q14 L15 F44 I53V6-V11 HydrophobicContact CB-CG2 4.17Å; V6-V11 HydrophobicContact CG1-CG2 3.6Å; G7-V11 PolarHBondContact O-N 3.49Å; V11-T13 VanDerWaalsContact C-N 3.35Å; V11-T13 PolarHBondContact O-N 3.18Å; V11-Q14 PolarHBondContact O-N 3.19Å; V11-L15 HydrophobicContact CG1-CD1 3.87Å; V11-L15 HydrophobicContact CG1-CG 4.41Å; V11-L15 VanDerWaalsContact O-CG 3.31Å; V11-L15 WeakPolarHBondContact O-CG 3.5Å; V11-L15 PolarHBondContact O-N 2.68Å; V11-F44 HydrophobicContact CG1-CD2 4.41Å; V11-F44 HydrophobicContact CG1-CE2 4.44Å; V11-I53 HydrophobicContact CB-CD1 3.92Å; V11-I53 HydrophobicContact CG1-CD1 3.81Å; V11-I53 HydrophobicContact CG2-CD1 3.9Å
12I87.5Confident73.5Confident16 Ų1667.8 Ų67.88%0.08240%0.4CS..Hα-helixtrans-60-46.9177.5-69.7163.3000110.5A8 Q14 L15 E16 I57 T60A8-I12 WeakPolarHBondContact O-CD1 3.42Å; A8-I12 WeakPolarHBondContact O-CG1 3.33Å; A8-I12 PolarHBondContact O-N 3.3Å; I12-Q14 VanDerWaalsContact C-N 3.28Å; I12-Q14 PolarHBondContact O-N 2.91Å; I12-L15 PolarHBondContact O-N 3.29Å; I12-E16 HydrophobicContact CG2-CG 4.14Å; I12-E16 WeakPolarHBondContact O-CB 3.33Å; I12-E16 WeakPolarHBondContact O-CG 3.46Å; I12-E16 PolarHBondContact O-N 3.13Å; I12-I57 HydrophobicContact CD1-CG1 4.46Å; I12-I57 HydrophobicContact CG1-CG1 3.82Å; I12-T60 WeakPolarHBondContact CD1-OG1 3.41Å
13T88.9Confident76.7Confident88 Ų8864.4 Ų64.454%0.5438%0.383SS..Hα-helixtrans-61-39.3-178.4-53.50000111.6P9 E10 V11 S17P9-T13 PolarHBondContact O-N 3.02Å; P9-T13 PolarHBondContact O-OG1 3.1Å; E10-T13 PolarHBondContact O-N 3.46Å; V11-T13 VanDerWaalsContact C-N 3.35Å; V11-T13 PolarHBondContact O-N 3.18Å; T13-S17 WeakPolarHBondContact O-CB 3.4Å; T13-S17 PolarHBondContact O-N 3.15Å; T13-S17 PolarHBondContact O-OG 2.97Å
14Q92.5Very high79.7Confident82 Ų8258.6 Ų58.638%0.38336%0.36SS..Hα-helixtrans-69-39.8177.4-166.5-178.86.700112.4E10 V11 I12 S17 A18 V40E10-Q14 PolarHBondContact O-N 3.31Å; E10-Q14 VanDerWaalsContact O-N 3.07Å; V11-Q14 PolarHBondContact O-N 3.19Å; I12-Q14 VanDerWaalsContact C-N 3.28Å; I12-Q14 PolarHBondContact O-N 2.91Å; Q14-S17 PolarHBondContact O-OG 3.41Å; Q14-A18 WeakPolarHBondContact O-CB 3.43Å; Q14-A18 PolarHBondContact O-N 3.43Å; Q14-V40 HydrophobicContact CG-CG1 4.04Å; Q14-V40 HydrophobicContact CG-CG2 4.46Å
15L93.9Very high82.7Confident2 Ų257.2 Ų57.21%0.0134%0.343CS..Hα-helixtrans-68.3-40.2175.9-67.3167.9000111.3V11 I12 A18 A19 V40 F41 F44 I57 V66V11-L15 HydrophobicContact CG1-CD1 3.87Å; V11-L15 HydrophobicContact CG1-CG 4.41Å; V11-L15 VanDerWaalsContact O-CG 3.31Å; V11-L15 WeakPolarHBondContact O-CG 3.5Å; V11-L15 PolarHBondContact O-N 2.68Å; I12-L15 PolarHBondContact O-N 3.29Å; L15-A18 PolarHBondContact O-N 2.84Å; L15-A19 WeakPolarHBondContact O-CB 3.45Å; L15-A19 PolarHBondContact O-N 2.96Å; L15-V40 HydrophobicContact CD2-CG1 4.03Å; L15-F41 HydrophobicContact CB-CE1 4.06Å; L15-F41 HydrophobicContact CB-CZ 4.4Å; L15-F41 HydrophobicContact CD2-CD1 3.51Å; L15-F41 HydrophobicContact CD2-CE1 3.46Å; L15-F41 VanDerWaalsContact CD2-CE1 3.46Å; L15-F41 HydrophobicContact CD2-CG 4.4Å; L15-F41 HydrophobicContact CD2-CZ 4.3Å; L15-F41 HydrophobicContact CG-CE1 4.33Å; L15-F41 VanDerWaalsContact O-CZ 3.28Å; L15-F41 WeakPolarHBondContact O-CZ 3.47Å; L15-F44 HydrophobicContact CD1-CD1 4.35Å; L15-F44 HydrophobicContact CD1-CD2 4.22Å; L15-F44 HydrophobicContact CD1-CE1 4.29Å; L15-F44 HydrophobicContact CD1-CE2 4.17Å; L15-F44 HydrophobicContact CD1-CG 4.31Å; L15-F44 HydrophobicContact CD1-CZ 4.21Å; L15-F44 HydrophobicContact CD2-CB 4.1Å; L15-F44 HydrophobicContact CD2-CD1 4.14Å; L15-F44 HydrophobicContact CD2-CG 4.03Å; L15-I57 HydrophobicContact CD1-CD1 3.72Å; L15-V66 HydrophobicContact CB-CG1 3.92Å; L15-V66 HydrophobicContact CB-CG2 4.19Å; L15-V66 HydrophobicContact CD1-CG1 4.42Å; L15-V66 WeakPolarHBondContact O-CG2 3.45Å
16E94.4Very high85.1Confident47 Ų4757 Ų5722%0.2233%0.332CS..Hα-helixtrans-67.9-35.5177.4-71.6-174173.500112.5I12 K20 S61 V63 V66I12-E16 HydrophobicContact CG2-CG 4.14Å; I12-E16 WeakPolarHBondContact O-CB 3.33Å; I12-E16 WeakPolarHBondContact O-CG 3.46Å; I12-E16 PolarHBondContact O-N 3.13Å; E16-K20 WeakPolarHBondContact O-CG 3.49Å; E16-K20 PolarHBondContact O-N 3.05Å; E16-S61 PolarHBondContact OE1-OG 3Å; E16-V63 HydrophobicContact CB-CG2 4.19Å; E16-V63 HydrophobicContact CG-CB 4.16Å; E16-V63 HydrophobicContact CG-CG2 3.7Å; E16-V66 HydrophobicContact CB-CG2 4.48Å; E16-V66 HydrophobicContact CG-CG2 3.96Å
17S93.1Very high87.3Confident62 Ų6259.2 Ų59.243%0.43435%0.351SS..Hα-helixtrans-68.9-44.1173.268.40000111.5T13 Q14 A19 K20 V21T13-S17 WeakPolarHBondContact O-CB 3.4Å; T13-S17 PolarHBondContact O-N 3.15Å; T13-S17 PolarHBondContact O-OG 2.97Å; Q14-S17 PolarHBondContact O-OG 3.41Å; S17-A19 VanDerWaalsContact C-N 3.33Å; S17-A19 PolarHBondContact O-N 3.49Å; S17-K20 PolarHBondContact O-N 2.81Å; S17-V21 WeakPolarHBondContact O-CG2 3.29Å; S17-V21 PolarHBondContact O-N 2.83Å; S17-V21 VanDerWaalsContact O-N 3.16Å
18A94.3Very high88.9Confident5 Ų564.6 Ų64.64%0.04137%0.368CS..Hα-helixtrans-60.5-41.1174.700000112.1Q14 L15 K20 V21 L22 A37 V40 F41Q14-A18 WeakPolarHBondContact O-CB 3.43Å; Q14-A18 PolarHBondContact O-N 3.43Å; L15-A18 PolarHBondContact O-N 2.84Å; A18-K20 VanDerWaalsContact C-N 3.34Å; A18-K20 PolarHBondContact O-N 2.92Å; A18-V21 WeakPolarHBondContact O-CB 3.46Å; A18-V21 PolarHBondContact O-N 2.64Å; A18-L22 PolarHBondContact O-N 2.9Å; A18-A37 HydrophobicContact CB-CB 3.87Å; A18-V40 HydrophobicContact CB-CB 4.26Å; A18-V40 HydrophobicContact CB-CG1 4.13Å; A18-F41 HydrophobicContact CB-CD2 4.22Å; A18-F41 HydrophobicContact CB-CE2 3.67Å; A18-F41 HydrophobicContact CB-CZ 4.24Å
19A94.7Very high90.3Very high1 Ų164 Ų641%0.00836%0.361CS..Hα-helixtrans-59.6-43.2175.300000112.2L15 S17 V21 L22 M23 F41 V63 Y65 V66L15-A19 WeakPolarHBondContact O-CB 3.45Å; L15-A19 PolarHBondContact O-N 2.96Å; S17-A19 VanDerWaalsContact C-N 3.33Å; S17-A19 PolarHBondContact O-N 3.49Å; A19-V21 VanDerWaalsContact C-N 3.28Å; A19-V21 PolarHBondContact O-N 3.45Å; A19-L22 PolarHBondContact O-N 2.92Å; A19-M23 VanDerWaalsContact O-CB 3.28Å; A19-M23 WeakPolarHBondContact O-CB 3.27Å; A19-M23 VanDerWaalsContact O-CG 3.26Å; A19-M23 WeakPolarHBondContact O-CG 3.41Å; A19-M23 PolarHBondContact O-N 3.04Å; A19-F41 HydrophobicContact CB-CE2 4.44Å; A19-F41 HydrophobicContact CB-CZ 4.03Å; A19-V63 HydrophobicContact CB-CG1 3.84Å; A19-Y65 HydrophobicContact CB-CD1 3.87Å; A19-Y65 HydrophobicContact CB-CG 4.36Å; A19-V66 HydrophobicContact CB-CG2 3.69Å
20K93.6Very high91.2Very high143 Ų14363.7 Ų63.762%0.62235%0.354SS*.Hα-helixtrans-62.2-37176.7-71171.1-171.71750112E16 S17 A18 A24E16-K20 WeakPolarHBondContact O-CG 3.49Å; E16-K20 PolarHBondContact O-N 3.05Å; S17-K20 PolarHBondContact O-N 2.81Å; A18-K20 VanDerWaalsContact C-N 3.34Å; A18-K20 PolarHBondContact O-N 2.92Å; K20-A24 VanDerWaalsContact O-CB 3.31Å; K20-A24 WeakPolarHBondContact O-CB 3.35Å; K20-A24 PolarHBondContact O-N 3.45Å; K20-A24 VanDerWaalsContact O-N 3.1Å
21V94.2Very high91.8Very high42 Ų4262.6 Ų62.626%0.25536%0.356SS..Hα-helixtrans-68-46176.71750000111S17 A18 A19 A24 V29 Q33 A37S17-V21 WeakPolarHBondContact O-CG2 3.29Å; S17-V21 PolarHBondContact O-N 2.83Å; S17-V21 VanDerWaalsContact O-N 3.16Å; A18-V21 WeakPolarHBondContact O-CB 3.46Å; A18-V21 PolarHBondContact O-N 2.64Å; A19-V21 VanDerWaalsContact C-N 3.28Å; A19-V21 PolarHBondContact O-N 3.45Å; V21-A24 PolarHBondContact O-N 2.83Å; V21-V29 HydrophobicContact CG1-CG1 3.53Å; V21-Q33 HydrophobicContact CG1-CB 4.11Å; V21-A37 HydrophobicContact CB-CB 3.94Å; V21-A37 HydrophobicContact CG1-CB 3.83Å
22L92.5Very high92.3Very high23 Ų2368.8 Ų68.812%0.1238%0.383CS..Hα-helixtrans-70.6-31-179.2-69179000113.7A18 A19 R34 A37 E38 F41 Y65A18-L22 PolarHBondContact O-N 2.9Å; A19-L22 PolarHBondContact O-N 2.92Å; L22-R34 HydrophobicContact CD2-CG 3.8Å; L22-A37 HydrophobicContact CD1-CB 4.41Å; L22-A37 HydrophobicContact CD2-CB 4Å; L22-A37 HydrophobicContact CG-CB 3.82Å; L22-E38 HydrophobicContact CD2-CB 4.42Å; L22-F41 HydrophobicContact CD1-CD2 3.59Å; L22-F41 HydrophobicContact CD1-CE2 3.78Å; L22-Y65 HydrophobicContact CD1-CE1 3.9Å
23M93.3Very high92.4Very high119 Ų11972.8 Ų72.859%0.58640%0.402SS*.THydrogen-bonded Turntrans-91-5.1179.4-63.4-59.2-62.400113.7A19 Y65A19-M23 VanDerWaalsContact O-CB 3.28Å; A19-M23 WeakPolarHBondContact O-CB 3.27Å; A19-M23 VanDerWaalsContact O-CG 3.26Å; A19-M23 WeakPolarHBondContact O-CG 3.41Å; A19-M23 PolarHBondContact O-N 3.04Å; M23-Y65 HydrophobicContact CG-CD2 3.96Å; M23-Y65 HydrophobicContact CG-CG 4.07Å; M23-Y65 HydrophobicContact SD-CD2 3.4Å; M23-Y65 WeakPolarHBondContact SD-CD2 3.36Å; M23-Y65 HydrophobicContact SD-CE2 3.75Å; M23-Y65 HydrophobicContact SD-CG 4.13Å
24A92.4Very high92.6Very high31 Ų3174.1 Ų74.126%0.25640%0.397SS..SBendtrans-71.6154.6172.900000110.7K20 V21 V29K20-A24 VanDerWaalsContact O-CB 3.31Å; K20-A24 WeakPolarHBondContact O-CB 3.35Å; K20-A24 PolarHBondContact O-N 3.45Å; K20-A24 VanDerWaalsContact O-N 3.1Å; V21-A24 PolarHBondContact O-N 2.83Å; A24-V29 HydrophobicContact CB-CG2 3.66Å
25P92.8Very high92.5Very high68 Ų6875.8 Ų75.844%0.44241%0.405SS..  trans-52.1130173.9-2634.7000110.7S27 M28P25-S27 PolarHBondContact O-N 3.47Å; P25-M28 HydrophobicContact CB-CG 4.23Å; P25-M28 HydrophobicContact CB-SD 4.3Å; P25-M28 HydrophobicContact CG-SD 4.08Å; P25-M28 PolarHBondContact O-N 3.35Å
26P87.9Confident92.4Very high101 Ų10181.3 Ų81.366%0.65643%0.43SS*.G310 helixtrans-62.2-22.1-173.123.2-33.2000112.9M28P26-M28 VanDerWaalsContact C-N 3.26Å; P26-M28 PolarHBondContact O-N 3.37Å
27S91.8Very high92.3Very high110 Ų11079.2 Ų79.277%0.76942%0.421SS*.G310 helixtrans-71.3-14.817454.70000114.6P25P25-S27 PolarHBondContact O-N 3.47Å
28M91.9Very high92.2Very high149 Ų14980.9 Ų80.973%0.73442%0.422SS*.G310 helixtrans-106.1-1.3-175.8-62.4-174.6178.100113.6P25 P26P25-M28 HydrophobicContact CB-CG 4.23Å; P25-M28 HydrophobicContact CB-SD 4.3Å; P25-M28 HydrophobicContact CG-SD 4.08Å; P25-M28 PolarHBondContact O-N 3.35Å; P26-M28 VanDerWaalsContact C-N 3.26Å; P26-M28 PolarHBondContact O-N 3.37Å
29V93.2Very high92.1Very high24 Ų2486.3 Ų86.315%0.14545%0.446CS..SBendtrans-128.8130-177.3178.60000108.5V21 A24 Q33 R34V21-V29 HydrophobicContact CG1-CG1 3.53Å; A24-V29 HydrophobicContact CB-CG2 3.66Å; V29-Q33 HydrophobicContact CG1-CB 3.73Å; V29-R34 HydrophobicContact CG1-CB 4.21Å
30N91.9Very high92Very high80 Ų8086.8 Ų86.843%0.42845%0.449SS..  trans-76160.1178.468.827.5000111.8E32 Q33 R34N30-E32 VanDerWaalsContact C-N 3.25Å; N30-E32 PolarHBondContact O-N 2.87Å; N30-E32 PolarHBondContact OD1-N 2.93Å; N30-Q33 PolarHBondContact O-N 3.47Å; N30-Q33 WeakPolarHBondContact OD1-CB 3.47Å; N30-Q33 WeakPolarHBondContact OD1-CG 3.23Å; N30-Q33 PolarHBondContact OD1-N 3.37Å; N30-R34 PolarHBondContact O-N 3.09Å; N30-R34 VanDerWaalsContact O-N 3.11Å
31T91.5Very high91.9Very high101 Ų10180.1 Ų80.162%0.6242%0.42SS*.Hα-helixtrans-56.2-39.6-177.9-45.20000112.2R34 Q35T31-R34 PolarHBondContact O-N 3.06Å; T31-Q35 HydrophobicContact CG2-CG 4.39Å; T31-Q35 WeakPolarHBondContact O-CB 3.47Å; T31-Q35 VanDerWaalsContact O-CG 3.3Å; T31-Q35 WeakPolarHBondContact O-CG 3.45Å; T31-Q35 PolarHBondContact O-N 3.29Å
32E92.3Very high91.7Very high150 Ų15081.3 Ų81.370%0.70142%0.424SS*.Hα-helixtrans-64.5-44.9-179.7-65.1-177.5174.700112.6N30 R34 Q35 H36N30-E32 VanDerWaalsContact C-N 3.25Å; N30-E32 PolarHBondContact O-N 2.87Å; N30-E32 PolarHBondContact OD1-N 2.93Å; E32-R34 VanDerWaalsContact C-N 3.33Å; E32-R34 PolarHBondContact O-N 3.46Å; E32-Q35 PolarHBondContact O-N 3.13Å; E32-H36 VanDerWaalsContact O-CB 3.29Å; E32-H36 WeakPolarHBondContact O-CB 3.46Å; E32-H36 PolarHBondContact O-N 3.3Å
33Q90.5Very high91.4Very high100 Ų10082.6 Ų82.647%0.46744%0.436SS..Hα-helixtrans-63.8-40.9177-76.8171.9-15.100111.1V21 V29 N30 H36 A37V21-Q33 HydrophobicContact CG1-CB 4.11Å; V29-Q33 HydrophobicContact CG1-CB 3.73Å; N30-Q33 PolarHBondContact O-N 3.47Å; N30-Q33 WeakPolarHBondContact OD1-CB 3.47Å; N30-Q33 WeakPolarHBondContact OD1-CG 3.23Å; N30-Q33 PolarHBondContact OD1-N 3.37Å; Q33-H36 PolarHBondContact O-N 3.34Å; Q33-A37 WeakPolarHBondContact O-CB 3.49Å; Q33-A37 PolarHBondContact O-N 3.49Å
34R91.1Very high91.3Very high116 Ų11677.8 Ų77.844%0.43841%0.412SS..Hα-helixtrans-65.6-47177.8-167.7179.3160.491.6-0.2111.3L22 V29 N30 T31 E32 H36 A37 E38L22-R34 HydrophobicContact CD2-CG 3.8Å; V29-R34 HydrophobicContact CG1-CB 4.21Å; N30-R34 PolarHBondContact O-N 3.09Å; N30-R34 VanDerWaalsContact O-N 3.11Å; T31-R34 PolarHBondContact O-N 3.06Å; E32-R34 VanDerWaalsContact C-N 3.33Å; E32-R34 PolarHBondContact O-N 3.46Å; R34-H36 VanDerWaalsContact C-N 3.34Å; R34-H36 PolarHBondContact O-N 2.97Å; R34-A37 PolarHBondContact O-N 3.12Å; R34-E38 WeakPolarHBondContact O-CB 3.35Å; R34-E38 PolarHBondContact O-N 3.03Å
35Q91.9Very high91.1Very high117 Ų11778.8 Ų78.855%0.54741%0.409SS..Hα-helixtrans-61.6-40.5174.7-75.7176.2-9.400112T31 E32 E38 H39T31-Q35 HydrophobicContact CG2-CG 4.39Å; T31-Q35 WeakPolarHBondContact O-CB 3.47Å; T31-Q35 VanDerWaalsContact O-CG 3.3Å; T31-Q35 WeakPolarHBondContact O-CG 3.45Å; T31-Q35 PolarHBondContact O-N 3.29Å; E32-Q35 PolarHBondContact O-N 3.13Å; Q35-E38 PolarHBondContact O-N 2.85Å; Q35-H39 VanDerWaalsContact O-CB 3.28Å; Q35-H39 WeakPolarHBondContact O-CB 3.44Å; Q35-H39 PolarHBondContact O-N 3.48Å
36H91.9Very high90.7Very high118 Ų11881 Ų8155%0.54641%0.411SS..Hα-helixtrans-63.5-46.9176.2-177.172.1000111.5E32 Q33 R34 E38 H39 V40E32-H36 VanDerWaalsContact O-CB 3.29Å; E32-H36 WeakPolarHBondContact O-CB 3.46Å; E32-H36 PolarHBondContact O-N 3.3Å; Q33-H36 PolarHBondContact O-N 3.34Å; R34-H36 VanDerWaalsContact C-N 3.34Å; R34-H36 PolarHBondContact O-N 2.97Å; H36-E38 VanDerWaalsContact C-N 3.34Å; H36-E38 PolarHBondContact O-N 3.21Å; H36-H39 PolarHBondContact O-N 3.48Å; H36-V40 WeakPolarHBondContact O-CG2 3.29Å; H36-V40 PolarHBondContact O-N 2.87Å
37A91.3Very high90.6Very high3 Ų378.2 Ų78.23%0.02539%0.394CS..Hα-helixtrans-63-39.7177.900000112.2A18 V21 L22 Q33 R34 V40 F41A18-A37 HydrophobicContact CB-CB 3.87Å; V21-A37 HydrophobicContact CB-CB 3.94Å; V21-A37 HydrophobicContact CG1-CB 3.83Å; L22-A37 HydrophobicContact CD1-CB 4.41Å; L22-A37 HydrophobicContact CD2-CB 4Å; L22-A37 HydrophobicContact CG-CB 3.82Å; Q33-A37 WeakPolarHBondContact O-CB 3.49Å; Q33-A37 PolarHBondContact O-N 3.49Å; R34-A37 PolarHBondContact O-N 3.12Å; A37-V40 WeakPolarHBondContact O-CB 3.35Å; A37-V40 PolarHBondContact O-N 3.24Å; A37-F41 WeakPolarHBondContact O-CD2 3.5Å; A37-F41 PolarHBondContact O-N 3.01Å
38E91.5Very high90.3Very high98 Ų9880.5 Ų80.546%0.45839%0.39SS..Hα-helixtrans-63-47172.7-178.2175.5-168.700111.8L22 R34 Q35 H36 V40 F41 L42L22-E38 HydrophobicContact CD2-CB 4.42Å; R34-E38 WeakPolarHBondContact O-CB 3.35Å; R34-E38 PolarHBondContact O-N 3.03Å; Q35-E38 PolarHBondContact O-N 2.85Å; H36-E38 VanDerWaalsContact C-N 3.34Å; H36-E38 PolarHBondContact O-N 3.21Å; E38-V40 VanDerWaalsContact C-N 3.25Å; E38-V40 PolarHBondContact O-N 3.5Å; E38-F41 PolarHBondContact O-N 3.41Å; E38-L42 HydrophobicContact CG-CD1 3.88Å; E38-L42 HydrophobicContact CG-CG 4.21Å; E38-L42 WeakPolarHBondContact O-CG 3.42Å; E38-L42 PolarHBondContact O-N 2.73Å
39H91.7Very high90Very high118 Ų11876.8 Ų76.855%0.54638%0.379SS..Hα-helixtrans-58.8-36.7177179.1-84.2000112.1Q35 H36 L42 S43Q35-H39 VanDerWaalsContact O-CB 3.28Å; Q35-H39 WeakPolarHBondContact O-CB 3.44Å; Q35-H39 PolarHBondContact O-N 3.48Å; H36-H39 PolarHBondContact O-N 3.48Å; H39-L42 PolarHBondContact O-N 2.84Å; H39-S43 WeakPolarHBondContact O-CB 3.27Å; H39-S43 PolarHBondContact O-N 3.09Å; H39-S43 PolarHBondContact O-OG 2.98Å
40V92.9Very high89.9Confident11 Ų1175.7 Ų75.77%0.06737%0.373CS..Hα-helixtrans-58.3-47.3173.3168.90000111Q14 L15 A18 H36 A37 E38 S43 F44Q14-V40 HydrophobicContact CG-CG1 4.04Å; Q14-V40 HydrophobicContact CG-CG2 4.46Å; L15-V40 HydrophobicContact CD2-CG1 4.03Å; A18-V40 HydrophobicContact CB-CB 4.26Å; A18-V40 HydrophobicContact CB-CG1 4.13Å; H36-V40 WeakPolarHBondContact O-CG2 3.29Å; H36-V40 PolarHBondContact O-N 2.87Å; A37-V40 WeakPolarHBondContact O-CB 3.35Å; A37-V40 PolarHBondContact O-N 3.24Å; E38-V40 VanDerWaalsContact C-N 3.25Å; E38-V40 PolarHBondContact O-N 3.5Å; V40-S43 PolarHBondContact O-OG 3.36Å; V40-F44 VanDerWaalsContact O-CB 3.28Å; V40-F44 WeakPolarHBondContact O-CB 3.26Å; V40-F44 PolarHBondContact O-N 3.34Å
41F92.5Very high89.9Confident4 Ų472.9 Ų72.92%0.01836%0.357CS..Hα-helixtrans-70-41.2177.9-76.1-66.4000113.2L15 A18 A19 L22 A37 E38 F44 R45 Y65 V66 Q69L15-F41 HydrophobicContact CB-CE1 4.06Å; L15-F41 HydrophobicContact CB-CZ 4.4Å; L15-F41 HydrophobicContact CD2-CD1 3.51Å; L15-F41 HydrophobicContact CD2-CE1 3.46Å; L15-F41 VanDerWaalsContact CD2-CE1 3.46Å; L15-F41 HydrophobicContact CD2-CG 4.4Å; L15-F41 HydrophobicContact CD2-CZ 4.3Å; L15-F41 HydrophobicContact CG-CE1 4.33Å; L15-F41 VanDerWaalsContact O-CZ 3.28Å; L15-F41 WeakPolarHBondContact O-CZ 3.47Å; A18-F41 HydrophobicContact CB-CD2 4.22Å; A18-F41 HydrophobicContact CB-CE2 3.67Å; A18-F41 HydrophobicContact CB-CZ 4.24Å; A19-F41 HydrophobicContact CB-CE2 4.44Å; A19-F41 HydrophobicContact CB-CZ 4.03Å; L22-F41 HydrophobicContact CD1-CD2 3.59Å; L22-F41 HydrophobicContact CD1-CE2 3.78Å; A37-F41 WeakPolarHBondContact O-CD2 3.5Å; A37-F41 PolarHBondContact O-N 3.01Å; E38-F41 PolarHBondContact O-N 3.41Å; F41-F44 PolarHBondContact O-N 3.42Å; F41-R45 WeakPolarHBondContact O-CB 3.11Å; F41-R45 WeakPolarHBondContact O-CG 3.36Å; F41-R45 PolarHBondContact O-N 3.08Å; F41-Y65 HydrophobicContact CD2-CE1 4.11Å; F41-Y65 AromaticContact CE2-CD1 3.99Å; F41-Y65 HydrophobicContact CE2-CD1 3.99Å; F41-Y65 AromaticContact CE2-CE1 3.68Å; F41-Y65 HydrophobicContact CE2-CE1 3.68Å; F41-Y65 AromaticContact CZ-CD1 3.87Å; F41-Y65 HydrophobicContact CZ-CD1 3.87Å; F41-Y65 AromaticContact CZ-CE1 3.97Å; F41-Y65 HydrophobicContact CZ-CE1 3.97Å; F41-V66 HydrophobicContact CZ-CG2 4.3Å; F41-Q69 HydrophobicContact CD1-CB 3.47Å; F41-Q69 VanDerWaalsContact CD1-CB 3.47Å; F41-Q69 HydrophobicContact CD1-CG 3.46Å; F41-Q69 VanDerWaalsContact CD1-CG 3.46Å; F41-Q69 HydrophobicContact CE1-CB 3.6Å; F41-Q69 HydrophobicContact CE1-CG 3.61Å; F41-Q69 HydrophobicContact CG-CB 4.39Å; F41-Q69 HydrophobicContact CG-CG 3.95Å; F41-Q69 HydrophobicContact CZ-CG 4.21Å
42L88.1Confident89.9Confident66 Ų6671.9 Ų71.935%0.34636%0.358SS..Hα-helixtrans-64.3-43.5178.4-69.9177.4000111.6E38 H39 R45 K46E38-L42 HydrophobicContact CG-CD1 3.88Å; E38-L42 HydrophobicContact CG-CG 4.21Å; E38-L42 WeakPolarHBondContact O-CG 3.42Å; E38-L42 PolarHBondContact O-N 2.73Å; H39-L42 PolarHBondContact O-N 2.84Å; L42-R45 PolarHBondContact O-N 2.99Å; L42-K46 WeakPolarHBondContact O-CB 3.4Å; L42-K46 VanDerWaalsContact O-CG 3.31Å; L42-K46 WeakPolarHBondContact O-CG 3.39Å; L42-K46 PolarHBondContact O-N 3.38Å; L42-K46 VanDerWaalsContact O-N 3.07Å
43S87.8Confident89.8Confident51 Ų5166.9 Ų66.936%0.35734%0.336SS..Hα-helixtrans-65.7-39.7175.860.30000112H39 V40 K46 S47H39-S43 WeakPolarHBondContact O-CB 3.27Å; H39-S43 PolarHBondContact O-N 3.09Å; H39-S43 PolarHBondContact O-OG 2.98Å; V40-S43 PolarHBondContact O-OG 3.36Å; S43-K46 PolarHBondContact O-N 2.82Å; S43-S47 PolarHBondContact O-N 3.34Å
44F90.9Very high90Very high18 Ų1862.1 Ų62.18%0.07931%0.314CS..Hα-helixtrans-59.8-48.1173170.4-108.4000112.2V11 L15 V40 F41 K46 S47 I53 I57 A73V11-F44 HydrophobicContact CG1-CD2 4.41Å; V11-F44 HydrophobicContact CG1-CE2 4.44Å; L15-F44 HydrophobicContact CD1-CD1 4.35Å; L15-F44 HydrophobicContact CD1-CD2 4.22Å; L15-F44 HydrophobicContact CD1-CE1 4.29Å; L15-F44 HydrophobicContact CD1-CE2 4.17Å; L15-F44 HydrophobicContact CD1-CG 4.31Å; L15-F44 HydrophobicContact CD1-CZ 4.21Å; L15-F44 HydrophobicContact CD2-CB 4.1Å; L15-F44 HydrophobicContact CD2-CD1 4.14Å; L15-F44 HydrophobicContact CD2-CG 4.03Å; V40-F44 VanDerWaalsContact O-CB 3.28Å; V40-F44 WeakPolarHBondContact O-CB 3.26Å; V40-F44 PolarHBondContact O-N 3.34Å; F41-F44 PolarHBondContact O-N 3.42Å; F44-K46 VanDerWaalsContact C-N 3.28Å; F44-K46 PolarHBondContact O-N 3.44Å; F44-S47 VanDerWaalsContact O-CB 3.25Å; F44-S47 WeakPolarHBondContact O-CB 3.42Å; F44-S47 PolarHBondContact O-N 2.98Å; F44-S47 VanDerWaalsContact O-N 3.07Å; F44-S47 PolarHBondContact O-OG 3.35Å; F44-I53 HydrophobicContact CE2-CG2 3.95Å; F44-I53 HydrophobicContact CZ-CG2 4.42Å; F44-I57 HydrophobicContact CE1-CD1 4.41Å; F44-I57 HydrophobicContact CE2-CD1 3.97Å; F44-I57 HydrophobicContact CZ-CD1 3.55Å; F44-A73 HydrophobicContact CD1-CB 4.13Å; F44-A73 HydrophobicContact CE1-CB 3.62Å; F44-A73 HydrophobicContact CZ-CB 4.29Å
45R87.9Confident90.1Very high51 Ų5159.2 Ų59.219%0.19230%0.304CS..Hα-helixtrans-62.1-33.4178.2-79.6163.357.9-172.1-0.4113.6F41 L42 S47 A73 E76 R80F41-R45 WeakPolarHBondContact O-CB 3.11Å; F41-R45 WeakPolarHBondContact O-CG 3.36Å; F41-R45 PolarHBondContact O-N 3.08Å; L42-R45 PolarHBondContact O-N 2.99Å; R45-S47 VanDerWaalsContact C-N 3.31Å; R45-A73 HydrophobicContact CB-CB 4.48Å; R45-A73 HydrophobicContact CG-CB 3.84Å; R45-E76 WeakPolarHBondContact CB-OE2 3.45Å; R45-E76 IonicContact CZ-OE1 2.73Å; R45-E76 IonicContact CZ-OE2 2.83Å; R45-E76 IonicContact NE-OE1 3.23Å; R45-E76 PolarHBondContact NE-OE1 3.44Å; R45-E76 IonicContact NE-OE2 3.22Å; R45-E76 PolarHBondContact NE-OE2 3.5Å; R45-E76 IonicContact NH2-OE1 3.94Å; R45-E76 PolarHBondContact NH2-OE1 3.39Å; R45-E76 IonicContact NH2-OE2 2.95Å; R45-R80 PolarHBondContact O-NH1 3.01Å; R45-R80 PolarHBondContact O-NH2 3.34Å
46K83.9Confident90.1Very high115 Ų11557 Ų5750%0.529%0.294SS..THydrogen-bonded Turntrans-79.2-7.7175.7-71.4179.8177.3-168.30114.2L42 S43 F44L42-K46 WeakPolarHBondContact O-CB 3.4Å; L42-K46 VanDerWaalsContact O-CG 3.31Å; L42-K46 WeakPolarHBondContact O-CG 3.39Å; L42-K46 PolarHBondContact O-N 3.38Å; L42-K46 VanDerWaalsContact O-N 3.07Å; S43-K46 PolarHBondContact O-N 2.82Å; F44-K46 VanDerWaalsContact C-N 3.28Å; F44-K46 PolarHBondContact O-N 3.44Å
47S86.5Confident90.2Very high42 Ų4251.4 Ų51.429%0.29427%0.268SS..SBendtrans-63.6153.8-179.569.30000112.3S43 F44 R45 P50 R80S43-S47 PolarHBondContact O-N 3.34Å; F44-S47 VanDerWaalsContact O-CB 3.25Å; F44-S47 WeakPolarHBondContact O-CB 3.42Å; F44-S47 PolarHBondContact O-N 2.98Å; F44-S47 VanDerWaalsContact O-N 3.07Å; F44-S47 PolarHBondContact O-OG 3.35Å; R45-S47 VanDerWaalsContact C-N 3.31Å; S47-P50 WeakPolarHBondContact O-CD 3.25Å; S47-R80 PolarHBondContact O-NH2 3.25Å
48K84.2Confident90.4Very high158 Ų15851.4 Ų51.469%0.68727%0.267SS*.SBendtrans-80133.4-179.8-68.6-168174.1-163.80110.7E81K48-E81 WeakPolarHBondContact CA-OE1 3.37Å
49S86.8Confident90.5Very high71 Ų7152.1 Ų52.150%0.49727%0.271SS..SBendtrans48.454.9178-153.20000114.7F51 E81S49-F51 PolarHBondContact O-N 2.88Å; S49-E81 VanDerWaalsContact CA-OE2 3.28Å; S49-E81 WeakPolarHBondContact CA-OE2 3.34Å; S49-E81 PolarHBondContact N-OE1 2.72Å; S49-E81 PolarHBondContact N-OE2 3.17Å; S49-E81 VanDerWaalsContact N-OE2 3.15Å
50P90.8Very high90.5Very high2 Ų249.6 Ų49.61%0.01326%0.264CS..THydrogen-bonded Turntrans-73.54-177.132.5-35.5000113.8S47 A52 I53 C54 A77S47-P50 WeakPolarHBondContact O-CD 3.25Å; P50-A52 PolarHBondContact O-N 3.07Å; P50-I53 HydrophobicContact CB-CG2 4.18Å; P50-I53 WeakPolarHBondContact O-CG2 3.22Å; P50-I53 PolarHBondContact O-N 2.75Å; P50-C54 WeakPolarHBondContact O-CB 3.44Å; P50-C54 PolarHBondContact O-N 3.34Å; P50-C54 PolarHBondContact O-SG 3.07Å; P50-A77 HydrophobicContact CG-CB 3.42Å; P50-A77 VanDerWaalsContact CG-CB 3.42Å
51F92.4Very high90.5Very high21 Ų2149.5 Ų49.59%0.09226%0.264CS..Hα-helixtrans-60.6-46-169.1-51.5-71000113.5S49 C54 K55 A77 V78 E81 L85 L93S49-F51 PolarHBondContact O-N 2.88Å; F51-C54 PolarHBondContact O-N 3.04Å; F51-K55 WeakPolarHBondContact O-CG 3.39Å; F51-K55 PolarHBondContact O-N 3.12Å; F51-A77 HydrophobicContact CE1-CB 3.75Å; F51-A77 HydrophobicContact CZ-CB 3.7Å; F51-V78 HydrophobicContact CE1-CB 3.99Å; F51-E81 WeakPolarHBondContact CE2-OE2 3.49Å; F51-L85 HydrophobicContact CD2-CD2 4.31Å; F51-L85 HydrophobicContact CE1-CD1 4.44Å; F51-L85 HydrophobicContact CE2-CD1 4.16Å; F51-L85 HydrophobicContact CE2-CD2 3.73Å; F51-L85 HydrophobicContact CE2-CG 4.49Å; F51-L85 HydrophobicContact CZ-CD1 3.8Å; F51-L85 HydrophobicContact CZ-CD2 4.25Å; F51-L93 HydrophobicContact CD1-CD2 3.76Å; F51-L93 HydrophobicContact CE1-CD2 4.16Å
52A90.5Very high90.5Very high79 Ų7958.5 Ų58.565%0.65330%0.303SS*.Hα-helixtrans-67.1-41.2-17900000112.1P50 K55 H56P50-A52 PolarHBondContact O-N 3.07Å; A52-K55 PolarHBondContact O-N 2.63Å; A52-H56 PolarHBondContact O-N 2.88Å
53I91.1Very high90.9Very high46 Ų4657.2 Ų57.224%0.23630%0.297CS..Hα-helixtrans-70.7-36.4178.6-164.4160000111.5V11 F44 P50 H56 I57V11-I53 HydrophobicContact CB-CD1 3.92Å; V11-I53 HydrophobicContact CG1-CD1 3.81Å; V11-I53 HydrophobicContact CG2-CD1 3.9Å; F44-I53 HydrophobicContact CE2-CG2 3.95Å; F44-I53 HydrophobicContact CZ-CG2 4.42Å; P50-I53 HydrophobicContact CB-CG2 4.18Å; P50-I53 WeakPolarHBondContact O-CG2 3.22Å; P50-I53 PolarHBondContact O-N 2.75Å; I53-H56 WeakPolarHBondContact O-CB 3.37Å; I53-H56 PolarHBondContact O-N 3.34Å; I53-I57 HydrophobicContact CG1-CD1 4.16Å; I53-I57 WeakPolarHBondContact O-CD1 3.4Å; I53-I57 VanDerWaalsContact O-CG1 3.25Å; I53-I57 WeakPolarHBondContact O-CG1 3.33Å; I53-I57 PolarHBondContact O-N 2.99Å
54C94.7Very high91.2Very high0 Ų057.5 Ų57.50%030%0.295CS..Hα-helixtrans-65.8-40.9173.9-66.80000112P50 F51 H56 I57 L58 A70 V74P50-C54 WeakPolarHBondContact O-CB 3.44Å; P50-C54 PolarHBondContact O-N 3.34Å; P50-C54 PolarHBondContact O-SG 3.07Å; F51-C54 PolarHBondContact O-N 3.04Å; C54-H56 VanDerWaalsContact C-N 3.3Å; C54-H56 PolarHBondContact O-N 3.38Å; C54-I57 PolarHBondContact O-N 3.1Å; C54-L58 WeakPolarHBondContact O-CB 3.31Å; C54-L58 VanDerWaalsContact O-CG 3.28Å; C54-L58 WeakPolarHBondContact O-CG 3.28Å; C54-L58 PolarHBondContact O-N 2.85Å; C54-A70 HydrophobicContact CB-CB 4.38Å; C54-V74 HydrophobicContact CB-CG2 3.38Å
55K93.3Very high91.5Very high55 Ų5559.2 Ų59.224%0.23930%0.302CS..Hα-helixtrans-57.4-46.2172.2-73.7-176.7-178.4-174.30110.9F51 A52 L58 E59 F96F51-K55 WeakPolarHBondContact O-CG 3.39Å; F51-K55 PolarHBondContact O-N 3.12Å; A52-K55 PolarHBondContact O-N 2.63Å; K55-L58 PolarHBondContact O-N 3.28Å; K55-E59 WeakPolarHBondContact O-CG 3.34Å; K55-E59 PolarHBondContact O-N 3.42Å; K55-E59 VanDerWaalsContact O-N 3.07Å; K55-F96 HydrophobicContact CB-CE1 4.27Å; K55-F96 HydrophobicContact CB-CZ 4.07Å; K55-F96 HydrophobicContact CD-CD1 4.38Å; K55-F96 HydrophobicContact CD-CG 4.43Å; K55-F96 HydrophobicContact CG-CD1 3.98Å; K55-F96 HydrophobicContact CG-CE1 3.7Å; K55-F96 HydrophobicContact CG-CE2 4.43Å; K55-F96 HydrophobicContact CG-CG 4.47Å; K55-F96 HydrophobicContact CG-CZ 3.94Å
56H92.2Very high91.9Very high71 Ų7156.9 Ų56.933%0.32929%0.293SS..Hα-helixtrans-61.3-48.5176.7-17164000112.1A52 I53 C54 L58 E59 T60A52-H56 PolarHBondContact O-N 2.88Å; I53-H56 WeakPolarHBondContact O-CB 3.37Å; I53-H56 PolarHBondContact O-N 3.34Å; C54-H56 VanDerWaalsContact C-N 3.3Å; C54-H56 PolarHBondContact O-N 3.38Å; H56-L58 VanDerWaalsContact C-N 3.32Å; H56-L58 PolarHBondContact O-N 3.46Å; H56-E59 PolarHBondContact O-N 3.47Å; H56-E59 VanDerWaalsContact O-N 3.1Å; H56-T60 PolarHBondContact O-N 2.67Å; H56-T60 PolarHBondContact O-OG1 3.14Å
57I94.1Very high92.5Very high0 Ų051.7 Ų51.70%027%0.27CS..Hα-helixtrans-56.1-46.2176.9-71.3160.9000111.1I12 L15 F44 I53 C54 E59 T60 S61 V66 A70I12-I57 HydrophobicContact CD1-CG1 4.46Å; I12-I57 HydrophobicContact CG1-CG1 3.82Å; L15-I57 HydrophobicContact CD1-CD1 3.72Å; F44-I57 HydrophobicContact CE1-CD1 4.41Å; F44-I57 HydrophobicContact CE2-CD1 3.97Å; F44-I57 HydrophobicContact CZ-CD1 3.55Å; I53-I57 HydrophobicContact CG1-CD1 4.16Å; I53-I57 WeakPolarHBondContact O-CD1 3.4Å; I53-I57 VanDerWaalsContact O-CG1 3.25Å; I53-I57 WeakPolarHBondContact O-CG1 3.33Å; I53-I57 PolarHBondContact O-N 2.99Å; C54-I57 PolarHBondContact O-N 3.1Å; I57-E59 VanDerWaalsContact C-N 3.27Å; I57-E59 PolarHBondContact O-N 3.5Å; I57-T60 PolarHBondContact O-N 3.24Å; I57-S61 WeakPolarHBondContact O-CB 3.38Å; I57-S61 PolarHBondContact O-N 3Å; I57-V66 HydrophobicContact CG2-CG1 3.64Å; I57-A70 HydrophobicContact CB-CB 4.23Å; I57-A70 HydrophobicContact CG2-CB 3.73Å
58L94.6Very high92.9Very high2 Ų252.1 Ų52.11%0.0127%0.267CS..Hα-helixtrans-61.3-37.1178.9-73.8170.4000111.8C54 K55 H56 L67 A70 F96 L97 Y100 I115C54-L58 WeakPolarHBondContact O-CB 3.31Å; C54-L58 VanDerWaalsContact O-CG 3.28Å; C54-L58 WeakPolarHBondContact O-CG 3.28Å; C54-L58 PolarHBondContact O-N 2.85Å; K55-L58 PolarHBondContact O-N 3.28Å; H56-L58 VanDerWaalsContact C-N 3.32Å; H56-L58 PolarHBondContact O-N 3.46Å; L58-L67 HydrophobicContact CD2-CB 4.23Å; L58-L67 HydrophobicContact CD2-CD2 4.11Å; L58-A70 HydrophobicContact CD2-CB 4.43Å; L58-A70 HydrophobicContact CG-CB 4.36Å; L58-F96 HydrophobicContact CD1-CE1 3.95Å; L58-L97 HydrophobicContact CD1-CD2 4.1Å; L58-Y100 HydrophobicContact CB-CD2 4.3Å; L58-Y100 HydrophobicContact CB-CE2 3.74Å; L58-Y100 WeakPolarHBondContact O-CE2 3.22Å; L58-Y100 VanDerWaalsContact O-CZ 3.24Å; L58-Y100 PolarHBondContact O-OH 2.99Å; L58-I115 HydrophobicContact CD2-CD1 4.19Å
59E93.4Very high93.4Very high113 Ų11345.1 Ų45.153%0.52824%0.237SC..Hα-helixtrans-78.8-28.9180-70.6175.3162.100113.7K55 H56 I57 F96K55-E59 WeakPolarHBondContact O-CG 3.34Å; K55-E59 PolarHBondContact O-N 3.42Å; K55-E59 VanDerWaalsContact O-N 3.07Å; H56-E59 PolarHBondContact O-N 3.47Å; H56-E59 VanDerWaalsContact O-N 3.1Å; I57-E59 VanDerWaalsContact C-N 3.27Å; I57-E59 PolarHBondContact O-N 3.5Å; E59-F96 HydrophobicContact CG-CE2 4.37Å; E59-F96 HydrophobicContact CG-CZ 4.34Å; E59-F96 WeakPolarHBondContact OE1-CE2 3.42Å
60T91.9Very high93.8Very high65 Ų6541.8 Ų41.840%0.39921%0.214SC..Hα-helixtrans-110.8-37.4-170.361.50000115.7I12 H56 I57I12-T60 WeakPolarHBondContact CD1-OG1 3.41Å; H56-T60 PolarHBondContact O-N 2.67Å; H56-T60 PolarHBondContact O-OG1 3.14Å; I57-T60 PolarHBondContact O-N 3.24Å
61S93Very high94.1Very high10 Ų1041.7 Ų41.77%0.0721%0.213CC..  trans-73.1146.6-175.7-174.10000110.8E16 I57 V63E16-S61 PolarHBondContact OE1-OG 3Å; I57-S61 WeakPolarHBondContact O-CB 3.38Å; I57-S61 PolarHBondContact O-N 3Å; S61-V63 PolarHBondContact OG-N 3.35Å
62K92.4Very high94.1Very high192 Ų19241 Ų4184%0.83521%0.211SC*.  trans-110.74.6175.8-63.2-175.4179.7-179.40112.7
63V95.6Very high94.1Very high39 Ų3937.3 Ų37.324%0.23618%0.18CC..  trans-95107.4-179.4-178.20000108.5E16 A19 S61 Y65 V66 L67E16-V63 HydrophobicContact CB-CG2 4.19Å; E16-V63 HydrophobicContact CG-CB 4.16Å; E16-V63 HydrophobicContact CG-CG2 3.7Å; A19-V63 HydrophobicContact CB-CG1 3.84Å; S61-V63 PolarHBondContact OG-N 3.35Å; V63-Y65 PolarHBondContact O-N 3.12Å; V63-Y65 VanDerWaalsContact O-N 3.16Å; V63-V66 HydrophobicContact CB-CB 4.21Å; V63-V66 HydrophobicContact CB-CG2 3.9Å; V63-V66 HydrophobicContact CG1-CB 4.47Å; V63-V66 HydrophobicContact CG1-CG2 3.85Å; V63-V66 WeakPolarHBondContact O-CA 3.3Å; V63-V66 WeakPolarHBondContact O-CB 3.39Å; V63-V66 PolarHBondContact O-N 3.43Å; V63-L67 PolarHBondContact O-N 2.9Å; V63-L67 VanDerWaalsContact O-N 3.13Å
64D95.9Very high94.2Very high58 Ų5835.1 Ų35.131%0.3117%0.169SC..Hα-helixtrans-55.2-37.2-173.5-65.8-43.9000113.5V66 L67 F68 Q108 Y110 V111D64-V66 VanDerWaalsContact C-N 3.31Å; D64-V66 PolarHBondContact O-N 3.24Å; D64-L67 WeakPolarHBondContact O-CB 3.4Å; D64-L67 PolarHBondContact O-N 3.48Å; D64-F68 PolarHBondContact O-N 3.01Å; D64-Q108 HydrophobicContact CB-CB 4.24Å; D64-Q108 HydrophobicContact CB-CG 4.27Å; D64-Y110 HydrophobicContact CB-CE2 4.24Å; D64-Y110 WeakPolarHBondContact CB-OH 3.25Å; D64-V111 HydrophobicContact CB-CG2 3.95Å; D64-V111 VanDerWaalsContact O-CG2 3.31Å; D64-V111 WeakPolarHBondContact O-CG2 3.36Å
65Y95.6Very high94Very high54 Ų5436.7 Ų36.721%0.21218%0.176CC..Hα-helixtrans-63.5-36.1176-167-90.9000112.5A19 L22 M23 F41 V63 F68 Q69 Y110A19-Y65 HydrophobicContact CB-CD1 3.87Å; A19-Y65 HydrophobicContact CB-CG 4.36Å; L22-Y65 HydrophobicContact CD1-CE1 3.9Å; M23-Y65 HydrophobicContact CG-CD2 3.96Å; M23-Y65 HydrophobicContact CG-CG 4.07Å; M23-Y65 HydrophobicContact SD-CD2 3.4Å; M23-Y65 WeakPolarHBondContact SD-CD2 3.36Å; M23-Y65 HydrophobicContact SD-CE2 3.75Å; M23-Y65 HydrophobicContact SD-CG 4.13Å; F41-Y65 HydrophobicContact CD2-CE1 4.11Å; F41-Y65 AromaticContact CE2-CD1 3.99Å; F41-Y65 HydrophobicContact CE2-CD1 3.99Å; F41-Y65 AromaticContact CE2-CE1 3.68Å; F41-Y65 HydrophobicContact CE2-CE1 3.68Å; F41-Y65 AromaticContact CZ-CD1 3.87Å; F41-Y65 HydrophobicContact CZ-CD1 3.87Å; F41-Y65 AromaticContact CZ-CE1 3.97Å; F41-Y65 HydrophobicContact CZ-CE1 3.97Å; V63-Y65 PolarHBondContact O-N 3.12Å; V63-Y65 VanDerWaalsContact O-N 3.16Å; Y65-F68 PolarHBondContact O-N 3.14Å; Y65-Q69 HydrophobicContact CD1-CG 3.97Å; Y65-Q69 HydrophobicContact CE1-CG 3.69Å; Y65-Q69 VanDerWaalsContact O-CG 3.31Å; Y65-Q69 WeakPolarHBondContact O-CG 3.44Å; Y65-Q69 PolarHBondContact O-N 3.27Å; Y65-Q69 PolarHBondContact OH-NE2 3.42Å; Y65-Y110 PolarHBondContact N-OH 3.07Å
66V96.3Very high93.6Very high1 Ų135.9 Ų35.91%0.00617%0.173CC..Hα-helixtrans-69.9-38.7175.7178.60000110.5L15 E16 A19 F41 I57 V63 D64 F68 Q69 A70L15-V66 HydrophobicContact CB-CG1 3.92Å; L15-V66 HydrophobicContact CB-CG2 4.19Å; L15-V66 HydrophobicContact CD1-CG1 4.42Å; L15-V66 WeakPolarHBondContact O-CG2 3.45Å; E16-V66 HydrophobicContact CB-CG2 4.48Å; E16-V66 HydrophobicContact CG-CG2 3.96Å; A19-V66 HydrophobicContact CB-CG2 3.69Å; F41-V66 HydrophobicContact CZ-CG2 4.3Å; I57-V66 HydrophobicContact CG2-CG1 3.64Å; V63-V66 HydrophobicContact CB-CB 4.21Å; V63-V66 HydrophobicContact CB-CG2 3.9Å; V63-V66 HydrophobicContact CG1-CB 4.47Å; V63-V66 HydrophobicContact CG1-CG2 3.85Å; V63-V66 WeakPolarHBondContact O-CA 3.3Å; V63-V66 WeakPolarHBondContact O-CB 3.39Å; V63-V66 PolarHBondContact O-N 3.43Å; D64-V66 VanDerWaalsContact C-N 3.31Å; D64-V66 PolarHBondContact O-N 3.24Å; V66-F68 VanDerWaalsContact C-N 3.35Å; V66-Q69 PolarHBondContact O-N 2.91Å; V66-A70 WeakPolarHBondContact O-CB 3.35Å; V66-A70 PolarHBondContact O-N 3.17Å
67L96.7Very high93.4Very high6 Ų632.5 Ų32.53%0.03116%0.158CC..Hα-helixtrans-61.9-43.1173.8-57.4178.1000111.4L58 V63 D64 A70 A71 L107 V111L58-L67 HydrophobicContact CD2-CB 4.23Å; L58-L67 HydrophobicContact CD2-CD2 4.11Å; V63-L67 PolarHBondContact O-N 2.9Å; V63-L67 VanDerWaalsContact O-N 3.13Å; D64-L67 WeakPolarHBondContact O-CB 3.4Å; D64-L67 PolarHBondContact O-N 3.48Å; L67-A70 PolarHBondContact O-N 2.88Å; L67-A71 PolarHBondContact O-N 3.35Å; L67-L107 HydrophobicContact CD1-CD1 4.25Å; L67-V111 HydrophobicContact CB-CG1 3.59Å; L67-V111 HydrophobicContact CB-CG2 4.27Å; L67-V111 HydrophobicContact CD1-CG1 4.42Å
68F96.2Very high93Very high52 Ų5232.5 Ų32.523%0.22816%0.158CC..Hα-helixtrans-59.5-49.5174.2176.4-92.5000111.6D64 Y65 V66 A70 A71 T72 Y110 V111 Q114D64-F68 PolarHBondContact O-N 3.01Å; Y65-F68 PolarHBondContact O-N 3.14Å; V66-F68 VanDerWaalsContact C-N 3.35Å; F68-A70 VanDerWaalsContact C-N 3.31Å; F68-A70 PolarHBondContact O-N 3.42Å; F68-A71 WeakPolarHBondContact O-CB 3.48Å; F68-A71 PolarHBondContact O-N 3.06Å; F68-T72 PolarHBondContact O-N 2.9Å; F68-T72 PolarHBondContact O-OG1 3.41Å; F68-Y110 HydrophobicContact CB-CD2 4.06Å; F68-Y110 HydrophobicContact CB-CE2 3.89Å; F68-Y110 AromaticContact CD2-CD2 3.77Å; F68-Y110 HydrophobicContact CD2-CD2 3.77Å; F68-Y110 HydrophobicContact CD2-CE2 4.42Å; F68-Y110 HydrophobicContact CG-CD2 4.15Å; F68-Y110 HydrophobicContact CG-CE2 4.35Å; F68-V111 HydrophobicContact CB-CG2 4.38Å; F68-Q114 HydrophobicContact CD2-CB 3.51Å; F68-Q114 HydrophobicContact CD2-CG 3.58Å; F68-Q114 HydrophobicContact CE2-CB 3.61Å; F68-Q114 HydrophobicContact CE2-CG 3.51Å; F68-Q114 HydrophobicContact CG-CG 4.32Å; F68-Q114 HydrophobicContact CZ-CG 4.18Å
69Q94.5Very high92.4Very high11 Ų1133.2 Ų33.25%0.05116%0.162CC..Hα-helixtrans-66-32.4178.8-67.5-67.1-21.500112.7F41 Y65 V66 T72 A73F41-Q69 HydrophobicContact CD1-CB 3.47Å; F41-Q69 VanDerWaalsContact CD1-CB 3.47Å; F41-Q69 HydrophobicContact CD1-CG 3.46Å; F41-Q69 VanDerWaalsContact CD1-CG 3.46Å; F41-Q69 HydrophobicContact CE1-CB 3.6Å; F41-Q69 HydrophobicContact CE1-CG 3.61Å; F41-Q69 HydrophobicContact CG-CB 4.39Å; F41-Q69 HydrophobicContact CG-CG 3.95Å; F41-Q69 HydrophobicContact CZ-CG 4.21Å; Y65-Q69 HydrophobicContact CD1-CG 3.97Å; Y65-Q69 HydrophobicContact CE1-CG 3.69Å; Y65-Q69 VanDerWaalsContact O-CG 3.31Å; Y65-Q69 WeakPolarHBondContact O-CG 3.44Å; Y65-Q69 PolarHBondContact O-N 3.27Å; Y65-Q69 PolarHBondContact OH-NE2 3.42Å; V66-Q69 PolarHBondContact O-N 2.91Å; Q69-T72 PolarHBondContact O-N 3.27Å; Q69-A73 WeakPolarHBondContact O-CB 3.43Å; Q69-A73 PolarHBondContact O-N 3.12Å
70A95.6Very high91.8Very high1 Ų129.3 Ų29.31%0.00814%0.142CC..Hα-helixtrans-66.4-42.7172.200000111.9C54 I57 L58 V66 L67 F68 A73 V74C54-A70 HydrophobicContact CB-CB 4.38Å; I57-A70 HydrophobicContact CB-CB 4.23Å; I57-A70 HydrophobicContact CG2-CB 3.73Å; L58-A70 HydrophobicContact CD2-CB 4.43Å; L58-A70 HydrophobicContact CG-CB 4.36Å; V66-A70 WeakPolarHBondContact O-CB 3.35Å; V66-A70 PolarHBondContact O-N 3.17Å; L67-A70 PolarHBondContact O-N 2.88Å; F68-A70 VanDerWaalsContact C-N 3.31Å; F68-A70 PolarHBondContact O-N 3.42Å; A70-A73 PolarHBondContact O-N 3.19Å; A70-V74 WeakPolarHBondContact O-CG2 3.43Å; A70-V74 PolarHBondContact O-N 3.22Å
71A95.1Very high91.4Very high0 Ų027.1 Ų27.10%013%0.128CC..Hα-helixtrans-61.8-42.8173.600000111.6L67 F68 V74 M75 Q114 I115L67-A71 PolarHBondContact O-N 3.35Å; F68-A71 WeakPolarHBondContact O-CB 3.48Å; F68-A71 PolarHBondContact O-N 3.06Å; A71-V74 PolarHBondContact O-N 3.47Å; A71-M75 WeakPolarHBondContact O-CB 3.35Å; A71-M75 PolarHBondContact O-N 3.09Å; A71-Q114 HydrophobicContact CB-CB 4.29Å; A71-Q114 HydrophobicContact CB-CG 3.83Å; A71-I115 HydrophobicContact CB-CG1 3.67Å
72T92.5Very high90.9Very high7 Ų727.2 Ų27.24%0.04313%0.127CC..Hα-helixtrans-61.6-42.7173.7-550000112.2F68 Q69 V74 M75 E76 Q114F68-T72 PolarHBondContact O-N 2.9Å; F68-T72 PolarHBondContact O-OG1 3.41Å; Q69-T72 PolarHBondContact O-N 3.27Å; T72-V74 VanDerWaalsContact C-N 3.33Å; T72-V74 PolarHBondContact O-N 3.19Å; T72-M75 HydrophobicContact CG2-CE 4.34Å; T72-M75 WeakPolarHBondContact O-CB 3.36Å; T72-M75 PolarHBondContact O-N 3.25Å; T72-E76 HydrophobicContact CG2-CG 4.49Å; T72-E76 WeakPolarHBondContact O-CG 3.4Å; T72-E76 PolarHBondContact O-N 3.26Å; T72-Q114 PolarHBondContact OG1-NE2 3.37Å
73A92.1Very high90.3Very high0 Ų021.1 Ų21.10%010%0.102CC..Hα-helixtrans-62.5-39.9176.700000111.9F44 R45 Q69 A70 A77F44-A73 HydrophobicContact CD1-CB 4.13Å; F44-A73 HydrophobicContact CE1-CB 3.62Å; F44-A73 HydrophobicContact CZ-CB 4.29Å; R45-A73 HydrophobicContact CB-CB 4.48Å; R45-A73 HydrophobicContact CG-CB 3.84Å; Q69-A73 WeakPolarHBondContact O-CB 3.43Å; Q69-A73 PolarHBondContact O-N 3.12Å; A70-A73 PolarHBondContact O-N 3.19Å; A73-A77 WeakPolarHBondContact O-CB 3.49Å; A73-A77 PolarHBondContact O-N 3.02Å
74V93.3Very high89.7Confident1 Ų122.5 Ų22.51%0.00611%0.108CC..Hα-helixtrans-62.1-48173.2171.10000111.1C54 A70 A71 T72 E76 A77 V78 L93 L97C54-V74 HydrophobicContact CB-CG2 3.38Å; A70-V74 WeakPolarHBondContact O-CG2 3.43Å; A70-V74 PolarHBondContact O-N 3.22Å; A71-V74 PolarHBondContact O-N 3.47Å; T72-V74 VanDerWaalsContact C-N 3.33Å; T72-V74 PolarHBondContact O-N 3.19Å; V74-E76 PolarHBondContact O-N 2.9Å; V74-A77 PolarHBondContact O-N 3.46Å; V74-V78 WeakPolarHBondContact O-CB 3.33Å; V74-V78 WeakPolarHBondContact O-CG1 3.45Å; V74-V78 PolarHBondContact O-N 3.4Å; V74-L93 HydrophobicContact CG1-CD1 4.16Å; V74-L93 HydrophobicContact CG1-CD2 3.94Å; V74-L93 HydrophobicContact CG1-CG 4.33Å; V74-L97 HydrophobicContact CG1-CD1 4.2Å
75M89.1Confident89.2Confident33 Ų3321.6 Ų21.616%0.16310%0.103CC..Hα-helixtrans-58.9-44.4179.8-175.7-177.974.100112.5A71 T72 V78 L117 A118 V121A71-M75 WeakPolarHBondContact O-CB 3.35Å; A71-M75 PolarHBondContact O-N 3.09Å; T72-M75 HydrophobicContact CG2-CE 4.34Å; T72-M75 WeakPolarHBondContact O-CB 3.36Å; T72-M75 PolarHBondContact O-N 3.25Å; M75-V78 WeakPolarHBondContact O-CG1 3.22Å; M75-L117 HydrophobicContact SD-CD2 3.83Å; M75-L117 HydrophobicContact SD-CG 3.8Å; M75-A118 HydrophobicContact CB-CB 3.87Å; M75-A118 HydrophobicContact CG-CB 4.34Å; M75-V121 HydrophobicContact CG-CB 4.09Å; M75-V121 HydrophobicContact CG-CG1 4.09Å; M75-V121 HydrophobicContact CG-CG2 3.85Å; M75-V121 HydrophobicContact SD-CG2 3.99Å
76E86.1Confident88.8Confident37 Ų3725.4 Ų25.417%0.17312%0.123CC..Hα-helixtrans-74.5-40.6179.7-69178.4166.300112.3R45 T72 V74 R80R45-E76 WeakPolarHBondContact CB-OE2 3.45Å; R45-E76 IonicContact CZ-OE1 2.73Å; R45-E76 IonicContact CZ-OE2 2.83Å; R45-E76 IonicContact NE-OE1 3.23Å; R45-E76 PolarHBondContact NE-OE1 3.44Å; R45-E76 IonicContact NE-OE2 3.22Å; R45-E76 PolarHBondContact NE-OE2 3.5Å; R45-E76 IonicContact NH2-OE1 3.94Å; R45-E76 PolarHBondContact NH2-OE1 3.39Å; R45-E76 IonicContact NH2-OE2 2.95Å; T72-E76 HydrophobicContact CG2-CG 4.49Å; T72-E76 WeakPolarHBondContact O-CG 3.4Å; T72-E76 PolarHBondContact O-N 3.26Å; V74-E76 PolarHBondContact O-N 2.9Å; E76-R80 WeakPolarHBondContact O-CB 3.46Å; E76-R80 PolarHBondContact O-N 3.46Å; E76-R80 VanDerWaalsContact O-N 3.09Å; E76-R80 PolarHBondContact O-NH1 3.41Å
77A87.1Confident88.2Confident0 Ų031.2 Ų31.20%015%0.148CC..Hα-helixtrans-68.7-37.6-17900000112.4P50 F51 A73 V74 V79 R80 E81P50-A77 HydrophobicContact CG-CB 3.42Å; P50-A77 VanDerWaalsContact CG-CB 3.42Å; F51-A77 HydrophobicContact CE1-CB 3.75Å; F51-A77 HydrophobicContact CZ-CB 3.7Å; A73-A77 WeakPolarHBondContact O-CB 3.49Å; A73-A77 PolarHBondContact O-N 3.02Å; V74-A77 PolarHBondContact O-N 3.46Å; A77-V79 VanDerWaalsContact C-N 3.34Å; A77-V79 PolarHBondContact O-N 2.91Å; A77-R80 PolarHBondContact O-N 3.45Å; A77-E81 WeakPolarHBondContact O-CB 3.39Å; A77-E81 PolarHBondContact O-N 2.93Å
78V86.9Confident87.7Confident0 Ų035.5 Ų35.50%018%0.175CC..Hα-helixtrans-65.7-37.9-17772.60000111.7F51 V74 M75 W82 L85 L93 I122F51-V78 HydrophobicContact CE1-CB 3.99Å; V74-V78 WeakPolarHBondContact O-CB 3.33Å; V74-V78 WeakPolarHBondContact O-CG1 3.45Å; V74-V78 PolarHBondContact O-N 3.4Å; M75-V78 WeakPolarHBondContact O-CG1 3.22Å; V78-W82 HydrophobicContact CG2-CE3 3.96Å; V78-W82 HydrophobicContact CG2-CZ3 4.01Å; V78-W82 WeakPolarHBondContact O-CA 3.28Å; V78-W82 VanDerWaalsContact O-CB 3.29Å; V78-W82 WeakPolarHBondContact O-CB 3.41Å; V78-W82 PolarHBondContact O-N 2.92Å; V78-L85 HydrophobicContact CG2-CD1 3.92Å; V78-L93 HydrophobicContact CG2-CD2 4.31Å; V78-I122 HydrophobicContact CB-CG1 4.42Å; V78-I122 HydrophobicContact CG1-CD1 4.43Å; V78-I122 HydrophobicContact CG1-CG1 3.76Å; V78-I122 HydrophobicContact CG2-CD1 4.39Å; V78-I122 HydrophobicContact CG2-CG1 3.95Å
79V81.8Confident87.4Confident17 Ų1736 Ų3610%0.10319%0.185CC..Hα-helixtrans-76.7-41.2176.6-179.80000110.9A77 E81 W82 V121 I176 L178A77-V79 VanDerWaalsContact C-N 3.34Å; A77-V79 PolarHBondContact O-N 2.91Å; V79-E81 PolarHBondContact O-N 2.88Å; V79-W82 WeakPolarHBondContact O-CB 3.48Å; V79-W82 PolarHBondContact O-N 2.95Å; V79-V121 HydrophobicContact CG2-CG1 3.28Å; V79-I176 HydrophobicContact CB-CD1 3.4Å; V79-I176 HydrophobicContact CB-CG1 4.49Å; V79-I176 HydrophobicContact CB-CG2 4.24Å; V79-I176 HydrophobicContact CG1-CB 3.8Å; V79-I176 HydrophobicContact CG1-CD1 3.6Å; V79-I176 HydrophobicContact CG1-CG1 4.24Å; V79-I176 HydrophobicContact CG1-CG2 3.6Å; V79-I176 HydrophobicContact CG2-CD1 4.12Å; V79-L178 HydrophobicContact CG1-CD1 4.1Å
80R79.3Confident87.1Confident31 Ų3135.7 Ų35.712%0.11718%0.183CC..Hα-helixtrans-59.9-46.2177.6177.3178.362.4-117.618.2112.4R45 S47 E76 A77 I176 G1150 V1154R45-R80 PolarHBondContact O-NH1 3.01Å; R45-R80 PolarHBondContact O-NH2 3.34Å; S47-R80 PolarHBondContact O-NH2 3.25Å; E76-R80 WeakPolarHBondContact O-CB 3.46Å; E76-R80 PolarHBondContact O-N 3.46Å; E76-R80 VanDerWaalsContact O-N 3.09Å; E76-R80 PolarHBondContact O-NH1 3.41Å; A77-R80 PolarHBondContact O-N 3.45Å; R80-I176 HydrophobicContact CB-CG2 4.37Å; R80-G1150 WeakPolarHBondContact CG-O 3.33Å; R80-V1154 HydrophobicContact CG-CG2 4.03Å
81E83.8Confident86.7Confident20 Ų2038 Ų389%0.09319%0.194CC..THydrogen-bonded Turntrans-98.711.1-175.9-60.3178.7-168.700112.1K48 S49 F51 A77 V79 I83 L84 L85K48-E81 WeakPolarHBondContact CA-OE1 3.37Å; S49-E81 VanDerWaalsContact CA-OE2 3.28Å; S49-E81 WeakPolarHBondContact CA-OE2 3.34Å; S49-E81 PolarHBondContact N-OE1 2.72Å; S49-E81 PolarHBondContact N-OE2 3.17Å; S49-E81 VanDerWaalsContact N-OE2 3.15Å; F51-E81 WeakPolarHBondContact CE2-OE2 3.49Å; A77-E81 WeakPolarHBondContact O-CB 3.39Å; A77-E81 PolarHBondContact O-N 2.93Å; V79-E81 PolarHBondContact O-N 2.88Å; E81-I83 VanDerWaalsContact C-N 3.28Å; E81-I83 PolarHBondContact O-N 2.98Å; E81-I83 VanDerWaalsContact O-N 3.11Å; E81-L84 HydrophobicContact CB-CD1 4.37Å; E81-L84 WeakPolarHBondContact O-CA 3.49Å; E81-L84 VanDerWaalsContact O-CB 3.31Å; E81-L84 WeakPolarHBondContact O-CB 3.25Å; E81-L84 PolarHBondContact O-N 3.21Å; E81-L85 WeakPolarHBondContact O-CG 3.03Å; E81-L85 PolarHBondContact O-N 3.24Å
82W83.2Confident86.4Confident11 Ų1141.2 Ų41.24%0.04222%0.217CC..G310 helixtrans-48.8-47.1-170.6-175.5-98000113.7V78 V79 L84 L85 I90 I122 R125 G126 D129 I132V78-W82 HydrophobicContact CG2-CE3 3.96Å; V78-W82 HydrophobicContact CG2-CZ3 4.01Å; V78-W82 WeakPolarHBondContact O-CA 3.28Å; V78-W82 VanDerWaalsContact O-CB 3.29Å; V78-W82 WeakPolarHBondContact O-CB 3.41Å; V78-W82 PolarHBondContact O-N 2.92Å; V79-W82 WeakPolarHBondContact O-CB 3.48Å; V79-W82 PolarHBondContact O-N 2.95Å; W82-L84 PolarHBondContact O-N 3.21Å; W82-L85 PolarHBondContact O-N 3.05Å; W82-I90 HydrophobicContact CD2-CD1 4.23Å; W82-I90 HydrophobicContact CE3-CD1 4.15Å; W82-I90 HydrophobicContact CH2-CD1 4.14Å; W82-I90 HydrophobicContact CH2-CG2 3.95Å; W82-I90 HydrophobicContact CZ2-CD1 4.16Å; W82-I90 HydrophobicContact CZ3-CD1 4.12Å; W82-I90 HydrophobicContact CZ3-CG2 3.86Å; W82-I122 HydrophobicContact CH2-CG2 4.41Å; W82-I122 WeakPolarHBondContact CH2-O 3.46Å; W82-I122 HydrophobicContact CZ3-CG2 4.32Å; W82-R125 HydrophobicContact CB-CG 4.48Å; W82-R125 HydrophobicContact CD2-CB 4.33Å; W82-R125 HydrophobicContact CD2-CG 3.34Å; W82-R125 HydrophobicContact CE3-CB 4.07Å; W82-R125 HydrophobicContact CE3-CG 3.47Å; W82-R125 VanDerWaalsContact CE3-CG 3.47Å; W82-R125 HydrophobicContact CG-CG 3.79Å; W82-R125 HydrophobicContact CH2-CB 3.93Å; W82-R125 HydrophobicContact CH2-CG 3.96Å; W82-R125 HydrophobicContact CZ2-CB 4.24Å; W82-R125 HydrophobicContact CZ2-CG 3.9Å; W82-R125 HydrophobicContact CZ3-CB 3.86Å; W82-R125 HydrophobicContact CZ3-CG 3.77Å; W82-G126 VanDerWaalsContact CZ2-CA 3.48Å; W82-D129 PolarHBondContact NE1-OD2 2.89Å; W82-I132 HydrophobicContact CH2-CD1 3.54Å; W82-I132 HydrophobicContact CH2-CG1 4.44Å; W82-I132 HydrophobicContact CZ2-CD1 4.19Å
83I79.8Confident86.4Confident64 Ų6441.2 Ų41.233%0.32822%0.216SC..G310 helixtrans-72.8-14.9-176.2-36.3178.7000111.5E81 R1112E81-I83 VanDerWaalsContact C-N 3.28Å; E81-I83 PolarHBondContact O-N 2.98Å; E81-I83 VanDerWaalsContact O-N 3.11Å; I83-R1112 VanDerWaalsContact C-NH1 3.26Å; I83-R1112 VanDerWaalsContact CB-NH1 3.27Å; I83-R1112 VanDerWaalsContact CG2-CZ 3.49Å; I83-R1112 VanDerWaalsContact O-CZ 3.3Å; I83-R1112 PolarHBondContact O-NH1 3.48Å; I83-R1112 PolarHBondContact O-NH2 3.11Å
84L82.9Confident86.3Confident68 Ų6842.1 Ų42.136%0.35622%0.22SC..G310 helixtrans-90.9-17.2176.5-56.2174.9000112.2E81 W82 V1108 L1151E81-L84 HydrophobicContact CB-CD1 4.37Å; E81-L84 WeakPolarHBondContact O-CA 3.49Å; E81-L84 VanDerWaalsContact O-CB 3.31Å; E81-L84 WeakPolarHBondContact O-CB 3.25Å; E81-L84 PolarHBondContact O-N 3.21Å; W82-L84 PolarHBondContact O-N 3.21Å; L84-V1108 HydrophobicContact CD2-CG1 4.24Å; L84-L1151 HydrophobicContact CD1-CD2 4.49Å
85L85.9Confident86.2Confident39 Ų3944.2 Ų44.220%0.20424%0.237CC..SBendtrans-87.7138.3-175.8-63.1174.4000111.7F51 V78 E81 W82 I90F51-L85 HydrophobicContact CD2-CD2 4.31Å; F51-L85 HydrophobicContact CE1-CD1 4.44Å; F51-L85 HydrophobicContact CE2-CD1 4.16Å; F51-L85 HydrophobicContact CE2-CD2 3.73Å; F51-L85 HydrophobicContact CE2-CG 4.49Å; F51-L85 HydrophobicContact CZ-CD1 3.8Å; F51-L85 HydrophobicContact CZ-CD2 4.25Å; V78-L85 HydrophobicContact CG2-CD1 3.92Å; E81-L85 WeakPolarHBondContact O-CG 3.03Å; E81-L85 PolarHBondContact O-N 3.24Å; W82-L85 PolarHBondContact O-N 3.05Å; L85-I90 HydrophobicContact CB-CD1 3.87Å; L85-I90 HydrophobicContact CB-CG1 3.72Å; L85-I90 HydrophobicContact CD1-CG1 4.14Å
86E87Confident86.4Confident135 Ų13544.3 Ų44.363%0.63124%0.237SC*.  trans-72.6142.1170.7-64.5-176.6178.600111T88 S89 I90E86-T88 PolarHBondContact O-N 3.29Å; E86-S89 WeakPolarHBondContact O-CB 3.44Å; E86-S89 PolarHBondContact O-N 3.01Å; E86-I90 PolarHBondContact O-N 2.98Å; E86-I90 VanDerWaalsContact O-N 3.12Å
87K84.3Confident86.8Confident122 Ų12242.6 Ų42.653%0.5323%0.229SC..Hα-helixtrans-53.1-41179.8-63.7-174.9176.5-170.80112.9S89 I90 E91K87-S89 VanDerWaalsContact C-N 3.33Å; K87-S89 PolarHBondContact O-N 3.4Å; K87-I90 PolarHBondContact O-N 3.44Å; K87-E91 PolarHBondContact O-N 3.06Å; K87-E91 VanDerWaalsContact O-N 3.07Å
88T86.1Confident87Confident97 Ų9743.9 Ų43.960%0.59524%0.235SC*.Hα-helixtrans-62.1-38.5177.246.80000112.6E86 S92E86-T88 PolarHBondContact O-N 3.29Å; T88-S92 WeakPolarHBondContact O-CB 3.39Å; T88-S92 PolarHBondContact O-N 3.36Å
89S88.4Confident87.2Confident62 Ų6246.9 Ų46.943%0.43425%0.254SS..Hα-helixtrans-71.1-37.6178.9-660000111.7E86 K87 S92 L93E86-S89 WeakPolarHBondContact O-CB 3.44Å; E86-S89 PolarHBondContact O-N 3.01Å; K87-S89 VanDerWaalsContact C-N 3.33Å; K87-S89 PolarHBondContact O-N 3.4Å; S89-S92 PolarHBondContact O-N 3.32Å; S89-L93 WeakPolarHBondContact O-CB 3.34Å; S89-L93 PolarHBondContact O-N 2.84Å
90I88.8Confident87.8Confident5 Ų546.6 Ų46.63%0.02625%0.251CS..Hα-helixtrans-66.3-45.8176.4-57.3166.9000110.6W82 L85 E86 K87 S92 L93 R94 I122 I132W82-I90 HydrophobicContact CD2-CD1 4.23Å; W82-I90 HydrophobicContact CE3-CD1 4.15Å; W82-I90 HydrophobicContact CH2-CD1 4.14Å; W82-I90 HydrophobicContact CH2-CG2 3.95Å; W82-I90 HydrophobicContact CZ2-CD1 4.16Å; W82-I90 HydrophobicContact CZ3-CD1 4.12Å; W82-I90 HydrophobicContact CZ3-CG2 3.86Å; L85-I90 HydrophobicContact CB-CD1 3.87Å; L85-I90 HydrophobicContact CB-CG1 3.72Å; L85-I90 HydrophobicContact CD1-CG1 4.14Å; E86-I90 PolarHBondContact O-N 2.98Å; E86-I90 VanDerWaalsContact O-N 3.12Å; K87-I90 PolarHBondContact O-N 3.44Å; I90-S92 VanDerWaalsContact C-N 3.34Å; I90-S92 PolarHBondContact O-N 3.45Å; I90-L93 WeakPolarHBondContact O-CB 3.47Å; I90-L93 PolarHBondContact O-N 3.05Å; I90-R94 PolarHBondContact O-N 3.18Å; I90-I122 HydrophobicContact CG2-CG2 3.63Å; I90-I132 HydrophobicContact CG2-CD1 3.6Å
91E86.9Confident88.5Confident49 Ų4945.2 Ų45.223%0.22925%0.246CC..Hα-helixtrans-62.7-40.4175.8-75.2-73.2-169.700112.1K87 L93 R94 A95 I132 N133K87-E91 PolarHBondContact O-N 3.06Å; K87-E91 VanDerWaalsContact O-N 3.07Å; E91-L93 VanDerWaalsContact C-N 3.3Å; E91-L93 PolarHBondContact O-N 3.32Å; E91-R94 PolarHBondContact O-N 2.89Å; E91-R94 IonicContact OE2-CZ 3.19Å; E91-R94 IonicContact OE2-NE 2.96Å; E91-R94 PolarHBondContact OE2-NE 3.37Å; E91-R94 IonicContact OE2-NH2 3.14Å; E91-R94 PolarHBondContact OE2-NH2 2.92Å; E91-A95 WeakPolarHBondContact O-CB 3.34Å; E91-A95 PolarHBondContact O-N 2.94Å; E91-I132 VanDerWaalsContact OE1-CG2 3.26Å; E91-I132 WeakPolarHBondContact OE1-CG2 3.49Å; E91-N133 PolarHBondContact OE1-N 2.95Å
92S90.2Very high88.7Confident68 Ų6848 Ų4848%0.47626%0.262SS..Hα-helixtrans-60.9-39.4173.9179.70000112.3T88 S89 I90 F96T88-S92 WeakPolarHBondContact O-CB 3.39Å; T88-S92 PolarHBondContact O-N 3.36Å; S89-S92 PolarHBondContact O-N 3.32Å; I90-S92 VanDerWaalsContact C-N 3.34Å; I90-S92 PolarHBondContact O-N 3.45Å; S92-F96 WeakPolarHBondContact O-CB 3.37Å; S92-F96 PolarHBondContact O-N 3.07Å
93L91.9Very high89.1Confident7 Ų754.1 Ų54.14%0.03729%0.291CS..Hα-helixtrans-66.9-46.2176.118063.2000111.6F51 V74 V78 S89 I90 E91 A95 F96 L97 I122F51-L93 HydrophobicContact CD1-CD2 3.76Å; F51-L93 HydrophobicContact CE1-CD2 4.16Å; V74-L93 HydrophobicContact CG1-CD1 4.16Å; V74-L93 HydrophobicContact CG1-CD2 3.94Å; V74-L93 HydrophobicContact CG1-CG 4.33Å; V78-L93 HydrophobicContact CG2-CD2 4.31Å; S89-L93 WeakPolarHBondContact O-CB 3.34Å; S89-L93 PolarHBondContact O-N 2.84Å; I90-L93 WeakPolarHBondContact O-CB 3.47Å; I90-L93 PolarHBondContact O-N 3.05Å; E91-L93 VanDerWaalsContact C-N 3.3Å; E91-L93 PolarHBondContact O-N 3.32Å; L93-A95 PolarHBondContact O-N 3.28Å; L93-F96 WeakPolarHBondContact O-CB 3.47Å; L93-F96 PolarHBondContact O-N 3.44Å; L93-L97 WeakPolarHBondContact O-CG 3.48Å; L93-L97 PolarHBondContact O-N 2.9Å; L93-I122 HydrophobicContact CD2-CD1 4.32Å; L93-I122 HydrophobicContact CG-CD1 4.41Å
94R90.9Very high89.6Confident18 Ų1855 Ų557%0.06829%0.289CS..Hα-helixtrans-55.9-51.7174.9-175.5-174.973.1940.2111.3I90 E91 F96 L97 L98 V119 I122 E140I90-R94 PolarHBondContact O-N 3.18Å; E91-R94 PolarHBondContact O-N 2.89Å; E91-R94 IonicContact OE2-CZ 3.19Å; E91-R94 IonicContact OE2-NE 2.96Å; E91-R94 PolarHBondContact OE2-NE 3.37Å; E91-R94 IonicContact OE2-NH2 3.14Å; E91-R94 PolarHBondContact OE2-NH2 2.92Å; R94-F96 VanDerWaalsContact C-N 3.31Å; R94-F96 PolarHBondContact O-N 3.13Å; R94-L97 PolarHBondContact O-N 3.16Å; R94-L98 HydrophobicContact CG-CD1 4.38Å; R94-L98 PolarHBondContact O-N 2.66Å; R94-L98 VanDerWaalsContact O-N 3.11Å; R94-V119 HydrophobicContact CG-CG1 4.22Å; R94-I122 HydrophobicContact CB-CG2 4.35Å; R94-E140 IonicContact CZ-OE1 2.99Å; R94-E140 IonicContact NH1-OE1 3.37Å; R94-E140 PolarHBondContact NH1-OE1 3.12Å; R94-E140 IonicContact NH1-OE2 3.45Å; R94-E140 PolarHBondContact NH1-OE2 2.96Å; R94-E140 VanDerWaalsContact NH1-OE2 3.14Å; R94-E140 IonicContact NH2-OE1 3.29Å; R94-E140 PolarHBondContact NH2-OE1 3.46Å; R94-E140 VanDerWaalsContact NH2-OE1 3.17Å
95A89.9Confident89.7Confident46 Ų4654.8 Ų54.838%0.3829%0.292SS..Hα-helixtrans-61.4-39.2-179.900000112.1E91 L93 T99E91-A95 WeakPolarHBondContact O-CB 3.34Å; E91-A95 PolarHBondContact O-N 2.94Å; L93-A95 PolarHBondContact O-N 3.28Å; A95-T99 VanDerWaalsContact O-CB 3.27Å; A95-T99 WeakPolarHBondContact O-CB 3.3Å; A95-T99 PolarHBondContact O-N 3.4Å; A95-T99 PolarHBondContact O-OG1 3.2Å
96F94.4Very high89.7Confident35 Ų3560.5 Ų60.515%0.15432%0.323CS..Hα-helixtrans-59.7-50.1174.3166.9-94.7000111.8K55 L58 E59 S92 L93 R94 L98 T99 Y100K55-F96 HydrophobicContact CB-CE1 4.27Å; K55-F96 HydrophobicContact CB-CZ 4.07Å; K55-F96 HydrophobicContact CD-CD1 4.38Å; K55-F96 HydrophobicContact CD-CG 4.43Å; K55-F96 HydrophobicContact CG-CD1 3.98Å; K55-F96 HydrophobicContact CG-CE1 3.7Å; K55-F96 HydrophobicContact CG-CE2 4.43Å; K55-F96 HydrophobicContact CG-CG 4.47Å; K55-F96 HydrophobicContact CG-CZ 3.94Å; L58-F96 HydrophobicContact CD1-CE1 3.95Å; E59-F96 HydrophobicContact CG-CE2 4.37Å; E59-F96 HydrophobicContact CG-CZ 4.34Å; E59-F96 WeakPolarHBondContact OE1-CE2 3.42Å; S92-F96 WeakPolarHBondContact O-CB 3.37Å; S92-F96 PolarHBondContact O-N 3.07Å; L93-F96 WeakPolarHBondContact O-CB 3.47Å; L93-F96 PolarHBondContact O-N 3.44Å; R94-F96 VanDerWaalsContact C-N 3.31Å; R94-F96 PolarHBondContact O-N 3.13Å; F96-L98 PolarHBondContact O-N 3.05Å; F96-T99 PolarHBondContact O-N 2.78Å; F96-Y100 HydrophobicContact CZ-CD2 4.09Å; F96-Y100 WeakPolarHBondContact O-CB 3.43Å; F96-Y100 PolarHBondContact O-N 3.44Å
97L94.4Very high90Very high1 Ų155 Ų551%0.00530%0.298CS..Hα-helixtrans-61.9-44.5-177.9-68.1176.6000112L58 V74 L93 R94 Y100 V101 I115 A118 V119 I122L58-L97 HydrophobicContact CD1-CD2 4.1Å; V74-L97 HydrophobicContact CG1-CD1 4.2Å; L93-L97 WeakPolarHBondContact O-CG 3.48Å; L93-L97 PolarHBondContact O-N 2.9Å; R94-L97 PolarHBondContact O-N 3.16Å; L97-Y100 WeakPolarHBondContact O-CB 3.3Å; L97-Y100 PolarHBondContact O-N 2.96Å; L97-V101 PolarHBondContact O-N 3.32Å; L97-I115 HydrophobicContact CB-CG2 3.78Å; L97-I115 HydrophobicContact CD2-CG2 3.99Å; L97-I115 HydrophobicContact CG-CG2 4.33Å; L97-A118 HydrophobicContact CD1-CB 4.23Å; L97-V119 HydrophobicContact CB-CG2 3.67Å; L97-V119 HydrophobicContact CD1-CG2 4.07Å; L97-I122 HydrophobicContact CD1-CD1 4.15Å
98L89.8Confident90.5Very high26 Ų2653.2 Ų53.214%0.13629%0.292CS..Hα-helixtrans-63-47.4176.4-76173.4000111.8R94 F96 Y100 V101 L102 L116 V119 I159R94-L98 HydrophobicContact CG-CD1 4.38Å; R94-L98 PolarHBondContact O-N 2.66Å; R94-L98 VanDerWaalsContact O-N 3.11Å; F96-L98 PolarHBondContact O-N 3.05Å; L98-Y100 VanDerWaalsContact C-N 3.29Å; L98-Y100 PolarHBondContact O-N 2.96Å; L98-V101 PolarHBondContact O-N 3.46Å; L98-L102 WeakPolarHBondContact O-CB 3.41Å; L98-L102 PolarHBondContact O-N 3.08Å; L98-L116 HydrophobicContact CD2-CD2 4.33Å; L98-V119 HydrophobicContact CD1-CG1 4.31Å; L98-V119 HydrophobicContact CD2-CG1 4.07Å; L98-V119 HydrophobicContact CD2-CG2 4.24Å; L98-V119 HydrophobicContact CG-CG1 4.13Å; L98-V119 HydrophobicContact CG-CG2 4.1Å; L98-I159 HydrophobicContact CD2-CD1 4Å; L98-I159 HydrophobicContact CD2-CG1 4.29Å
99T91.7Very high90.7Very high64 Ų6455.7 Ų55.739%0.39329%0.294SS..Hα-helixtrans-62.1-39.4178.2-56.30000111.3A95 F96 V101 L102 Q103A95-T99 VanDerWaalsContact O-CB 3.27Å; A95-T99 WeakPolarHBondContact O-CB 3.3Å; A95-T99 PolarHBondContact O-N 3.4Å; A95-T99 PolarHBondContact O-OG1 3.2Å; F96-T99 PolarHBondContact O-N 2.78Å; T99-V101 PolarHBondContact O-N 2.99Å; T99-L102 PolarHBondContact O-N 2.64Å; T99-Q103 HydrophobicContact CG2-CG 4.21Å; T99-Q103 VanDerWaalsContact CG2-NE2 3.32Å; T99-Q103 WeakPolarHBondContact O-CB 3.49Å; T99-Q103 VanDerWaalsContact O-CG 3.29Å; T99-Q103 WeakPolarHBondContact O-CG 3.3Å; T99-Q103 PolarHBondContact O-N 2.95Å
100Y94.4Very high90.9Very high10 Ų1056.7 Ų56.74%0.03929%0.289CS..Hα-helixtrans-58.7-46.1179.5179-82.7000112L58 F96 L97 L98 R104 L107 I115L58-Y100 HydrophobicContact CB-CD2 4.3Å; L58-Y100 HydrophobicContact CB-CE2 3.74Å; L58-Y100 WeakPolarHBondContact O-CE2 3.22Å; L58-Y100 VanDerWaalsContact O-CZ 3.24Å; L58-Y100 PolarHBondContact O-OH 2.99Å; F96-Y100 HydrophobicContact CZ-CD2 4.09Å; F96-Y100 WeakPolarHBondContact O-CB 3.43Å; F96-Y100 PolarHBondContact O-N 3.44Å; L97-Y100 WeakPolarHBondContact O-CB 3.3Å; L97-Y100 PolarHBondContact O-N 2.96Å; L98-Y100 VanDerWaalsContact C-N 3.29Å; L98-Y100 PolarHBondContact O-N 2.96Å; Y100-R104 PolarHBondContact O-NH1 3.2Å; Y100-L107 HydrophobicContact CD1-CD2 4.41Å; Y100-L107 HydrophobicContact CE1-CD1 4.47Å; Y100-L107 HydrophobicContact CE1-CD2 3.88Å; Y100-I115 HydrophobicContact CD1-CD1 3.79Å; Y100-I115 HydrophobicContact CE1-CD1 3.82Å
101V93.6Very high91.3Very high3 Ų356.5 Ų56.52%0.01829%0.288CS..Hα-helixtrans-71.6-42.3178.8174.60000111L97 L98 T99 Q103 R104 L107 R112 I115 L155L97-V101 PolarHBondContact O-N 3.32Å; L98-V101 PolarHBondContact O-N 3.46Å; T99-V101 PolarHBondContact O-N 2.99Å; V101-Q103 VanDerWaalsContact C-N 3.3Å; V101-Q103 PolarHBondContact O-N 3.24Å; V101-R104 CarbonylContact O-C 3.6Å; V101-R104 PolarHBondContact O-N 2.99Å; V101-R104 VanDerWaalsContact O-N 3.07Å; V101-L107 HydrophobicContact CG2-CD2 4.48Å; V101-R112 HydrophobicContact CG1-CG 3.66Å; V101-I115 HydrophobicContact CG2-CB 3.93Å; V101-I115 HydrophobicContact CG2-CD1 4.04Å; V101-I115 HydrophobicContact CG2-CG2 3.56Å; V101-L155 HydrophobicContact CG1-CD1 3.43Å; V101-L155 VanDerWaalsContact CG1-CD1 3.43Å; V101-L155 HydrophobicContact CG1-CD2 4.11Å; V101-L155 HydrophobicContact CG1-CG 4.44Å
102L88.6Confident91.6Very high79 Ų7955.6 Ų55.641%0.41428%0.282SS..Hα-helixtrans-61.5-38-179.9-173.565.9000112.4L98 T99 R104 L144 V152 L155L98-L102 WeakPolarHBondContact O-CB 3.41Å; L98-L102 PolarHBondContact O-N 3.08Å; T99-L102 PolarHBondContact O-N 2.64Å; L102-R104 VanDerWaalsContact C-N 3.26Å; L102-R104 PolarHBondContact O-N 2.75Å; L102-L144 HydrophobicContact CD1-CD2 3.85Å; L102-L144 HydrophobicContact CD2-CD2 4.21Å; L102-V152 HydrophobicContact CD1-CG1 4.46Å; L102-L155 HydrophobicContact CB-CD2 4.25Å; L102-L155 HydrophobicContact CD1-CD2 3.68Å
103Q90.9Very high91.8Very high139 Ų13955.7 Ų55.765%0.6528%0.275SS*.THydrogen-bonded Turntrans-75.5-11.4178-70.5177.1-500113.6T99 V101 P105T99-Q103 HydrophobicContact CG2-CG 4.21Å; T99-Q103 VanDerWaalsContact CG2-NE2 3.32Å; T99-Q103 WeakPolarHBondContact O-CB 3.49Å; T99-Q103 VanDerWaalsContact O-CG 3.29Å; T99-Q103 WeakPolarHBondContact O-CG 3.3Å; T99-Q103 PolarHBondContact O-N 2.95Å; V101-Q103 VanDerWaalsContact C-N 3.3Å; V101-Q103 PolarHBondContact O-N 3.24Å; Q103-P105 WeakPolarHBondContact O-CD 3.22Å
104R91.4Very high91.9Very high81 Ų8156.5 Ų56.531%0.30628%0.279SS..  trans-126.271.7-175-65.4-178.1178.479.8-7.1111.4Y100 V101 L102 N106 L107Y100-R104 PolarHBondContact O-NH1 3.2Å; V101-R104 CarbonylContact O-C 3.6Å; V101-R104 PolarHBondContact O-N 2.99Å; V101-R104 VanDerWaalsContact O-N 3.07Å; L102-R104 VanDerWaalsContact C-N 3.26Å; L102-R104 PolarHBondContact O-N 2.75Å; R104-N106 PolarHBondContact O-N 3.03Å; R104-N106 VanDerWaalsContact O-N 3.12Å; R104-L107 HydrophobicContact CB-CB 4.1Å; R104-L107 VanDerWaalsContact O-CB 3.26Å; R104-L107 WeakPolarHBondContact O-CB 3.4Å; R104-L107 PolarHBondContact O-N 3.01Å
105P84.3Confident92.1Very high64 Ų6455.7 Ų55.742%0.41628%0.276SS..THydrogen-bonded Turntrans-62.5-22.6-178.625.5-35.2000113.9Q103 R112 T151Q103-P105 WeakPolarHBondContact O-CD 3.22Å; P105-R112 PolarHBondContact O-NH2 3.17Å; P105-T151 HydrophobicContact CB-CG2 3.79Å
106N87.1Confident92.3Very high159 Ų15953.6 Ų53.685%0.8526%0.258SS*.THydrogen-bonded Turntrans-95.410.1178.9-61.8-25.7000113.4R104R104-N106 PolarHBondContact O-N 3.03Å; R104-N106 VanDerWaalsContact O-N 3.12Å
107L92.6Very high92.2Very high19 Ų1954.3 Ų54.310%0.09926%0.264CS..SBendtrans-61.1140.8175.1-174.566.5000110.3L67 Y100 V101 R104 K109 V111 R112 I115L67-L107 HydrophobicContact CD1-CD1 4.25Å; Y100-L107 HydrophobicContact CD1-CD2 4.41Å; Y100-L107 HydrophobicContact CE1-CD1 4.47Å; Y100-L107 HydrophobicContact CE1-CD2 3.88Å; V101-L107 HydrophobicContact CG2-CD2 4.48Å; R104-L107 HydrophobicContact CB-CB 4.1Å; R104-L107 VanDerWaalsContact O-CB 3.26Å; R104-L107 WeakPolarHBondContact O-CB 3.4Å; R104-L107 PolarHBondContact O-N 3.01Å; L107-K109 PolarHBondContact O-N 2.95Å; L107-V111 HydrophobicContact CD1-CB 4.43Å; L107-V111 HydrophobicContact CD1-CG1 4.14Å; L107-V111 HydrophobicContact CD2-CB 4.4Å; L107-V111 HydrophobicContact CD2-CG1 4.04Å; L107-V111 HydrophobicContact CG-CB 4.23Å; L107-V111 HydrophobicContact CG-CG1 4.22Å; L107-R112 HydrophobicContact CD2-CB 4.28Å; L107-R112 PolarHBondContact O-NH2 3.13Å; L107-I115 HydrophobicContact CD2-CD1 4.11Å
108Q93.7Very high92Very high86 Ų8654.3 Ų54.340%0.40226%0.263SS..  trans-53.7134.3179.5-176.162.1-7.600111.7D64 Y110 V111 R112D64-Q108 HydrophobicContact CB-CB 4.24Å; D64-Q108 HydrophobicContact CB-CG 4.27Å; Q108-Y110 HydrophobicContact CG-CD1 3.56Å; Q108-Y110 HydrophobicContact CG-CE1 3.26Å; Q108-Y110 HydrophobicContact CG-CE2 4.45Å; Q108-Y110 HydrophobicContact CG-CG 4.29Å; Q108-Y110 PolarHBondContact O-N 3.06Å; Q108-V111 HydrophobicContact CB-CG2 4.05Å; Q108-V111 HydrophobicContact CG-CG2 4.45Å; Q108-V111 WeakPolarHBondContact O-CB 3.35Å; Q108-V111 PolarHBondContact O-N 3.19Å; Q108-R112 PolarHBondContact O-N 2.81Å
109K91.1Very high92.1Very high148 Ų14853.1 Ų53.164%0.64326%0.257SS*.Hα-helixtrans-53.3-51.9-169.4-67.7-177.2-178.4177.60112.5L107 V111 R112 E113L107-K109 PolarHBondContact O-N 2.95Å; K109-V111 VanDerWaalsContact C-N 3.28Å; K109-V111 PolarHBondContact O-N 3.38Å; K109-R112 WeakPolarHBondContact O-CB 3.25Å; K109-R112 PolarHBondContact O-N 3.26Å; K109-E113 WeakPolarHBondContact O-CG 3.41Å; K109-E113 PolarHBondContact O-N 3.22Å
110Y93.1Very high92Very high84 Ų8450.1 Ų50.133%0.32924%0.239SC..Hα-helixtrans-65-28.9-178.266.8-104.8000113.5D64 Y65 F68 Q108 Q114D64-Y110 HydrophobicContact CB-CE2 4.24Å; D64-Y110 WeakPolarHBondContact CB-OH 3.25Å; Y65-Y110 PolarHBondContact N-OH 3.07Å; F68-Y110 HydrophobicContact CB-CD2 4.06Å; F68-Y110 HydrophobicContact CB-CE2 3.89Å; F68-Y110 AromaticContact CD2-CD2 3.77Å; F68-Y110 HydrophobicContact CD2-CD2 3.77Å; F68-Y110 HydrophobicContact CD2-CE2 4.42Å; F68-Y110 HydrophobicContact CG-CD2 4.15Å; F68-Y110 HydrophobicContact CG-CE2 4.35Å; Q108-Y110 HydrophobicContact CG-CD1 3.56Å; Q108-Y110 HydrophobicContact CG-CE1 3.26Å; Q108-Y110 HydrophobicContact CG-CE2 4.45Å; Q108-Y110 HydrophobicContact CG-CG 4.29Å; Q108-Y110 PolarHBondContact O-N 3.06Å; Y110-Q114 VanDerWaalsContact O-CB 3.31Å; Y110-Q114 WeakPolarHBondContact O-CB 3.37Å; Y110-Q114 PolarHBondContact O-N 3.44Å
111V95.8Very high91.7Very high0 Ų050.2 Ų50.20%024%0.24CC..Hα-helixtrans-70.9-44.5175.5-1780000109.9D64 L67 F68 L107 Q108 K109 Q114 I115D64-V111 HydrophobicContact CB-CG2 3.95Å; D64-V111 VanDerWaalsContact O-CG2 3.31Å; D64-V111 WeakPolarHBondContact O-CG2 3.36Å; L67-V111 HydrophobicContact CB-CG1 3.59Å; L67-V111 HydrophobicContact CB-CG2 4.27Å; L67-V111 HydrophobicContact CD1-CG1 4.42Å; F68-V111 HydrophobicContact CB-CG2 4.38Å; L107-V111 HydrophobicContact CD1-CB 4.43Å; L107-V111 HydrophobicContact CD1-CG1 4.14Å; L107-V111 HydrophobicContact CD2-CB 4.4Å; L107-V111 HydrophobicContact CD2-CG1 4.04Å; L107-V111 HydrophobicContact CG-CB 4.23Å; L107-V111 HydrophobicContact CG-CG1 4.22Å; Q108-V111 HydrophobicContact CB-CG2 4.05Å; Q108-V111 HydrophobicContact CG-CG2 4.45Å; Q108-V111 WeakPolarHBondContact O-CB 3.35Å; Q108-V111 PolarHBondContact O-N 3.19Å; K109-V111 VanDerWaalsContact C-N 3.28Å; K109-V111 PolarHBondContact O-N 3.38Å; V111-Q114 PolarHBondContact O-N 3.46Å; V111-I115 HydrophobicContact CG1-CD1 4.04Å; V111-I115 WeakPolarHBondContact O-CG1 3.33Å; V111-I115 PolarHBondContact O-N 3.49Å
112R94.6Very high91.5Very high30 Ų3050 Ų5011%0.11324%0.24CC..Hα-helixtrans-56.8-54.3174.9176.9-174.5-40.8-176.45.5111.1V101 P105 L107 Q108 K109 Q114 I115 L116V101-R112 HydrophobicContact CG1-CG 3.66Å; P105-R112 PolarHBondContact O-NH2 3.17Å; L107-R112 HydrophobicContact CD2-CB 4.28Å; L107-R112 PolarHBondContact O-NH2 3.13Å; Q108-R112 PolarHBondContact O-N 2.81Å; K109-R112 WeakPolarHBondContact O-CB 3.25Å; K109-R112 PolarHBondContact O-N 3.26Å; R112-Q114 VanDerWaalsContact C-N 3.28Å; R112-Q114 PolarHBondContact O-N 3.05Å; R112-I115 PolarHBondContact O-N 3.22Å; R112-I115 VanDerWaalsContact O-N 3.15Å; R112-L116 HydrophobicContact CG-CD1 4.15Å; R112-L116 HydrophobicContact CG-CG 4.49Å; R112-L116 WeakPolarHBondContact O-CG 3.36Å; R112-L116 PolarHBondContact O-N 3.41Å
113E92.8Very high91.4Very high70 Ų7046.5 Ų46.533%0.32722%0.221SC..Hα-helixtrans-62-36.6-178.5-60.8-53.3150.700111.5K109 I115 L116 L117 S158K109-E113 WeakPolarHBondContact O-CG 3.41Å; K109-E113 PolarHBondContact O-N 3.22Å; E113-I115 PolarHBondContact O-N 2.86Å; E113-L116 PolarHBondContact O-N 3.12Å; E113-L117 WeakPolarHBondContact O-CB 3.36Å; E113-L117 PolarHBondContact O-N 3Å; E113-S158 PolarHBondContact OE1-OG 3.32Å
114Q94.3Very high91.2Very high25 Ų2540.1 Ų40.112%0.11719%0.191CC..Hα-helixtrans-66.3-37.4175.1-16863.71000113.4F68 A71 T72 Y110 V111 R112 A118F68-Q114 HydrophobicContact CD2-CB 3.51Å; F68-Q114 HydrophobicContact CD2-CG 3.58Å; F68-Q114 HydrophobicContact CE2-CB 3.61Å; F68-Q114 HydrophobicContact CE2-CG 3.51Å; F68-Q114 HydrophobicContact CG-CG 4.32Å; F68-Q114 HydrophobicContact CZ-CG 4.18Å; A71-Q114 HydrophobicContact CB-CB 4.29Å; A71-Q114 HydrophobicContact CB-CG 3.83Å; T72-Q114 PolarHBondContact OG1-NE2 3.37Å; Y110-Q114 VanDerWaalsContact O-CB 3.31Å; Y110-Q114 WeakPolarHBondContact O-CB 3.37Å; Y110-Q114 PolarHBondContact O-N 3.44Å; V111-Q114 PolarHBondContact O-N 3.46Å; R112-Q114 VanDerWaalsContact C-N 3.28Å; R112-Q114 PolarHBondContact O-N 3.05Å; Q114-A118 PolarHBondContact O-N 3.42Å
115I95.9Very high90.8Very high0 Ų037.3 Ų37.30%018%0.181CC..Hα-helixtrans-67.6-41.7174.2-68167.7000110.5L58 A71 L97 Y100 V101 L107 V111 R112 E113 L117 A118 V119L58-I115 HydrophobicContact CD2-CD1 4.19Å; A71-I115 HydrophobicContact CB-CG1 3.67Å; L97-I115 HydrophobicContact CB-CG2 3.78Å; L97-I115 HydrophobicContact CD2-CG2 3.99Å; L97-I115 HydrophobicContact CG-CG2 4.33Å; Y100-I115 HydrophobicContact CD1-CD1 3.79Å; Y100-I115 HydrophobicContact CE1-CD1 3.82Å; V101-I115 HydrophobicContact CG2-CB 3.93Å; V101-I115 HydrophobicContact CG2-CD1 4.04Å; V101-I115 HydrophobicContact CG2-CG2 3.56Å; L107-I115 HydrophobicContact CD2-CD1 4.11Å; V111-I115 HydrophobicContact CG1-CD1 4.04Å; V111-I115 WeakPolarHBondContact O-CG1 3.33Å; V111-I115 PolarHBondContact O-N 3.49Å; R112-I115 PolarHBondContact O-N 3.22Å; R112-I115 VanDerWaalsContact O-N 3.15Å; E113-I115 PolarHBondContact O-N 2.86Å; I115-L117 VanDerWaalsContact C-N 3.33Å; I115-A118 WeakPolarHBondContact O-CB 3.46Å; I115-A118 PolarHBondContact O-N 3.01Å; I115-V119 WeakPolarHBondContact O-CG2 3.26Å; I115-V119 PolarHBondContact O-N 3.23Å
116L94Very high90.6Very high3 Ų334.3 Ų34.32%0.01616%0.161CC..Hα-helixtrans-65.6-37.1176.9-65.9-177.4000111.9L98 R112 E113 V119 A120 L155 S158 I159 A162L98-L116 HydrophobicContact CD2-CD2 4.33Å; R112-L116 HydrophobicContact CG-CD1 4.15Å; R112-L116 HydrophobicContact CG-CG 4.49Å; R112-L116 WeakPolarHBondContact O-CG 3.36Å; R112-L116 PolarHBondContact O-N 3.41Å; E113-L116 PolarHBondContact O-N 3.12Å; L116-V119 WeakPolarHBondContact O-CB 3.48Å; L116-V119 PolarHBondContact O-N 3.26Å; L116-A120 PolarHBondContact O-N 3.02Å; L116-L155 HydrophobicContact CD1-CD1 4.01Å; L116-L155 HydrophobicContact CD2-CD1 4.41Å; L116-S158 VanDerWaalsContact CD1-CB 3.48Å; L116-I159 HydrophobicContact CD1-CG1 4.25Å; L116-I159 HydrophobicContact CD2-CG1 3.64Å; L116-A162 HydrophobicContact CB-CB 3.96Å
117L91.6Very high90.2Very high50 Ų5028.2 Ų28.226%0.26213%0.131SC..Hα-helixtrans-60.8-45.3170.4-178.162.2000111.1M75 E113 I115 V119 A120 V121 E166M75-L117 HydrophobicContact SD-CD2 3.83Å; M75-L117 HydrophobicContact SD-CG 3.8Å; E113-L117 WeakPolarHBondContact O-CB 3.36Å; E113-L117 PolarHBondContact O-N 3Å; I115-L117 VanDerWaalsContact C-N 3.33Å; L117-V119 VanDerWaalsContact C-N 3.27Å; L117-V119 PolarHBondContact O-N 2.91Å; L117-A120 PolarHBondContact O-N 3.26Å; L117-A120 VanDerWaalsContact O-N 3.09Å; L117-V121 HydrophobicContact CD1-CG2 4.44Å; L117-V121 HydrophobicContact CG-CG2 4.49Å; L117-V121 VanDerWaalsContact O-CG2 3.32Å; L117-V121 WeakPolarHBondContact O-CG2 3.46Å; L117-V121 PolarHBondContact O-N 3.26Å; L117-E166 HydrophobicContact CD1-CB 4.43Å; L117-E166 WeakPolarHBondContact CD1-OE2 3.2Å
118A91.4Very high88.8Confident0 Ų029.8 Ų29.80%014%0.139CC..Hα-helixtrans-59-38.8174.600000112.3M75 L97 Q114 I115 I122M75-A118 HydrophobicContact CB-CB 3.87Å; M75-A118 HydrophobicContact CG-CB 4.34Å; L97-A118 HydrophobicContact CD1-CB 4.23Å; Q114-A118 PolarHBondContact O-N 3.42Å; I115-A118 WeakPolarHBondContact O-CB 3.46Å; I115-A118 PolarHBondContact O-N 3.01Å; A118-I122 VanDerWaalsContact O-CG1 3.25Å; A118-I122 WeakPolarHBondContact O-CG1 3.35Å; A118-I122 PolarHBondContact O-N 3.06Å; A118-I122 VanDerWaalsContact O-N 3.07Å
119V92.1Very high87.5Confident2 Ų229.4 Ų29.41%0.01214%0.14CC..Hα-helixtrans-63.3-46.2172.8171.40000111R94 L97 L98 I115 L116 L117 V121 I122 V123 I137R94-V119 HydrophobicContact CG-CG1 4.22Å; L97-V119 HydrophobicContact CB-CG2 3.67Å; L97-V119 HydrophobicContact CD1-CG2 4.07Å; L98-V119 HydrophobicContact CD1-CG1 4.31Å; L98-V119 HydrophobicContact CD2-CG1 4.07Å; L98-V119 HydrophobicContact CD2-CG2 4.24Å; L98-V119 HydrophobicContact CG-CG1 4.13Å; L98-V119 HydrophobicContact CG-CG2 4.1Å; I115-V119 WeakPolarHBondContact O-CG2 3.26Å; I115-V119 PolarHBondContact O-N 3.23Å; L116-V119 WeakPolarHBondContact O-CB 3.48Å; L116-V119 PolarHBondContact O-N 3.26Å; L117-V119 VanDerWaalsContact C-N 3.27Å; L117-V119 PolarHBondContact O-N 2.91Å; V119-V121 VanDerWaalsContact C-N 3.35Å; V119-V121 PolarHBondContact O-N 3.42Å; V119-I122 WeakPolarHBondContact O-CB 3.36Å; V119-I122 PolarHBondContact O-N 3.25Å; V119-V123 WeakPolarHBondContact O-CG2 3.25Å; V119-V123 PolarHBondContact O-N 2.96Å; V119-I137 HydrophobicContact CG1-CD1 3.94Å
120A89.6Confident86.2Confident1 Ų131.3 Ų31.31%0.00815%0.148CC..Hα-helixtrans-61.7-41.8178.700000112.1L116 L117 I122 V123 K124 A162 L163 E166L116-A120 PolarHBondContact O-N 3.02Å; L117-A120 PolarHBondContact O-N 3.26Å; L117-A120 VanDerWaalsContact O-N 3.09Å; A120-I122 PolarHBondContact O-N 2.91Å; A120-V123 PolarHBondContact O-N 3.48Å; A120-K124 PolarHBondContact O-N 2.72Å; A120-A162 HydrophobicContact CB-CB 4.29Å; A120-A162 WeakPolarHBondContact CB-O 3.28Å; A120-L163 HydrophobicContact CB-CD2 4.08Å; A120-E166 HydrophobicContact CB-CB 3.71Å; A120-E166 HydrophobicContact CB-CG 3.96Å
121V87.6Confident84.6Confident11 Ų1128.1 Ų28.17%0.06714%0.138CC..Hα-helixtrans-60.6-43.3174.9169.60000111.2M75 V79 L117 V119 V123 K124 R125 E166M75-V121 HydrophobicContact CG-CB 4.09Å; M75-V121 HydrophobicContact CG-CG1 4.09Å; M75-V121 HydrophobicContact CG-CG2 3.85Å; M75-V121 HydrophobicContact SD-CG2 3.99Å; V79-V121 HydrophobicContact CG2-CG1 3.28Å; L117-V121 HydrophobicContact CD1-CG2 4.44Å; L117-V121 HydrophobicContact CG-CG2 4.49Å; L117-V121 VanDerWaalsContact O-CG2 3.32Å; L117-V121 WeakPolarHBondContact O-CG2 3.46Å; L117-V121 PolarHBondContact O-N 3.26Å; V119-V121 VanDerWaalsContact C-N 3.35Å; V119-V121 PolarHBondContact O-N 3.42Å; V121-V123 VanDerWaalsContact C-N 3.34Å; V121-V123 PolarHBondContact O-N 2.85Å; V121-K124 PolarHBondContact O-N 2.91Å; V121-R125 VanDerWaalsContact O-CB 3.26Å; V121-R125 WeakPolarHBondContact O-CB 3.38Å; V121-R125 PolarHBondContact O-N 3.33Å; V121-E166 HydrophobicContact CG2-CG 4.12Å
122I88.4Confident83Confident0 Ų028.7 Ų28.70%014%0.141CC..Hα-helixtrans-60.3-44.7174.9-70167.2000110.7V78 W82 I90 L93 R94 L97 A118 V119 A120 G126 I132V78-I122 HydrophobicContact CB-CG1 4.42Å; V78-I122 HydrophobicContact CG1-CD1 4.43Å; V78-I122 HydrophobicContact CG1-CG1 3.76Å; V78-I122 HydrophobicContact CG2-CD1 4.39Å; V78-I122 HydrophobicContact CG2-CG1 3.95Å; W82-I122 HydrophobicContact CH2-CG2 4.41Å; W82-I122 WeakPolarHBondContact CH2-O 3.46Å; W82-I122 HydrophobicContact CZ3-CG2 4.32Å; I90-I122 HydrophobicContact CG2-CG2 3.63Å; L93-I122 HydrophobicContact CD2-CD1 4.32Å; L93-I122 HydrophobicContact CG-CD1 4.41Å; R94-I122 HydrophobicContact CB-CG2 4.35Å; L97-I122 HydrophobicContact CD1-CD1 4.15Å; A118-I122 VanDerWaalsContact O-CG1 3.25Å; A118-I122 WeakPolarHBondContact O-CG1 3.35Å; A118-I122 PolarHBondContact O-N 3.06Å; A118-I122 VanDerWaalsContact O-N 3.07Å; V119-I122 WeakPolarHBondContact O-CB 3.36Å; V119-I122 PolarHBondContact O-N 3.25Å; A120-I122 PolarHBondContact O-N 2.91Å; I122-G126 PolarHBondContact O-N 2.7Å; I122-I132 HydrophobicContact CG2-CD1 3.67Å
123V87.9Confident81.6Confident5 Ų532.3 Ų32.33%0.0316%0.163CC..Hα-helixtrans-65.5-47.6180173.80000111.3V119 A120 V121 R125 G126 S127 C134 I137 L163 F167V119-V123 WeakPolarHBondContact O-CG2 3.25Å; V119-V123 PolarHBondContact O-N 2.96Å; A120-V123 PolarHBondContact O-N 3.48Å; V121-V123 VanDerWaalsContact C-N 3.34Å; V121-V123 PolarHBondContact O-N 2.85Å; V123-R125 PolarHBondContact O-N 3.18Å; V123-G126 PolarHBondContact O-N 2.99Å; V123-S127 PolarHBondContact O-N 3.08Å; V123-S127 VanDerWaalsContact O-N 3.12Å; V123-S127 PolarHBondContact O-OG 3.09Å; V123-C134 HydrophobicContact CG1-CB 4.18Å; V123-I137 HydrophobicContact CG2-CD1 3.98Å; V123-L163 HydrophobicContact CB-CD2 4Å; V123-L163 HydrophobicContact CG1-CD2 3.92Å; V123-L163 HydrophobicContact CG2-CD2 4.3Å; V123-F167 HydrophobicContact CG1-CE2 4.2Å; V123-F167 HydrophobicContact CG1-CZ 4.26Å
124K85.8Confident80Confident5 Ų530.2 Ų30.22%0.02216%0.155CC..Hα-helixtrans-60.1-46.2176.7-174.3-179.5175.3-173.10111.5A120 V121 G126 S127 E166 F167 S169 T173 H183 C186A120-K124 PolarHBondContact O-N 2.72Å; V121-K124 PolarHBondContact O-N 2.91Å; K124-G126 VanDerWaalsContact C-N 3.28Å; K124-G126 PolarHBondContact O-N 3.22Å; K124-S127 WeakPolarHBondContact O-CB 3.38Å; K124-S127 PolarHBondContact O-N 2.89Å; K124-E166 HydrophobicContact CB-CG 4.23Å; K124-E166 HydrophobicContact CD-CG 3.78Å; K124-E166 WeakPolarHBondContact CD-O 3.48Å; K124-E166 WeakPolarHBondContact CD-OE1 3.46Å; K124-E166 WeakPolarHBondContact CE-O 3.34Å; K124-E166 PolarHBondContact NZ-O 3.23Å; K124-E166 IonicContact NZ-OE1 3.09Å; K124-E166 PolarHBondContact NZ-OE1 2.73Å; K124-F167 HydrophobicContact CB-CD1 4.48Å; K124-F167 HydrophobicContact CB-CD2 4.19Å; K124-F167 HydrophobicContact CB-CE1 4.03Å; K124-F167 HydrophobicContact CB-CE2 3.7Å; K124-F167 HydrophobicContact CB-CZ 3.65Å; K124-F167 HydrophobicContact CD-CG 4.48Å; K124-F167 HydrophobicContact CG-CD1 4.03Å; K124-F167 HydrophobicContact CG-CD2 4.44Å; K124-F167 HydrophobicContact CG-CE1 3.85Å; K124-F167 HydrophobicContact CG-CE2 4.29Å; K124-F167 HydrophobicContact CG-CG 4.37Å; K124-F167 HydrophobicContact CG-CZ 4.02Å; K124-S169 PolarHBondContact NZ-O 2.87Å; K124-T173 PolarHBondContact NZ-OG1 3.02Å; K124-H183 VanDerWaalsContact CE-ND1 3.34Å; K124-H183 WeakPolarHBondContact CE-ND1 3.38Å; K124-H183 PolarHBondContact NZ-ND1 3.49Å; K124-C186 HydrophobicContact CG-CB 4.26Å
125R82.3Confident78.8Confident22 Ų2234.9 Ų34.98%0.08318%0.175CC..Hα-helixtrans-63.8-33.3179.3-173.562.4-171.783.8-5.2112.7W82 V121 V123 D129W82-R125 HydrophobicContact CB-CG 4.48Å; W82-R125 HydrophobicContact CD2-CB 4.33Å; W82-R125 HydrophobicContact CD2-CG 3.34Å; W82-R125 HydrophobicContact CE3-CB 4.07Å; W82-R125 HydrophobicContact CE3-CG 3.47Å; W82-R125 VanDerWaalsContact CE3-CG 3.47Å; W82-R125 HydrophobicContact CG-CG 3.79Å; W82-R125 HydrophobicContact CH2-CB 3.93Å; W82-R125 HydrophobicContact CH2-CG 3.96Å; W82-R125 HydrophobicContact CZ2-CB 4.24Å; W82-R125 HydrophobicContact CZ2-CG 3.9Å; W82-R125 HydrophobicContact CZ3-CB 3.86Å; W82-R125 HydrophobicContact CZ3-CG 3.77Å; V121-R125 VanDerWaalsContact O-CB 3.26Å; V121-R125 WeakPolarHBondContact O-CB 3.38Å; V121-R125 PolarHBondContact O-N 3.33Å; V123-R125 PolarHBondContact O-N 3.18Å; R125-D129 IonicContact CZ-OD2 2.82Å; R125-D129 IonicContact NH1-OD1 3.23Å; R125-D129 IonicContact NH1-OD2 2.78Å; R125-D129 PolarHBondContact NH1-OD2 2.92Å; R125-D129 IonicContact NH2-OD2 3.18Å
126G81.4Confident77.9Confident0 Ų035.8 Ų35.80%018%0.184CC..Hα-helixtrans-81.2-12.1177.600000116.3W82 I122 V123 K124 S131W82-G126 VanDerWaalsContact CZ2-CA 3.48Å; I122-G126 PolarHBondContact O-N 2.7Å; V123-G126 PolarHBondContact O-N 2.99Å; K124-G126 VanDerWaalsContact C-N 3.28Å; K124-G126 PolarHBondContact O-N 3.22Å; G126-S131 PolarHBondContact O-N 3.05Å
127S77.4Confident77.5Confident31 Ų3135.8 Ų35.822%0.21718%0.184CC..Hα-helixtrans-68.4-38-174.5-66.10000113.4V123 K124 C134V123-S127 PolarHBondContact O-N 3.08Å; V123-S127 VanDerWaalsContact O-N 3.12Å; V123-S127 PolarHBondContact O-OG 3.09Å; K124-S127 WeakPolarHBondContact O-CB 3.38Å; K124-S127 PolarHBondContact O-N 2.89Å; S127-C134 PolarHBondContact OG-SG 3.46Å
128L64.7Low77.3Confident52 Ų5234.4 Ų34.427%0.27218%0.176SC..Hα-helixtrans-86.4-34.5-179.5-77.4173000114K130 F182 N185 C186 L189L128-K130 PolarHBondContact O-N 3.43Å; L128-K130 VanDerWaalsContact O-N 3.14Å; L128-F182 HydrophobicContact CB-CE2 3.88Å; L128-F182 HydrophobicContact CB-CZ 4.42Å; L128-F182 HydrophobicContact CD1-CD1 4.34Å; L128-F182 HydrophobicContact CD1-CD2 3.33Å; L128-F182 HydrophobicContact CD1-CE1 4.36Å; L128-F182 HydrophobicContact CD1-CE2 3.38Å; L128-F182 HydrophobicContact CD1-CG 3.83Å; L128-F182 HydrophobicContact CD1-CZ 3.9Å; L128-F182 WeakPolarHBondContact CD1-O 3.15Å; L128-F182 HydrophobicContact CG-CE2 4.19Å; L128-N185 HydrophobicContact CD1-CB 4.1Å; L128-N185 HydrophobicContact CD2-CB 4.19Å; L128-C186 WeakPolarHBondContact CD1-SG 3.41Å; L128-C186 VanDerWaalsContact CG-SG 3.58Å; L128-L189 HydrophobicContact CD2-CD1 3.44Å; L128-L189 VanDerWaalsContact CD2-CD1 3.44Å; L128-L189 HydrophobicContact CG-CD1 4.38Å
129D65.8Low77.1Confident78 Ų7840.5 Ų40.542%0.41720%0.204SC..THydrogen-bonded Turntrans-73.5-2.3178.2-72.7-13.3000113.1W82 R125 S131W82-D129 PolarHBondContact NE1-OD2 2.89Å; R125-D129 IonicContact CZ-OD2 2.82Å; R125-D129 IonicContact NH1-OD1 3.23Å; R125-D129 IonicContact NH1-OD2 2.78Å; R125-D129 PolarHBondContact NH1-OD2 2.92Å; R125-D129 IonicContact NH2-OD2 3.18Å; D129-S131 PolarHBondContact O-N 2.92Å
130K64.3Low76.9Confident188 Ų18843.9 Ų43.982%0.81722%0.22SC*.THydrogen-bonded Turntrans4732-170-57.8-179.4-1781780111.6L128L128-K130 PolarHBondContact O-N 3.43Å; L128-K130 VanDerWaalsContact O-N 3.14Å
131S58.3Low76.9Confident18 Ų1843.9 Ų43.913%0.12622%0.22CC..  trans-91-25.5-169.557.40000112.7G126 D129G126-S131 PolarHBondContact O-N 3.05Å; D129-S131 PolarHBondContact O-N 2.92Å
132I63.1Low77Confident12 Ų1244.2 Ų44.26%0.06223%0.225CC..SBendtrans-123.2139.1-176.8-67.5-176.5000108.9W82 I90 E91 I122 C134W82-I132 HydrophobicContact CH2-CD1 3.54Å; W82-I132 HydrophobicContact CH2-CG1 4.44Å; W82-I132 HydrophobicContact CZ2-CD1 4.19Å; I90-I132 HydrophobicContact CG2-CD1 3.6Å; E91-I132 VanDerWaalsContact OE1-CG2 3.26Å; E91-I132 WeakPolarHBondContact OE1-CG2 3.49Å; I122-I132 HydrophobicContact CG2-CD1 3.67Å; I132-C134 VanDerWaalsContact C-N 3.26Å; I132-C134 PolarHBondContact O-N 3.44Å; I132-C134 PolarHBondContact O-SG 3.25Å
133N64.1Low77.1Confident106 Ų10649.8 Ų49.857%0.56725%0.252SS*.  trans-76.682.9172.7-175.23.4000109.7E91 K135 G136E91-N133 PolarHBondContact OE1-N 2.95Å; N133-K135 PolarHBondContact O-N 2.86Å; N133-K135 WeakPolarHBondContact OD1-CB 3.39Å; N133-K135 PolarHBondContact OD1-N 3.5Å; N133-G136 PolarHBondContact O-N 3.3Å
134C60.8Low77.2Confident25 Ų2551.2 Ų51.217%0.16926%0.259CS..THydrogen-bonded Turntrans-62.7-14.8-178.7-58.90000113V123 S127 I132 G136 I137V123-C134 HydrophobicContact CG1-CB 4.18Å; S127-C134 PolarHBondContact OG-SG 3.46Å; I132-C134 VanDerWaalsContact C-N 3.26Å; I132-C134 PolarHBondContact O-N 3.44Å; I132-C134 PolarHBondContact O-SG 3.25Å; C134-G136 VanDerWaalsContact C-N 3.34Å; C134-I137 WeakPolarHBondContact O-CG2 3.45Å
135K67.8Low77.4Confident124 Ų12451.8 Ų51.854%0.53926%0.262SS..THydrogen-bonded Turntrans-76.8-20.6174.4-60.5-168.4172.9-150.80113.2N133 I137 D193N133-K135 PolarHBondContact O-N 2.86Å; N133-K135 WeakPolarHBondContact OD1-CB 3.39Å; N133-K135 PolarHBondContact OD1-N 3.5Å; K135-I137 VanDerWaalsContact C-N 3.32Å; K135-I137 PolarHBondContact O-N 3.09Å; K135-D193 WeakPolarHBondContact CE-OD2 3.5Å; K135-D193 IonicContact NZ-OD2 3.63Å; K135-D193 PolarHBondContact NZ-OD2 2.92Å
136G77.3Confident77.8Confident18 Ų1855.7 Ų55.719%0.18629%0.293CS..Hα-helixtrans-62.9-36.7179.800000113.1N133 C134 F138 H139 E140N133-G136 PolarHBondContact O-N 3.3Å; C134-G136 VanDerWaalsContact C-N 3.34Å; G136-F138 PolarHBondContact O-N 3.08Å; G136-H139 PolarHBondContact O-N 3.03Å; G136-E140 WeakPolarHBondContact O-CG 3.28Å; G136-E140 PolarHBondContact O-N 2.91Å
137I85.8Confident78Confident3 Ų358.8 Ų58.82%0.01531%0.314CS..Hα-helixtrans-65.7-36.7-176.8-161.8165.2000112.6V119 V123 C134 K135 H139 E140 V141 I159 L163V119-I137 HydrophobicContact CG1-CD1 3.94Å; V123-I137 HydrophobicContact CG2-CD1 3.98Å; C134-I137 WeakPolarHBondContact O-CG2 3.45Å; K135-I137 VanDerWaalsContact C-N 3.32Å; K135-I137 PolarHBondContact O-N 3.09Å; I137-H139 VanDerWaalsContact C-N 3.34Å; I137-H139 PolarHBondContact O-N 3.37Å; I137-E140 PolarHBondContact O-N 3.36Å; I137-V141 WeakPolarHBondContact O-CB 3.44Å; I137-V141 VanDerWaalsContact O-CG2 3.25Å; I137-V141 WeakPolarHBondContact O-CG2 3.34Å; I137-V141 PolarHBondContact O-N 3.15Å; I137-I159 HydrophobicContact CD1-CG2 4.13Å; I137-I159 HydrophobicContact CG1-CG2 4.36Å; I137-L163 HydrophobicContact CD1-CD1 4.11Å; I137-L163 HydrophobicContact CD1-CD2 4.38Å; I137-L163 HydrophobicContact CG2-CD1 4.16Å
138F87.9Confident78.1Confident21 Ų2159.5 Ų59.59%0.09233%0.327CS..Hα-helixtrans-68.7-35.3177.8-63.5-63.9000111.9G136 V141 G142 L160 L163 F190 Q197 I198G136-F138 PolarHBondContact O-N 3.08Å; F138-V141 PolarHBondContact O-N 2.79Å; F138-G142 PolarHBondContact O-N 3.11Å; F138-L160 HydrophobicContact CD1-CD2 4.26Å; F138-L160 HydrophobicContact CE1-CD2 4.29Å; F138-L163 HydrophobicContact CE1-CD1 4.15Å; F138-L163 HydrophobicContact CZ-CD1 4.5Å; F138-F190 HydrophobicContact CZ-CE2 4.09Å; F138-Q197 HydrophobicContact CG-CB 4.48Å; F138-I198 HydrophobicContact CD1-CG1 4.36Å; F138-I198 HydrophobicContact CE1-CD1 4Å; F138-I198 HydrophobicContact CE1-CG1 3.59Å; F138-I198 HydrophobicContact CZ-CG1 4.37Å
139H86.8Confident79.3Confident128 Ų12860.6 Ų60.659%0.59333%0.333SS*.Hα-helixtrans-67.1-43.8173.1-173.469.1000111.9G136 I137 V141 G142 Q143G136-H139 PolarHBondContact O-N 3.03Å; I137-H139 VanDerWaalsContact C-N 3.34Å; I137-H139 PolarHBondContact O-N 3.37Å; H139-V141 VanDerWaalsContact C-N 3.35Å; H139-V141 PolarHBondContact O-N 3.07Å; H139-G142 PolarHBondContact O-N 3.18Å; H139-Q143 PolarHBondContact CD2-NE2 2.92Å; H139-Q143 PolarHBondContact NE2-NE2 2.86Å; H139-Q143 WeakPolarHBondContact O-CG 3.34Å; H139-Q143 PolarHBondContact O-N 3.18Å; H139-Q143 VanDerWaalsContact O-N 3.13Å
140E87.3Confident80.3Confident73 Ų7357.7 Ų57.734%0.34132%0.319SS..Hα-helixtrans-57.2-47.8173.9-69.2163.3-158.100110.5R94 G136 I137 Q143 L144R94-E140 IonicContact CZ-OE1 2.99Å; R94-E140 IonicContact NH1-OE1 3.37Å; R94-E140 PolarHBondContact NH1-OE1 3.12Å; R94-E140 IonicContact NH1-OE2 3.45Å; R94-E140 PolarHBondContact NH1-OE2 2.96Å; R94-E140 VanDerWaalsContact NH1-OE2 3.14Å; R94-E140 IonicContact NH2-OE1 3.29Å; R94-E140 PolarHBondContact NH2-OE1 3.46Å; R94-E140 VanDerWaalsContact NH2-OE1 3.17Å; G136-E140 WeakPolarHBondContact O-CG 3.28Å; G136-E140 PolarHBondContact O-N 2.91Å; I137-E140 PolarHBondContact O-N 3.36Å; E140-Q143 PolarHBondContact O-N 3.39Å; E140-L144 WeakPolarHBondContact O-CG 3.41Å; E140-L144 PolarHBondContact O-N 3.21Å; E140-L144 VanDerWaalsContact O-N 3.12Å
141V90.3Very high81.4Confident2 Ų251.5 Ų51.51%0.01230%0.297CS..Hα-helixtrans-61.8-44.7177.31700000111.9I137 F138 H139 Q143 L144 I145 A156 I159 L160 L201I137-V141 WeakPolarHBondContact O-CB 3.44Å; I137-V141 VanDerWaalsContact O-CG2 3.25Å; I137-V141 WeakPolarHBondContact O-CG2 3.34Å; I137-V141 PolarHBondContact O-N 3.15Å; F138-V141 PolarHBondContact O-N 2.79Å; H139-V141 VanDerWaalsContact C-N 3.35Å; H139-V141 PolarHBondContact O-N 3.07Å; V141-Q143 VanDerWaalsContact C-N 3.27Å; V141-Q143 PolarHBondContact O-N 3.23Å; V141-L144 WeakPolarHBondContact O-CB 3.44Å; V141-L144 PolarHBondContact O-N 2.97Å; V141-I145 HydrophobicContact CG1-CD1 3.99Å; V141-I145 HydrophobicContact CG1-CG1 4.38Å; V141-I145 WeakPolarHBondContact O-CG1 3.42Å; V141-I145 PolarHBondContact O-N 3.32Å; V141-A156 HydrophobicContact CG1-CB 4.11Å; V141-I159 HydrophobicContact CG2-CB 4.23Å; V141-I159 HydrophobicContact CG2-CD1 4.39Å; V141-I159 HydrophobicContact CG2-CG2 3.75Å; V141-L160 HydrophobicContact CB-CD2 4.47Å; V141-L160 HydrophobicContact CG1-CD1 3.97Å; V141-L160 HydrophobicContact CG1-CD2 3.81Å; V141-L160 HydrophobicContact CG1-CG 3.84Å; V141-L160 HydrophobicContact CG2-CD2 4.36Å; V141-L201 HydrophobicContact CG1-CD1 4.47Å
142G89.6Confident83Confident17 Ų1752.1 Ų52.118%0.17530%0.299CS..Hα-helixtrans-58.6-37.2177.200000113.1F138 H139 I145 S146F138-G142 PolarHBondContact O-N 3.11Å; H139-G142 PolarHBondContact O-N 3.18Å; G142-I145 PolarHBondContact O-N 3.21Å; G142-S146 WeakPolarHBondContact O-CB 3.44Å; G142-S146 PolarHBondContact O-N 2.94Å; G142-S146 VanDerWaalsContact O-N 3.09Å; G142-S146 PolarHBondContact O-OG 3.37Å
143Q89.6Confident84.3Confident117 Ų11751.9 Ų51.955%0.54730%0.298SS..Hα-helixtrans-66.7-39.5173.1-67.9-178.24.400112.4H139 E140 V141 I145 S146 S147H139-Q143 PolarHBondContact CD2-NE2 2.92Å; H139-Q143 PolarHBondContact NE2-NE2 2.86Å; H139-Q143 WeakPolarHBondContact O-CG 3.34Å; H139-Q143 PolarHBondContact O-N 3.18Å; H139-Q143 VanDerWaalsContact O-N 3.13Å; E140-Q143 PolarHBondContact O-N 3.39Å; V141-Q143 VanDerWaalsContact C-N 3.27Å; V141-Q143 PolarHBondContact O-N 3.23Å; Q143-I145 VanDerWaalsContact C-N 3.35Å; Q143-S146 PolarHBondContact O-N 3.36Å; Q143-S147 PolarHBondContact O-N 3.07Å
144L90.4Very high85.6Confident35 Ų3547.7 Ų47.718%0.18328%0.276CS..Hα-helixtrans-62.7-41.9176-65.8179.4000111.5L102 E140 V141 S147 V152 A156 I159L102-L144 HydrophobicContact CD1-CD2 3.85Å; L102-L144 HydrophobicContact CD2-CD2 4.21Å; E140-L144 WeakPolarHBondContact O-CG 3.41Å; E140-L144 PolarHBondContact O-N 3.21Å; E140-L144 VanDerWaalsContact O-N 3.12Å; V141-L144 WeakPolarHBondContact O-CB 3.44Å; V141-L144 PolarHBondContact O-N 2.97Å; L144-S147 WeakPolarHBondContact O-CB 3.41Å; L144-S147 PolarHBondContact O-N 3.49Å; L144-S147 PolarHBondContact O-OG 3.15Å; L144-V152 HydrophobicContact CB-CG1 3.79Å; L144-V152 HydrophobicContact CD2-CG1 3.73Å; L144-V152 HydrophobicContact CG-CG1 4.29Å; L144-V152 WeakPolarHBondContact O-CG1 3.31Å; L144-A156 HydrophobicContact CB-CB 3.96Å; L144-I159 HydrophobicContact CD1-CD1 4.02Å
145I90.8Very high87Confident17 Ų1747.1 Ų47.19%0.08727%0.272CS..Hα-helixtrans-62-45176.9-64.4176.5000111V141 G142 Q143 S147 G148 Q153 A156 L201 V205 Y226V141-I145 HydrophobicContact CG1-CD1 3.99Å; V141-I145 HydrophobicContact CG1-CG1 4.38Å; V141-I145 WeakPolarHBondContact O-CG1 3.42Å; V141-I145 PolarHBondContact O-N 3.32Å; G142-I145 PolarHBondContact O-N 3.21Å; Q143-I145 VanDerWaalsContact C-N 3.35Å; I145-S147 PolarHBondContact O-N 2.96Å; I145-S147 VanDerWaalsContact O-N 3.1Å; I145-G148 PolarHBondContact O-N 3.01Å; I145-Q153 PolarHBondContact O-NE2 3.29Å; I145-A156 HydrophobicContact CG1-CB 3.74Å; I145-L201 HydrophobicContact CD1-CB 4.38Å; I145-V205 HydrophobicContact CD1-CG2 4.44Å; I145-V205 HydrophobicContact CG2-CG2 3.52Å; I145-Y226 HydrophobicContact CD1-CE1 4.25Å; I145-Y226 WeakPolarHBondContact CD1-OH 3.41Å; I145-Y226 VanDerWaalsContact CG1-OH 3.3Å; I145-Y226 WeakPolarHBondContact CG1-OH 3.47Å
146S89.5Confident88.3Confident105 Ų10541.2 Ų41.273%0.73425%0.246SC*.THydrogen-bonded Turntrans-65.8-11.4-178.5-580000114.2G142 Q143 G148G142-S146 WeakPolarHBondContact O-CB 3.44Å; G142-S146 PolarHBondContact O-N 2.94Å; G142-S146 VanDerWaalsContact O-N 3.09Å; G142-S146 PolarHBondContact O-OG 3.37Å; Q143-S146 PolarHBondContact O-N 3.36Å; S146-G148 PolarHBondContact O-N 3.47Å
147S87.3Confident89.1Confident64 Ų6440.5 Ų40.545%0.44824%0.238SC..THydrogen-bonded Turntrans-68-18.8-179.671.70000114.2Q143 L144 I145 N149Q143-S147 PolarHBondContact O-N 3.07Å; L144-S147 WeakPolarHBondContact O-CB 3.41Å; L144-S147 PolarHBondContact O-N 3.49Å; L144-S147 PolarHBondContact O-OG 3.15Å; I145-S147 PolarHBondContact O-N 2.96Å; I145-S147 VanDerWaalsContact O-N 3.1Å; S147-N149 PolarHBondContact O-N 2.99Å; S147-N149 PolarHBondContact OG-N 3.06Å
148G79.6Confident89.5Confident47 Ų4740.6 Ų40.649%0.48524%0.239SC..  trans69.82.5-177.800000115.2I145 S146 P150I145-G148 PolarHBondContact O-N 3.01Å; S146-G148 PolarHBondContact O-N 3.47Å; G148-P150 WeakPolarHBondContact O-CD 3.39Å
149N88.1Confident89.7Confident75 Ų7540 Ų4040%0.40124%0.237SC..  trans-88.3118.5177.4-178-39.5000110.4S147 T151 V152 Q153S147-N149 PolarHBondContact O-N 2.99Å; S147-N149 PolarHBondContact OG-N 3.06Å; N149-T151 VanDerWaalsContact C-N 3.28Å; N149-T151 PolarHBondContact O-N 3.38Å; N149-T151 WeakPolarHBondContact OD1-CB 3.4Å; N149-T151 PolarHBondContact OD1-N 3.35Å; N149-V152 HydrophobicContact CB-CB 4.07Å; N149-V152 HydrophobicContact CB-CG2 3.87Å; N149-V152 PolarHBondContact O-N 3.28Å; N149-Q153 WeakPolarHBondContact O-CG 3.33Å; N149-Q153 PolarHBondContact O-N 2.95Å
150P88.4Confident90.1Very high17 Ų1734 Ų3411%0.1121%0.208CC..Hα-helixtrans-56.5-36.3-177-27.735.4000114.4G148 V152 Q153 T154 Q218 M219 V222G148-P150 WeakPolarHBondContact O-CD 3.39Å; P150-V152 VanDerWaalsContact C-N 3.34Å; P150-Q153 PolarHBondContact O-N 3.12Å; P150-T154 VanDerWaalsContact O-CB 3.29Å; P150-T154 WeakPolarHBondContact O-CB 3.5Å; P150-T154 PolarHBondContact O-N 3.34Å; P150-T154 PolarHBondContact O-OG1 3.43Å; P150-Q218 HydrophobicContact CB-CB 3.97Å; P150-Q218 HydrophobicContact CG-CB 4.31Å; P150-M219 HydrophobicContact CG-CG 4.44Å; P150-V222 HydrophobicContact CB-CG2 3.87Å; P150-V222 WeakPolarHBondContact O-CG2 3.38Å
151T87.8Confident90.4Very high58 Ų5832.2 Ų32.236%0.35620%0.203SC..Hα-helixtrans-67.8-37.3178.5-54.30000111.5P105 N149 T154 L155P105-T151 HydrophobicContact CB-CG2 3.79Å; N149-T151 VanDerWaalsContact C-N 3.28Å; N149-T151 PolarHBondContact O-N 3.38Å; N149-T151 WeakPolarHBondContact OD1-CB 3.4Å; N149-T151 PolarHBondContact OD1-N 3.35Å; T151-T154 WeakPolarHBondContact O-CB 3.36Å; T151-L155 PolarHBondContact O-N 3.2Å; T151-L155 VanDerWaalsContact O-N 3.09Å
152V90.1Very high90.4Very high30 Ų3032.6 Ų32.618%0.18221%0.206CC..Hα-helixtrans-74.8-39.6178.3-179.10000110.7L102 L144 N149 P150 T154 L155 A156L102-V152 HydrophobicContact CD1-CG1 4.46Å; L144-V152 HydrophobicContact CB-CG1 3.79Å; L144-V152 HydrophobicContact CD2-CG1 3.73Å; L144-V152 HydrophobicContact CG-CG1 4.29Å; L144-V152 WeakPolarHBondContact O-CG1 3.31Å; N149-V152 HydrophobicContact CB-CB 4.07Å; N149-V152 HydrophobicContact CB-CG2 3.87Å; N149-V152 PolarHBondContact O-N 3.28Å; P150-V152 VanDerWaalsContact C-N 3.34Å; V152-T154 VanDerWaalsContact C-N 3.32Å; V152-T154 PolarHBondContact O-N 3.3Å; V152-L155 PolarHBondContact O-N 2.86Å; V152-A156 WeakPolarHBondContact O-CB 3.31Å; V152-A156 PolarHBondContact O-N 3.39Å
153Q91.3Very high90.5Very high7 Ų731.8 Ų31.83%0.03320%0.198CC..Hα-helixtrans-61.8-40.7171.8-71177.2-25.500111.5I145 N149 P150 L155 A156 C157 V222 Y226I145-Q153 PolarHBondContact O-NE2 3.29Å; N149-Q153 WeakPolarHBondContact O-CG 3.33Å; N149-Q153 PolarHBondContact O-N 2.95Å; P150-Q153 PolarHBondContact O-N 3.12Å; Q153-L155 VanDerWaalsContact C-N 3.33Å; Q153-L155 PolarHBondContact O-N 2.88Å; Q153-A156 WeakPolarHBondContact O-CB 3.37Å; Q153-A156 PolarHBondContact O-N 3.4Å; Q153-C157 PolarHBondContact O-N 2.86Å; Q153-V222 HydrophobicContact CB-CG1 4.02Å; Q153-V222 HydrophobicContact CB-CG2 4.39Å; Q153-Y226 HydrophobicContact CB-CE2 4.43Å; Q153-Y226 PolarHBondContact O-OH 3.5Å
154T91.3Very high90.6Very high19 Ų1926.4 Ų26.412%0.11717%0.173CC..Hα-helixtrans-60-43.9174-63.50000111.7P150 T151 V152 C157 S158 V222 R225P150-T154 VanDerWaalsContact O-CB 3.29Å; P150-T154 WeakPolarHBondContact O-CB 3.5Å; P150-T154 PolarHBondContact O-N 3.34Å; P150-T154 PolarHBondContact O-OG1 3.43Å; T151-T154 WeakPolarHBondContact O-CB 3.36Å; V152-T154 VanDerWaalsContact C-N 3.32Å; V152-T154 PolarHBondContact O-N 3.3Å; T154-C157 WeakPolarHBondContact O-CB 3.26Å; T154-C157 PolarHBondContact O-N 3.41Å; T154-S158 PolarHBondContact O-N 3.49Å; T154-V222 WeakPolarHBondContact OG1-CG2 3.49Å; T154-R225 VanDerWaalsContact CG2-CZ 3.41Å
155L90.9Very high90.5Very high13 Ų1327.8 Ų27.87%0.06819%0.185CC..Hα-helixtrans-66-41.7176.5175.360.5000111.9V101 L102 L116 T151 V152 Q153 C157 S158 I159V101-L155 HydrophobicContact CG1-CD1 3.43Å; V101-L155 VanDerWaalsContact CG1-CD1 3.43Å; V101-L155 HydrophobicContact CG1-CD2 4.11Å; V101-L155 HydrophobicContact CG1-CG 4.44Å; L102-L155 HydrophobicContact CB-CD2 4.25Å; L102-L155 HydrophobicContact CD1-CD2 3.68Å; L116-L155 HydrophobicContact CD1-CD1 4.01Å; L116-L155 HydrophobicContact CD2-CD1 4.41Å; T151-L155 PolarHBondContact O-N 3.2Å; T151-L155 VanDerWaalsContact O-N 3.09Å; V152-L155 PolarHBondContact O-N 2.86Å; Q153-L155 VanDerWaalsContact C-N 3.33Å; Q153-L155 PolarHBondContact O-N 2.88Å; L155-C157 VanDerWaalsContact C-N 3.31Å; L155-C157 PolarHBondContact O-N 2.85Å; L155-S158 PolarHBondContact O-N 2.89Å; L155-I159 HydrophobicContact CD1-CG1 4.49Å; L155-I159 HydrophobicContact CG-CD1 4.25Å; L155-I159 WeakPolarHBondContact O-CG1 3.28Å; L155-I159 PolarHBondContact O-N 3.21Å
156A93.3Very high90.3Very high0 Ų027.8 Ų27.80%019%0.185CC..Hα-helixtrans-57.1-46174.300000111V141 L144 I145 V152 Q153 I159 L160V141-A156 HydrophobicContact CG1-CB 4.11Å; L144-A156 HydrophobicContact CB-CB 3.96Å; I145-A156 HydrophobicContact CG1-CB 3.74Å; V152-A156 WeakPolarHBondContact O-CB 3.31Å; V152-A156 PolarHBondContact O-N 3.39Å; Q153-A156 WeakPolarHBondContact O-CB 3.37Å; Q153-A156 PolarHBondContact O-N 3.4Å; A156-I159 WeakPolarHBondContact O-CB 3.13Å; A156-I159 PolarHBondContact O-N 2.97Å; A156-L160 WeakPolarHBondContact O-CG 3.31Å; A156-L160 PolarHBondContact O-N 3.35Å; A156-L160 VanDerWaalsContact O-N 3.09Å
157C94.4Very high90.2Very high2 Ų223 Ų231%0.01415%0.151CC..Hα-helixtrans-59.1-47.7173.4-166.60000112.1Q153 T154 L155 I159 L160 T161 R225 Y226Q153-C157 PolarHBondContact O-N 2.86Å; T154-C157 WeakPolarHBondContact O-CB 3.26Å; T154-C157 PolarHBondContact O-N 3.41Å; L155-C157 VanDerWaalsContact C-N 3.31Å; L155-C157 PolarHBondContact O-N 2.85Å; C157-I159 VanDerWaalsContact C-N 3.28Å; C157-I159 PolarHBondContact O-N 3.2Å; C157-L160 WeakPolarHBondContact O-CB 3.31Å; C157-L160 PolarHBondContact O-N 3.1Å; C157-L160 VanDerWaalsContact O-N 3.09Å; C157-T161 PolarHBondContact O-N 3.21Å; C157-T161 PolarHBondContact O-OG1 3Å; C157-T161 VanDerWaalsContact O-OG1 3.08Å; C157-R225 PolarHBondContact SG-O 3.36Å; C157-Y226 HydrophobicContact CB-CD2 4.22Å; C157-Y226 HydrophobicContact CB-CE1 4.35Å; C157-Y226 HydrophobicContact CB-CE2 3.74Å
158S93.8Very high89.9Confident5 Ų522.1 Ų22.14%0.03515%0.145CC..Hα-helixtrans-58.9-37.1176.6-73.70000112.5E113 L116 T154 L155 T161 A162E113-S158 PolarHBondContact OE1-OG 3.32Å; L116-S158 VanDerWaalsContact CD1-CB 3.48Å; T154-S158 PolarHBondContact O-N 3.49Å; L155-S158 PolarHBondContact O-N 2.89Å; S158-T161 PolarHBondContact O-N 3.34Å; S158-A162 WeakPolarHBondContact O-CB 3.37Å; S158-A162 PolarHBondContact O-N 3.33Å
159I93Very high89.4Confident10 Ų1020.8 Ų20.85%0.05113%0.128CC..Hα-helixtrans-62.8-46174.8-66.3161.3000110.4L98 L116 I137 V141 L144 L155 A156 C157 A162 L163L98-I159 HydrophobicContact CD2-CD1 4Å; L98-I159 HydrophobicContact CD2-CG1 4.29Å; L116-I159 HydrophobicContact CD1-CG1 4.25Å; L116-I159 HydrophobicContact CD2-CG1 3.64Å; I137-I159 HydrophobicContact CD1-CG2 4.13Å; I137-I159 HydrophobicContact CG1-CG2 4.36Å; V141-I159 HydrophobicContact CG2-CB 4.23Å; V141-I159 HydrophobicContact CG2-CD1 4.39Å; V141-I159 HydrophobicContact CG2-CG2 3.75Å; L144-I159 HydrophobicContact CD1-CD1 4.02Å; L155-I159 HydrophobicContact CD1-CG1 4.49Å; L155-I159 HydrophobicContact CG-CD1 4.25Å; L155-I159 WeakPolarHBondContact O-CG1 3.28Å; L155-I159 PolarHBondContact O-N 3.21Å; A156-I159 WeakPolarHBondContact O-CB 3.13Å; A156-I159 PolarHBondContact O-N 2.97Å; C157-I159 VanDerWaalsContact C-N 3.28Å; C157-I159 PolarHBondContact O-N 3.2Å; I159-A162 PolarHBondContact O-N 3.07Å; I159-L163 HydrophobicContact CG2-CD1 4.25Å; I159-L163 WeakPolarHBondContact O-CG 3.47Å; I159-L163 PolarHBondContact O-N 3.3Å
160L94.8Very high88Confident0 Ų017.4 Ų17.40%011%0.11CC..Hα-helixtrans-63.6-44.1178.4-65.7-179.1000111.8F138 V141 A156 C157 A162 L163 L164 I198 L229F138-L160 HydrophobicContact CD1-CD2 4.26Å; F138-L160 HydrophobicContact CE1-CD2 4.29Å; V141-L160 HydrophobicContact CB-CD2 4.47Å; V141-L160 HydrophobicContact CG1-CD1 3.97Å; V141-L160 HydrophobicContact CG1-CD2 3.81Å; V141-L160 HydrophobicContact CG1-CG 3.84Å; V141-L160 HydrophobicContact CG2-CD2 4.36Å; A156-L160 WeakPolarHBondContact O-CG 3.31Å; A156-L160 PolarHBondContact O-N 3.35Å; A156-L160 VanDerWaalsContact O-N 3.09Å; C157-L160 WeakPolarHBondContact O-CB 3.31Å; C157-L160 PolarHBondContact O-N 3.1Å; C157-L160 VanDerWaalsContact O-N 3.09Å; L160-A162 PolarHBondContact O-N 3.2Å; L160-L163 PolarHBondContact O-N 3.43Å; L160-L164 WeakPolarHBondContact O-CB 3.44Å; L160-L164 PolarHBondContact O-N 2.92Å; L160-I198 HydrophobicContact CB-CG2 4.3Å; L160-I198 HydrophobicContact CD1-CG2 4.36Å; L160-I198 HydrophobicContact CD2-CD1 4.2Å; L160-I198 HydrophobicContact CD2-CG1 3.96Å; L160-L229 HydrophobicContact CB-CD1 4.31Å; L160-L229 HydrophobicContact CB-CD2 3.78Å; L160-L229 HydrophobicContact CD1-CD2 3.83Å; L160-L229 HydrophobicContact CG-CD2 4.46Å
161T93.6Very high86.2Confident36 Ų3619.9 Ų19.922%0.22113%0.128CC..Hα-helixtrans-61.7-41.2175.7-57.60000111.9C157 S158 L164 S165C157-T161 PolarHBondContact O-N 3.21Å; C157-T161 PolarHBondContact O-OG1 3Å; C157-T161 VanDerWaalsContact O-OG1 3.08Å; S158-T161 PolarHBondContact O-N 3.34Å; T161-L164 PolarHBondContact O-N 3.34Å; T161-S165 VanDerWaalsContact O-CB 3.31Å; T161-S165 WeakPolarHBondContact O-CB 3.32Å; T161-S165 PolarHBondContact O-N 3.34Å; T161-S165 PolarHBondContact O-OG 2.99Å
162A91.5Very high84.4Confident10 Ų1025.5 Ų25.58%0.08315%0.147CC..Hα-helixtrans-64.7-42.2176.900000111.8L116 A120 S158 I159 L160 E166L116-A162 HydrophobicContact CB-CB 3.96Å; A120-A162 HydrophobicContact CB-CB 4.29Å; A120-A162 WeakPolarHBondContact CB-O 3.28Å; S158-A162 WeakPolarHBondContact O-CB 3.37Å; S158-A162 PolarHBondContact O-N 3.33Å; I159-A162 PolarHBondContact O-N 3.07Å; L160-A162 PolarHBondContact O-N 3.2Å; A162-E166 VanDerWaalsContact O-CB 3.22Å; A162-E166 WeakPolarHBondContact O-CB 3.36Å; A162-E166 PolarHBondContact O-N 3.4Å
163L91.3Very high82.4Confident1 Ų125.1 Ų25.11%0.00515%0.145CC..Hα-helixtrans-61.4-49.6173-71168.5000111A120 V123 I137 F138 I159 L160 S165 E166 F167 F190A120-L163 HydrophobicContact CB-CD2 4.08Å; V123-L163 HydrophobicContact CB-CD2 4Å; V123-L163 HydrophobicContact CG1-CD2 3.92Å; V123-L163 HydrophobicContact CG2-CD2 4.3Å; I137-L163 HydrophobicContact CD1-CD1 4.11Å; I137-L163 HydrophobicContact CD1-CD2 4.38Å; I137-L163 HydrophobicContact CG2-CD1 4.16Å; F138-L163 HydrophobicContact CE1-CD1 4.15Å; F138-L163 HydrophobicContact CZ-CD1 4.5Å; I159-L163 HydrophobicContact CG2-CD1 4.25Å; I159-L163 WeakPolarHBondContact O-CG 3.47Å; I159-L163 PolarHBondContact O-N 3.3Å; L160-L163 PolarHBondContact O-N 3.43Å; L163-S165 PolarHBondContact O-N 2.93Å; L163-E166 PolarHBondContact O-N 3.44Å; L163-F167 HydrophobicContact CD2-CE2 4.29Å; L163-F167 VanDerWaalsContact O-CD2 3.28Å; L163-F167 WeakPolarHBondContact O-CD2 3.31Å; L163-F167 PolarHBondContact O-N 3.01Å; L163-F190 HydrophobicContact CB-CZ 4.49Å
164L91.3Very high80.4Confident4 Ų428 Ų282%0.02117%0.167CC..Hα-helixtrans-57.9-50.8-179.9-168.969.5000111.3L160 T161 E166 F167 S168 F190 L195 L229 Q232 V233 W236L160-L164 WeakPolarHBondContact O-CB 3.44Å; L160-L164 PolarHBondContact O-N 2.92Å; T161-L164 PolarHBondContact O-N 3.34Å; L164-E166 VanDerWaalsContact C-N 3.35Å; L164-E166 PolarHBondContact O-N 3.16Å; L164-F167 PolarHBondContact O-N 3Å; L164-S168 VanDerWaalsContact O-CB 3.26Å; L164-S168 WeakPolarHBondContact O-CB 3.27Å; L164-S168 PolarHBondContact O-N 2.97Å; L164-F190 HydrophobicContact CD1-CE1 4.19Å; L164-L195 HydrophobicContact CD1-CD1 3.26Å; L164-L229 HydrophobicContact CD2-CD1 4.01Å; L164-Q232 HydrophobicContact CD2-CB 3.47Å; L164-Q232 VanDerWaalsContact CD2-CB 3.47Å; L164-V233 HydrophobicContact CD1-CG2 4.17Å; L164-V233 HydrophobicContact CD2-CG2 3.84Å; L164-W236 HydrophobicContact CD1-CE3 3.53Å; L164-W236 HydrophobicContact CD1-CZ3 3.48Å; L164-W236 VanDerWaalsContact CD1-CZ3 3.48Å; L164-W236 HydrophobicContact CG-CE3 4.23Å; L164-W236 HydrophobicContact CG-CZ3 4.07Å; L164-W236 WeakPolarHBondContact O-CZ3 3.35Å
165S88.3Confident78.3Confident63 Ų6329.8 Ų29.844%0.44118%0.18SC..Hα-helixtrans-59.6-44179.6-610000112.3T161 L163 S168T161-S165 VanDerWaalsContact O-CB 3.31Å; T161-S165 WeakPolarHBondContact O-CB 3.32Å; T161-S165 PolarHBondContact O-N 3.34Å; T161-S165 PolarHBondContact O-OG 2.99Å; L163-S165 PolarHBondContact O-N 2.93Å; S165-S168 PolarHBondContact O-N 3.3Å
166E86.8Confident76.4Confident17 Ų1730.7 Ų30.78%0.07918%0.184CC..Hα-helixtrans-68.8-39.3-178.5-178.747.6-13300111.8L117 A120 V121 K124 A162 L163 L164 T173L117-E166 HydrophobicContact CD1-CB 4.43Å; L117-E166 WeakPolarHBondContact CD1-OE2 3.2Å; A120-E166 HydrophobicContact CB-CB 3.71Å; A120-E166 HydrophobicContact CB-CG 3.96Å; V121-E166 HydrophobicContact CG2-CG 4.12Å; K124-E166 HydrophobicContact CB-CG 4.23Å; K124-E166 HydrophobicContact CD-CG 3.78Å; K124-E166 WeakPolarHBondContact CD-O 3.48Å; K124-E166 WeakPolarHBondContact CD-OE1 3.46Å; K124-E166 WeakPolarHBondContact CE-O 3.34Å; K124-E166 PolarHBondContact NZ-O 3.23Å; K124-E166 IonicContact NZ-OE1 3.09Å; K124-E166 PolarHBondContact NZ-OE1 2.73Å; A162-E166 VanDerWaalsContact O-CB 3.22Å; A162-E166 WeakPolarHBondContact O-CB 3.36Å; A162-E166 PolarHBondContact O-N 3.4Å; L163-E166 PolarHBondContact O-N 3.44Å; L164-E166 VanDerWaalsContact C-N 3.35Å; L164-E166 PolarHBondContact O-N 3.16Å; E166-T173 WeakPolarHBondContact OE1-CG2 3.32Å
167F87.4Confident74.5Confident5 Ų531.8 Ų31.82%0.02220%0.195CC..Hα-helixtrans-80-19177.4-79.8-97.4000113.8V123 K124 L163 L164 C186 F190 W236V123-F167 HydrophobicContact CG1-CE2 4.2Å; V123-F167 HydrophobicContact CG1-CZ 4.26Å; K124-F167 HydrophobicContact CB-CD1 4.48Å; K124-F167 HydrophobicContact CB-CD2 4.19Å; K124-F167 HydrophobicContact CB-CE1 4.03Å; K124-F167 HydrophobicContact CB-CE2 3.7Å; K124-F167 HydrophobicContact CB-CZ 3.65Å; K124-F167 HydrophobicContact CD-CG 4.48Å; K124-F167 HydrophobicContact CG-CD1 4.03Å; K124-F167 HydrophobicContact CG-CD2 4.44Å; K124-F167 HydrophobicContact CG-CE1 3.85Å; K124-F167 HydrophobicContact CG-CE2 4.29Å; K124-F167 HydrophobicContact CG-CG 4.37Å; K124-F167 HydrophobicContact CG-CZ 4.02Å; L163-F167 HydrophobicContact CD2-CE2 4.29Å; L163-F167 VanDerWaalsContact O-CD2 3.28Å; L163-F167 WeakPolarHBondContact O-CD2 3.31Å; L163-F167 PolarHBondContact O-N 3.01Å; L164-F167 PolarHBondContact O-N 3Å; F167-C186 HydrophobicContact CD1-CB 4.35Å; F167-C186 HydrophobicContact CE1-CB 4.35Å; F167-F190 HydrophobicContact CB-CB 4.23Å; F167-F190 HydrophobicContact CB-CD1 3.69Å; F167-F190 HydrophobicContact CB-CD2 4.2Å; F167-F190 HydrophobicContact CB-CE1 4.01Å; F167-F190 HydrophobicContact CB-CE2 4.48Å; F167-F190 HydrophobicContact CB-CG 3.78Å; F167-F190 HydrophobicContact CB-CZ 4.38Å; F167-F190 HydrophobicContact CD1-CB 3.39Å; F167-F190 HydrophobicContact CD1-CD1 4.35Å; F167-F190 AromaticContact CD1-CD2 3.69Å; F167-F190 HydrophobicContact CD1-CD2 3.69Å; F167-F190 AromaticContact CD1-CG 3.56Å; F167-F190 HydrophobicContact CD1-CG 3.56Å; F167-F190 AromaticContact CD2-CD2 3.82Å; F167-F190 HydrophobicContact CD2-CD2 3.82Å; F167-F190 AromaticContact CD2-CE2 3.88Å; F167-F190 HydrophobicContact CD2-CE2 3.88Å; F167-F190 HydrophobicContact CD2-CG 4.27Å; F167-F190 HydrophobicContact CD2-CZ 4.38Å; F167-F190 HydrophobicContact CE1-CB 3.83Å; F167-F190 AromaticContact CE1-CD2 3.83Å; F167-F190 HydrophobicContact CE1-CD2 3.83Å; F167-F190 HydrophobicContact CE1-CG 4.08Å; F167-F190 AromaticContact CE2-CD2 3.95Å; F167-F190 HydrophobicContact CE2-CD2 3.95Å; F167-F190 HydrophobicContact CE2-CE2 4.1Å; F167-F190 HydrophobicContact CG-CB 3.98Å; F167-F190 HydrophobicContact CG-CD1 4.07Å; F167-F190 AromaticContact CG-CD2 3.65Å; F167-F190 HydrophobicContact CG-CD2 3.65Å; F167-F190 HydrophobicContact CG-CE1 4.45Å; F167-F190 HydrophobicContact CG-CE2 4.07Å; F167-F190 AromaticContact CG-CG 3.63Å; F167-F190 HydrophobicContact CG-CG 3.63Å; F167-F190 HydrophobicContact CG-CZ 4.44Å; F167-F190 AromaticContact CZ-CD2 3.92Å; F167-F190 HydrophobicContact CZ-CD2 3.92Å; F167-F190 HydrophobicContact CZ-CE2 4.49Å; F167-W236 VanDerWaalsContact C-CH2 3.46Å; F167-W236 HydrophobicContact CB-CH2 3.84Å
168S81.8Confident73.1Confident45 Ų4532.5 Ų32.532%0.31520%0.199SC..Hα-helixtrans-71.8-37.4-179.1-1730000113.1L164 S165 K187L164-S168 VanDerWaalsContact O-CB 3.26Å; L164-S168 WeakPolarHBondContact O-CB 3.27Å; L164-S168 PolarHBondContact O-N 2.97Å; S165-S168 PolarHBondContact O-N 3.3Å; S168-K187 PolarHBondContact O-NZ 3.45Å
169S68.3Low71.6Confident20 Ų2033.6 Ų33.614%0.1421%0.206CC..  trans-93.8128.4-176.9-179.40000112.1K124 S171 K172K124-S169 PolarHBondContact NZ-O 2.87Å; S169-S171 PolarHBondContact OG-N 2.92Å; S169-S171 PolarHBondContact OG-OG 2.96Å; S169-K172 WeakPolarHBondContact OG-CB 3.32Å; S169-K172 WeakPolarHBondContact OG-CG 3.47Å; S169-K172 PolarHBondContact OG-N 2.75Å
170S59.8Low70.4Confident4 Ų434.1 Ų34.13%0.02821%0.209CC..SBendtrans-94.4-17.5165.677.90000113.7M180 H183 E252S170-M180 WeakPolarHBondContact OG-CE 3.35Å; S170-M180 PolarHBondContact OG-SD 3.39Å; S170-H183 VanDerWaalsContact CB-CB 3.43Å; S170-H183 PolarHBondContact O-CD2 3.43Å; S170-E252 WeakPolarHBondContact CB-OE1 3.42Å; S170-E252 PolarHBondContact N-OE1 3.44Å; S170-E252 PolarHBondContact OG-OE1 3.34Å; S170-E252 PolarHBondContact OG-OE2 3.47Å
171S50.4Low69.2Low68 Ų6838.5 Ų38.548%0.47623%0.229SC..SBendtrans-86.4-36.7-17757.30000115.5S169 T173 S174S169-S171 PolarHBondContact OG-N 2.92Å; S169-S171 PolarHBondContact OG-OG 2.96Å; S171-T173 VanDerWaalsContact C-N 3.26Å; S171-T173 PolarHBondContact O-N 2.8Å; S171-S174 PolarHBondContact O-N 3.49Å; S171-S174 PolarHBondContact O-OG 3Å
172K49.3Very low68.3Low176 Ų17638.2 Ų38.277%0.76523%0.225SC*.THydrogen-bonded Turntrans-70.8-14.6-172.1-72179.3-178.7177.80114.6S169S169-K172 WeakPolarHBondContact OG-CB 3.32Å; S169-K172 WeakPolarHBondContact OG-CG 3.47Å; S169-K172 PolarHBondContact OG-N 2.75Å
173T48.9Very low67.6Low22 Ų2238 Ų3814%0.13522%0.222CC..THydrogen-bonded Turntrans-104.711-179.240.80000115K124 E166 S171 S175 H183K124-T173 PolarHBondContact NZ-OG1 3.02Å; E166-T173 WeakPolarHBondContact OE1-CG2 3.32Å; S171-T173 VanDerWaalsContact C-N 3.26Å; S171-T173 PolarHBondContact O-N 2.8Å; T173-S175 PolarHBondContact O-N 3.08Å; T173-S175 VanDerWaalsContact O-N 3.07Å; T173-H183 PolarHBondContact OG1-CE1 2.93Å; T173-H183 PolarHBondContact OG1-ND1 2.81Å; T173-H183 PolarHBondContact OG1-NE2 3.44Å
174S49.3Very low67Low69 Ų6937.9 Ų37.948%0.48322%0.222SC..G310 helixtrans-58.6-15.9171.757.50000114.1S171 I176 G177S171-S174 PolarHBondContact O-N 3.49Å; S171-S174 PolarHBondContact O-OG 3Å; S174-I176 PolarHBondContact O-N 3.11Å; S174-G177 PolarHBondContact O-N 3.01Å
175S45.7Very low66.4Low56 Ų5639.7 Ų39.739%0.39223%0.231SC..G310 helixtrans-59.7-12.3-176.260.90000115.1T173 K1069T173-S175 PolarHBondContact O-N 3.08Å; T173-S175 VanDerWaalsContact O-N 3.07Å; S175-K1069 WeakPolarHBondContact O-CE 3.47Å; S175-K1069 PolarHBondContact O-NZ 3.35Å
176I52.5Low66.1Low32 Ų3236.7 Ų36.716%0.16421%0.211CC..G310 helixtrans-126.613.1-178-48175.1000112.1V79 R80 S174 L178V79-I176 HydrophobicContact CB-CD1 3.4Å; V79-I176 HydrophobicContact CB-CG1 4.49Å; V79-I176 HydrophobicContact CB-CG2 4.24Å; V79-I176 HydrophobicContact CG1-CB 3.8Å; V79-I176 HydrophobicContact CG1-CD1 3.6Å; V79-I176 HydrophobicContact CG1-CG1 4.24Å; V79-I176 HydrophobicContact CG1-CG2 3.6Å; V79-I176 HydrophobicContact CG2-CD1 4.12Å; R80-I176 HydrophobicContact CB-CG2 4.37Å; S174-I176 PolarHBondContact O-N 3.11Å; I176-L178 PolarHBondContact O-N 3.43Å
177G53.5Low66.1Low23 Ų2336.1 Ų36.124%0.23721%0.208CC..THydrogen-bonded Turntrans71.925.3170.100000115.2S174S174-G177 PolarHBondContact O-N 3.01Å
178L63.7Low65.9Low17 Ų1738.3 Ų38.39%0.08922%0.216CC..  trans-75.4141.8170.1-64175.3000109.8V79 I176 F182V79-L178 HydrophobicContact CG1-CD1 4.1Å; I176-L178 PolarHBondContact O-N 3.43Å; L178-F182 HydrophobicContact CB-CD1 4.21Å; L178-F182 HydrophobicContact CD1-CD1 4.05Å; L178-F182 HydrophobicContact CD1-CE1 3.84Å; L178-F182 HydrophobicContact CD1-CZ 4.45Å
179S62.9Low66.1Low27 Ų2740.5 Ų40.519%0.18922%0.224CC..  trans-69.6150-177.168.80000111.9E181 F182 H183S179-E181 PolarHBondContact O-N 2.9Å; S179-F182 VanDerWaalsContact O-CB 3.29Å; S179-F182 WeakPolarHBondContact O-CB 3.15Å; S179-F182 PolarHBondContact O-N 3.02Å; S179-F182 PolarHBondContact OG-N 2.92Å; S179-F182 VanDerWaalsContact OG-N 3.09Å; S179-H183 PolarHBondContact O-N 2.92Å
180M67.6Low67.1Low21 Ų2140.2 Ų40.210%0.10322%0.22CC..Hα-helixtrans-53.6-35.9170.2-168.970.2175.300111.8S170 H183 G184 R245 I248 A249S170-M180 WeakPolarHBondContact OG-CE 3.35Å; S170-M180 PolarHBondContact OG-SD 3.39Å; M180-H183 PolarHBondContact O-N 3.11Å; M180-G184 PolarHBondContact O-N 3.07Å; M180-R245 HydrophobicContact CB-CG 4.49Å; M180-I248 HydrophobicContact CE-CB 3.98Å; M180-I248 HydrophobicContact CE-CG2 3.6Å; M180-I248 HydrophobicContact CG-CB 4.39Å; M180-I248 HydrophobicContact CG-CG2 4.42Å; M180-A249 HydrophobicContact CE-CB 4.25Å
181E69.3Low68.4Low92 Ų9240.2 Ų40.243%0.4322%0.22SC..Hα-helixtrans-64.1-41.1176-163.8-164.8162.500112.1S179 H183 G184 N185S179-E181 PolarHBondContact O-N 2.9Å; E181-H183 VanDerWaalsContact C-N 3.31Å; E181-H183 PolarHBondContact O-N 3.42Å; E181-G184 PolarHBondContact O-N 3.08Å; E181-N185 VanDerWaalsContact O-CB 3.27Å; E181-N185 WeakPolarHBondContact O-CB 3.4Å; E181-N185 PolarHBondContact O-N 3.34Å; E181-N185 PolarHBondContact O-ND2 3.16Å
182F74.4Confident70Confident30 Ų3042 Ų4213%0.13222%0.22CC..Hα-helixtrans-57.2-47.4173.5176-84.3000110.5L128 L178 S179 N185 C186L128-F182 HydrophobicContact CB-CE2 3.88Å; L128-F182 HydrophobicContact CB-CZ 4.42Å; L128-F182 HydrophobicContact CD1-CD1 4.34Å; L128-F182 HydrophobicContact CD1-CD2 3.33Å; L128-F182 HydrophobicContact CD1-CE1 4.36Å; L128-F182 HydrophobicContact CD1-CE2 3.38Å; L128-F182 HydrophobicContact CD1-CG 3.83Å; L128-F182 HydrophobicContact CD1-CZ 3.9Å; L128-F182 WeakPolarHBondContact CD1-O 3.15Å; L128-F182 HydrophobicContact CG-CE2 4.19Å; L178-F182 HydrophobicContact CB-CD1 4.21Å; L178-F182 HydrophobicContact CD1-CD1 4.05Å; L178-F182 HydrophobicContact CD1-CE1 3.84Å; L178-F182 HydrophobicContact CD1-CZ 4.45Å; S179-F182 VanDerWaalsContact O-CB 3.29Å; S179-F182 WeakPolarHBondContact O-CB 3.15Å; S179-F182 PolarHBondContact O-N 3.02Å; S179-F182 PolarHBondContact OG-N 2.92Å; S179-F182 VanDerWaalsContact OG-N 3.09Å; F182-N185 PolarHBondContact O-N 3.33Å; F182-C186 PolarHBondContact O-N 3.15Å
183H77.8Confident71.7Confident5 Ų535.9 Ų35.92%0.02320%0.196CC..Hα-helixtrans-66-43.4178.9-70.5-48.8000112.9K124 S170 T173 S179 M180 E181 N185 C186 K187K124-H183 VanDerWaalsContact CE-ND1 3.34Å; K124-H183 WeakPolarHBondContact CE-ND1 3.38Å; K124-H183 PolarHBondContact NZ-ND1 3.49Å; S170-H183 VanDerWaalsContact CB-CB 3.43Å; S170-H183 PolarHBondContact O-CD2 3.43Å; T173-H183 PolarHBondContact OG1-CE1 2.93Å; T173-H183 PolarHBondContact OG1-ND1 2.81Å; T173-H183 PolarHBondContact OG1-NE2 3.44Å; S179-H183 PolarHBondContact O-N 2.92Å; M180-H183 PolarHBondContact O-N 3.11Å; E181-H183 VanDerWaalsContact C-N 3.31Å; E181-H183 PolarHBondContact O-N 3.42Å; H183-N185 VanDerWaalsContact C-N 3.34Å; H183-N185 PolarHBondContact O-N 3.05Å; H183-C186 PolarHBondContact O-N 3.31Å; H183-K187 WeakPolarHBondContact O-CB 3.47Å; H183-K187 PolarHBondContact O-N 3.43Å
184G78Confident73.6Confident0 Ų035.1 Ų35.10%019%0.193CC..Hα-helixtrans-61.8-39.3174.500000113.1M180 E181 K187 R188M180-G184 PolarHBondContact O-N 3.07Å; E181-G184 PolarHBondContact O-N 3.08Å; G184-K187 PolarHBondContact O-N 3.07Å; G184-R188 WeakPolarHBondContact O-CG 3.41Å; G184-R188 PolarHBondContact O-N 2.91Å
185N79.2Confident75.7Confident41 Ų4131.8 Ų31.822%0.21917%0.17CC..Hα-helixtrans-66.5-45175.1-75-29.5000111.5L128 E181 F182 H183 R188 L189L128-N185 HydrophobicContact CD1-CB 4.1Å; L128-N185 HydrophobicContact CD2-CB 4.19Å; E181-N185 VanDerWaalsContact O-CB 3.27Å; E181-N185 WeakPolarHBondContact O-CB 3.4Å; E181-N185 PolarHBondContact O-N 3.34Å; E181-N185 PolarHBondContact O-ND2 3.16Å; F182-N185 PolarHBondContact O-N 3.33Å; H183-N185 VanDerWaalsContact C-N 3.34Å; H183-N185 PolarHBondContact O-N 3.05Å; N185-R188 PolarHBondContact O-N 3.48Å; N185-R188 PolarHBondContact OD1-NH1 2.98Å; N185-R188 VanDerWaalsContact OD1-NH1 3.1Å; N185-R188 PolarHBondContact OD1-NH2 3.35Å; N185-L189 WeakPolarHBondContact O-CG 3.37Å; N185-L189 PolarHBondContact O-N 2.79Å
186C82.7Confident77.9Confident1 Ų133.3 Ų33.31%0.00717%0.167CC..Hα-helixtrans-58.4-46.7173.5-82.80000111.9K124 L128 F167 F182 H183 R188 L189 F190K124-C186 HydrophobicContact CG-CB 4.26Å; L128-C186 WeakPolarHBondContact CD1-SG 3.41Å; L128-C186 VanDerWaalsContact CG-SG 3.58Å; F167-C186 HydrophobicContact CD1-CB 4.35Å; F167-C186 HydrophobicContact CE1-CB 4.35Å; F182-C186 PolarHBondContact O-N 3.15Å; H183-C186 PolarHBondContact O-N 3.31Å; C186-R188 PolarHBondContact O-N 3.18Å; C186-L189 PolarHBondContact O-N 3.12Å; C186-F190 VanDerWaalsContact O-CB 3.31Å; C186-F190 WeakPolarHBondContact O-CB 3.41Å; C186-F190 PolarHBondContact O-N 3.25Å
187K86.6Confident79.8Confident4 Ų434.4 Ų34.42%0.01717%0.171CC..Hα-helixtrans-59.6-45.5179.3-173.3171.2177171.60111.3S168 H183 G184 F190 Q191 W236 N237 L239S168-K187 PolarHBondContact O-NZ 3.45Å; H183-K187 WeakPolarHBondContact O-CB 3.47Å; H183-K187 PolarHBondContact O-N 3.43Å; G184-K187 PolarHBondContact O-N 3.07Å; K187-F190 PolarHBondContact O-N 3.48Å; K187-Q191 VanDerWaalsContact O-CB 3.27Å; K187-Q191 WeakPolarHBondContact O-CB 3.48Å; K187-Q191 PolarHBondContact O-N 3.4Å; K187-W236 HydrophobicContact CD-CZ2 4.37Å; K187-W236 HydrophobicContact CG-CH2 4.4Å; K187-W236 HydrophobicContact CG-CZ2 3.61Å; K187-N237 WeakPolarHBondContact CE-O 3.25Å; K187-N237 PolarHBondContact NZ-O 3.24Å; K187-L239 HydrophobicContact CB-CD1 4.08Å; K187-L239 HydrophobicContact CD-CD1 3.83Å; K187-L239 HydrophobicContact CD-CG 4.12Å; K187-L239 HydrophobicContact CG-CD1 4.07Å; K187-L239 HydrophobicContact CG-CG 4.49Å
188R83.2Confident81.7Confident51 Ų5133.3 Ų33.319%0.19216%0.16CC..Hα-helixtrans-61.2-48.3175.5-80.2-174.6-90.8129.9-6.4113G184 N185 C186 F190 Q191 E192 L239G184-R188 WeakPolarHBondContact O-CG 3.41Å; G184-R188 PolarHBondContact O-N 2.91Å; N185-R188 PolarHBondContact O-N 3.48Å; N185-R188 PolarHBondContact OD1-NH1 2.98Å; N185-R188 VanDerWaalsContact OD1-NH1 3.1Å; N185-R188 PolarHBondContact OD1-NH2 3.35Å; C186-R188 PolarHBondContact O-N 3.18Å; R188-F190 VanDerWaalsContact C-N 3.29Å; R188-F190 PolarHBondContact O-N 3.42Å; R188-Q191 WeakPolarHBondContact O-CB 3.42Å; R188-Q191 PolarHBondContact O-N 2.6Å; R188-E192 PolarHBondContact O-N 2.67Å; R188-L239 HydrophobicContact CG-CB 3.74Å; R188-L239 HydrophobicContact CG-CD1 4.12Å
189L85Confident83.2Confident92 Ų9232.5 Ų32.548%0.48216%0.155SC..Hα-helixtrans-62.2-38.7177.7-72.5172.4000112.1L128 N185 C186L128-L189 HydrophobicContact CD2-CD1 3.44Å; L128-L189 VanDerWaalsContact CD2-CD1 3.44Å; L128-L189 HydrophobicContact CG-CD1 4.38Å; N185-L189 WeakPolarHBondContact O-CG 3.37Å; N185-L189 PolarHBondContact O-N 2.79Å; C186-L189 PolarHBondContact O-N 3.12Å
190F88.8Confident84.7Confident13 Ų1335.4 Ų35.46%0.05717%0.167CC..Iπ-helixtrans-68.9-41.3177.4-175.6-97.1000112.1F138 L163 L164 F167 C186 K187 R188 E192 G194 L195 I198 W236F138-F190 HydrophobicContact CZ-CE2 4.09Å; L163-F190 HydrophobicContact CB-CZ 4.49Å; L164-F190 HydrophobicContact CD1-CE1 4.19Å; F167-F190 HydrophobicContact CB-CB 4.23Å; F167-F190 HydrophobicContact CB-CD1 3.69Å; F167-F190 HydrophobicContact CB-CD2 4.2Å; F167-F190 HydrophobicContact CB-CE1 4.01Å; F167-F190 HydrophobicContact CB-CE2 4.48Å; F167-F190 HydrophobicContact CB-CG 3.78Å; F167-F190 HydrophobicContact CB-CZ 4.38Å; F167-F190 HydrophobicContact CD1-CB 3.39Å; F167-F190 HydrophobicContact CD1-CD1 4.35Å; F167-F190 AromaticContact CD1-CD2 3.69Å; F167-F190 HydrophobicContact CD1-CD2 3.69Å; F167-F190 AromaticContact CD1-CG 3.56Å; F167-F190 HydrophobicContact CD1-CG 3.56Å; F167-F190 AromaticContact CD2-CD2 3.82Å; F167-F190 HydrophobicContact CD2-CD2 3.82Å; F167-F190 AromaticContact CD2-CE2 3.88Å; F167-F190 HydrophobicContact CD2-CE2 3.88Å; F167-F190 HydrophobicContact CD2-CG 4.27Å; F167-F190 HydrophobicContact CD2-CZ 4.38Å; F167-F190 HydrophobicContact CE1-CB 3.83Å; F167-F190 AromaticContact CE1-CD2 3.83Å; F167-F190 HydrophobicContact CE1-CD2 3.83Å; F167-F190 HydrophobicContact CE1-CG 4.08Å; F167-F190 AromaticContact CE2-CD2 3.95Å; F167-F190 HydrophobicContact CE2-CD2 3.95Å; F167-F190 HydrophobicContact CE2-CE2 4.1Å; F167-F190 HydrophobicContact CG-CB 3.98Å; F167-F190 HydrophobicContact CG-CD1 4.07Å; F167-F190 AromaticContact CG-CD2 3.65Å; F167-F190 HydrophobicContact CG-CD2 3.65Å; F167-F190 HydrophobicContact CG-CE1 4.45Å; F167-F190 HydrophobicContact CG-CE2 4.07Å; F167-F190 AromaticContact CG-CG 3.63Å; F167-F190 HydrophobicContact CG-CG 3.63Å; F167-F190 HydrophobicContact CG-CZ 4.44Å; F167-F190 AromaticContact CZ-CD2 3.92Å; F167-F190 HydrophobicContact CZ-CD2 3.92Å; F167-F190 HydrophobicContact CZ-CE2 4.49Å; C186-F190 VanDerWaalsContact O-CB 3.31Å; C186-F190 WeakPolarHBondContact O-CB 3.41Å; C186-F190 PolarHBondContact O-N 3.25Å; K187-F190 PolarHBondContact O-N 3.48Å; R188-F190 VanDerWaalsContact C-N 3.29Å; R188-F190 PolarHBondContact O-N 3.42Å; F190-E192 VanDerWaalsContact C-N 3.28Å; F190-E192 PolarHBondContact O-N 3.07Å; F190-G194 CarbonylContact O-C 3.54Å; F190-G194 WeakPolarHBondContact O-CA 3.26Å; F190-G194 PolarHBondContact O-N 3.31Å; F190-L195 HydrophobicContact CD1-CB 4.1Å; F190-L195 HydrophobicContact CE1-CB 4.02Å; F190-L195 HydrophobicContact CE1-CD1 4.28Å; F190-L195 PolarHBondContact O-N 3.46Å; F190-I198 HydrophobicContact CE1-CD1 4.44Å; F190-I198 HydrophobicContact CE2-CD1 4.46Å; F190-I198 HydrophobicContact CZ-CD1 3.64Å; F190-W236 AromaticContact CD1-CH2 3.63Å; F190-W236 HydrophobicContact CD1-CH2 3.63Å; F190-W236 AromaticContact CD1-CZ2 3.91Å; F190-W236 HydrophobicContact CD1-CZ2 3.91Å; F190-W236 HydrophobicContact CD1-CZ3 4.4Å; F190-W236 AromaticContact CE1-CH2 3.87Å; F190-W236 HydrophobicContact CE1-CH2 3.87Å; F190-W236 HydrophobicContact CE1-CZ2 4.49Å; F190-W236 HydrophobicContact CE1-CZ3 4.21Å
191Q88.9Confident85.9Confident4 Ų435.7 Ų35.72%0.01917%0.169CC..Iπ-helixtrans-57.1-35.6178.3173.9-175.7-55.600113.5K187 R188 L195 F238 L239 W265K187-Q191 VanDerWaalsContact O-CB 3.27Å; K187-Q191 WeakPolarHBondContact O-CB 3.48Å; K187-Q191 PolarHBondContact O-N 3.4Å; R188-Q191 WeakPolarHBondContact O-CB 3.42Å; R188-Q191 PolarHBondContact O-N 2.6Å; Q191-L195 HydrophobicContact CG-CD2 4.46Å; Q191-F238 HydrophobicContact CG-CD1 3.48Å; Q191-F238 VanDerWaalsContact CG-CD1 3.48Å; Q191-F238 HydrophobicContact CG-CE1 3.57Å; Q191-F238 HydrophobicContact CG-CG 4.42Å; Q191-F238 VanDerWaalsContact OE1-CA 3.29Å; Q191-L239 PolarHBondContact NE2-O 2.96Å; Q191-W265 WeakPolarHBondContact O-CZ2 3.45Å; Q191-W265 PolarHBondContact O-NE1 3.22Å; Q191-W265 VanDerWaalsContact O-NE1 3.11Å
192E83.4Confident87.2Confident105 Ų10531.3 Ų31.349%0.49115%0.149SC..Iπ-helixtrans-79.8-37.5-176-70-176.1171.500114.1R188 F190R188-E192 PolarHBondContact O-N 2.67Å; F190-E192 VanDerWaalsContact C-N 3.28Å; F190-E192 PolarHBondContact O-N 3.07Å
193D84.5Confident88.2Confident48 Ų4830.7 Ų30.726%0.25715%0.146SC..Iπ-helixtrans-119.2-55-174.6-164.816.7000112.2K135 R196 Q197K135-D193 WeakPolarHBondContact CE-OD2 3.5Å; K135-D193 IonicContact NZ-OD2 3.63Å; K135-D193 PolarHBondContact NZ-OD2 2.92Å; D193-R196 PolarHBondContact O-N 3.2Å; D193-Q197 WeakPolarHBondContact O-CG 3.39Å; D193-Q197 PolarHBondContact O-N 2.98Å; D193-Q197 PolarHBondContact OD1-NE2 3.3Å
194G89.3Confident88.9Confident6 Ų636.3 Ų36.36%0.06217%0.172CC..Iπ-helixtrans-62.1-54.9-175.300000113.1F190 R196 Q197 I198F190-G194 CarbonylContact O-C 3.54Å; F190-G194 WeakPolarHBondContact O-CA 3.26Å; F190-G194 PolarHBondContact O-N 3.31Å; G194-R196 VanDerWaalsContact C-N 3.27Å; G194-R196 PolarHBondContact O-N 3.33Å; G194-Q197 PolarHBondContact O-N 3.36Å; G194-Q197 VanDerWaalsContact O-N 3.11Å; G194-I198 WeakPolarHBondContact O-CG1 3.45Å; G194-I198 PolarHBondContact O-N 2.93Å
195L93.1Very high89.7Confident0 Ų036.4 Ų36.40%017%0.173CC..Hα-helixtrans-57.5-40.6179.1-176.467.9000111.5L164 F190 Q191 I198 F199 V233 W236 F238 W265L164-L195 HydrophobicContact CD1-CD1 3.26Å; F190-L195 HydrophobicContact CD1-CB 4.1Å; F190-L195 HydrophobicContact CE1-CB 4.02Å; F190-L195 HydrophobicContact CE1-CD1 4.28Å; F190-L195 PolarHBondContact O-N 3.46Å; Q191-L195 HydrophobicContact CG-CD2 4.46Å; L195-I198 PolarHBondContact O-N 3.38Å; L195-F199 PolarHBondContact O-N 2.88Å; L195-V233 HydrophobicContact CD1-CB 4.4Å; L195-V233 HydrophobicContact CD1-CG1 3.92Å; L195-V233 HydrophobicContact CD1-CG2 4.21Å; L195-V233 HydrophobicContact CG-CG1 4.32Å; L195-W236 HydrophobicContact CD1-CB 4.47Å; L195-W236 HydrophobicContact CD1-CD2 4.08Å; L195-W236 HydrophobicContact CD1-CE3 4Å; L195-W236 HydrophobicContact CD1-CG 4.32Å; L195-W236 HydrophobicContact CD1-CZ3 4.49Å; L195-W236 HydrophobicContact CD2-CB 3.88Å; L195-W236 HydrophobicContact CD2-CD2 3.76Å; L195-W236 HydrophobicContact CD2-CG 3.44Å; L195-W236 VanDerWaalsContact CD2-CG 3.44Å; L195-F238 HydrophobicContact CD2-CE1 4.42Å; L195-F238 HydrophobicContact CD2-CZ 4.04Å; L195-W265 HydrophobicContact CB-CH2 4.27Å; L195-W265 HydrophobicContact CB-CZ2 3.9Å; L195-W265 HydrophobicContact CD2-CH2 4.14Å; L195-W265 HydrophobicContact CD2-CZ2 3.76Å; L195-W265 HydrophobicContact CG-CH2 3.77Å; L195-W265 HydrophobicContact CG-CZ2 3.7Å
196R91.7Very high90.5Very high87 Ų8734.4 Ų34.433%0.32816%0.163SC..Hα-helixtrans-64.4-40.7177.1-167176.663.6167.32.7112.2D193 G194 F199 M200 S264 W265D193-R196 PolarHBondContact O-N 3.2Å; G194-R196 VanDerWaalsContact C-N 3.27Å; G194-R196 PolarHBondContact O-N 3.33Å; R196-F199 WeakPolarHBondContact O-CB 3.45Å; R196-F199 PolarHBondContact O-N 3.38Å; R196-M200 VanDerWaalsContact O-CG 3.3Å; R196-M200 WeakPolarHBondContact O-CG 3.38Å; R196-M200 PolarHBondContact O-N 3.31Å; R196-S264 PolarHBondContact NH1-O 2.89Å; R196-W265 VanDerWaalsContact CA-CZ2 3.5Å; R196-W265 HydrophobicContact CB-CD2 4.42Å; R196-W265 HydrophobicContact CB-CH2 3.81Å; R196-W265 HydrophobicContact CB-CZ2 3.61Å; R196-W265 HydrophobicContact CB-CZ3 4.25Å; R196-W265 HydrophobicContact CG-CD2 4.27Å; R196-W265 HydrophobicContact CG-CE3 4.18Å; R196-W265 HydrophobicContact CG-CH2 4.25Å; R196-W265 HydrophobicContact CG-CZ2 4.28Å; R196-W265 HydrophobicContact CG-CZ3 4.17Å; R196-W265 VanDerWaalsContact N-CZ2 3.33Å
197Q91.9Very high91Very high55 Ų5538 Ų3826%0.25718%0.179SC..Hα-helixtrans-64.8-40.1174.6-70.3175.73200112F138 D193 G194 F199 M200 L201F138-Q197 HydrophobicContact CG-CB 4.48Å; D193-Q197 WeakPolarHBondContact O-CG 3.39Å; D193-Q197 PolarHBondContact O-N 2.98Å; D193-Q197 PolarHBondContact OD1-NE2 3.3Å; G194-Q197 PolarHBondContact O-N 3.36Å; G194-Q197 VanDerWaalsContact O-N 3.11Å; Q197-F199 VanDerWaalsContact C-N 3.34Å; Q197-M200 PolarHBondContact O-N 2.98Å; Q197-L201 WeakPolarHBondContact O-CG 3.28Å; Q197-L201 PolarHBondContact O-N 2.85Å
198I94.6Very high91.3Very high0 Ų041.6 Ų41.60%020%0.196CC..Hα-helixtrans-60.3-46.3174-61.3-172.5000110.4F138 L160 F190 G194 L195 M200 L201 T202 L229 V233F138-I198 HydrophobicContact CD1-CG1 4.36Å; F138-I198 HydrophobicContact CE1-CD1 4Å; F138-I198 HydrophobicContact CE1-CG1 3.59Å; F138-I198 HydrophobicContact CZ-CG1 4.37Å; L160-I198 HydrophobicContact CB-CG2 4.3Å; L160-I198 HydrophobicContact CD1-CG2 4.36Å; L160-I198 HydrophobicContact CD2-CD1 4.2Å; L160-I198 HydrophobicContact CD2-CG1 3.96Å; F190-I198 HydrophobicContact CE1-CD1 4.44Å; F190-I198 HydrophobicContact CE2-CD1 4.46Å; F190-I198 HydrophobicContact CZ-CD1 3.64Å; G194-I198 WeakPolarHBondContact O-CG1 3.45Å; G194-I198 PolarHBondContact O-N 2.93Å; L195-I198 PolarHBondContact O-N 3.38Å; I198-M200 PolarHBondContact O-N 3.34Å; I198-L201 PolarHBondContact O-N 3.49Å; I198-T202 WeakPolarHBondContact O-CB 3.36Å; I198-T202 PolarHBondContact O-N 3.01Å; I198-T202 PolarHBondContact O-OG1 3.48Å; I198-L229 HydrophobicContact CG2-CD1 4.25Å; I198-L229 HydrophobicContact CG2-CD2 4.25Å; I198-L229 HydrophobicContact CG2-CG 4.37Å; I198-V233 HydrophobicContact CG2-CG2 3.75Å
199F95.2Very high91.7Very high0 Ų039.2 Ų39.20%019%0.187CC..Hα-helixtrans-56.7-51.8177.5-176.6-108.8000111.5L195 R196 Q197 L201 T202 M203 V233 L234 W265 A268 L269 V274L195-F199 PolarHBondContact O-N 2.88Å; R196-F199 WeakPolarHBondContact O-CB 3.45Å; R196-F199 PolarHBondContact O-N 3.38Å; Q197-F199 VanDerWaalsContact C-N 3.34Å; F199-L201 PolarHBondContact O-N 3.17Å; F199-T202 WeakPolarHBondContact O-CB 3.38Å; F199-T202 PolarHBondContact O-N 3.48Å; F199-T202 VanDerWaalsContact O-N 3.12Å; F199-M203 HydrophobicContact CD1-CG 4.11Å; F199-M203 HydrophobicContact CD2-CE 4.09Å; F199-M203 HydrophobicContact CD2-CG 4.39Å; F199-M203 HydrophobicContact CE1-CG 3.73Å; F199-M203 HydrophobicContact CE1-SD 4.41Å; F199-M203 HydrophobicContact CE2-CE 3.69Å; F199-M203 HydrophobicContact CE2-CG 4.03Å; F199-M203 HydrophobicContact CE2-SD 3.88Å; F199-M203 HydrophobicContact CG-CG 4.43Å; F199-M203 HydrophobicContact CZ-CE 4.19Å; F199-M203 HydrophobicContact CZ-CG 3.68Å; F199-M203 HydrophobicContact CZ-SD 3.75Å; F199-M203 WeakPolarHBondContact O-CG 3.31Å; F199-M203 PolarHBondContact O-N 3.47Å; F199-V233 HydrophobicContact CB-CG1 3.86Å; F199-V233 HydrophobicContact CD2-CG1 3.78Å; F199-V233 HydrophobicContact CG-CG1 4.26Å; F199-L234 HydrophobicContact CD2-CD2 4.48Å; F199-L234 HydrophobicContact CE2-CD2 3.85Å; F199-L234 HydrophobicContact CE2-CG 4.34Å; F199-W265 HydrophobicContact CB-CH2 3.98Å; F199-W265 HydrophobicContact CB-CZ3 3.77Å; F199-W265 AromaticContact CD1-CZ3 3.99Å; F199-W265 HydrophobicContact CD1-CZ3 3.99Å; F199-W265 AromaticContact CG-CZ3 3.88Å; F199-W265 HydrophobicContact CG-CZ3 3.88Å; F199-A268 HydrophobicContact CD1-CB 4.3Å; F199-A268 HydrophobicContact CE1-CB 4.27Å; F199-L269 HydrophobicContact CE1-CD2 3.84Å; F199-L269 HydrophobicContact CE2-CD2 4.17Å; F199-L269 HydrophobicContact CZ-CD2 3.55Å; F199-V274 HydrophobicContact CZ-CG1 3.93Å
200M93.2Very high91.9Very high89 Ų8936.1 Ų36.144%0.43817%0.173SC..Hα-helixtrans-61-45.6-178.4-65.3-58.9-67.200112.6R196 Q197 I198 T202 M203 E204 A268R196-M200 VanDerWaalsContact O-CG 3.3Å; R196-M200 WeakPolarHBondContact O-CG 3.38Å; R196-M200 PolarHBondContact O-N 3.31Å; Q197-M200 PolarHBondContact O-N 2.98Å; I198-M200 PolarHBondContact O-N 3.34Å; M200-T202 VanDerWaalsContact C-N 3.27Å; M200-T202 PolarHBondContact O-N 3.46Å; M200-M203 PolarHBondContact O-N 3.47Å; M200-E204 WeakPolarHBondContact O-CG 3.43Å; M200-E204 PolarHBondContact O-N 3.21Å; M200-A268 HydrophobicContact SD-CB 4.09Å
201L94.2Very high92Very high27 Ų2743.9 Ų43.914%0.14120%0.202CC..Hα-helixtrans-60.8-38.6175.6-72.3172.8000111.8V141 I145 Q197 I198 F199 V205V141-L201 HydrophobicContact CG1-CD1 4.47Å; I145-L201 HydrophobicContact CD1-CB 4.38Å; Q197-L201 WeakPolarHBondContact O-CG 3.28Å; Q197-L201 PolarHBondContact O-N 2.85Å; I198-L201 PolarHBondContact O-N 3.49Å; F199-L201 PolarHBondContact O-N 3.17Å; L201-V205 WeakPolarHBondContact O-CG2 3.22Å; L201-V205 PolarHBondContact O-N 3.4Å
202T96Very high92.1Very high0 Ų047.5 Ų47.50%022%0.216CC..Hα-helixtrans-66.4-43.3177.4-55.10000110.6I198 F199 M200 E204 V205 L206 Y226 L229 A230I198-T202 WeakPolarHBondContact O-CB 3.36Å; I198-T202 PolarHBondContact O-N 3.01Å; I198-T202 PolarHBondContact O-OG1 3.48Å; F199-T202 WeakPolarHBondContact O-CB 3.38Å; F199-T202 PolarHBondContact O-N 3.48Å; F199-T202 VanDerWaalsContact O-N 3.12Å; M200-T202 VanDerWaalsContact C-N 3.27Å; M200-T202 PolarHBondContact O-N 3.46Å; T202-E204 PolarHBondContact O-N 3.28Å; T202-V205 PolarHBondContact O-N 2.99Å; T202-L206 HydrophobicContact CG2-CD1 4.17Å; T202-L206 HydrophobicContact CG2-CG 4.33Å; T202-L206 WeakPolarHBondContact O-CG 3.48Å; T202-L206 PolarHBondContact O-N 3.21Å; T202-Y226 HydrophobicContact CG2-CD1 4.23Å; T202-Y226 WeakPolarHBondContact CG2-O 3.42Å; T202-L229 WeakPolarHBondContact OG1-CD2 3.31Å; T202-A230 HydrophobicContact CG2-CB 3.74Å
203M95.1Very high92Very high16 Ų1650.7 Ų50.78%0.07923%0.231CC..Hα-helixtrans-63.7-39.2177.5-67.5-52.197.700112.3F199 M200 V205 L206 Q207 A230 V274 L277 F278F199-M203 HydrophobicContact CD1-CG 4.11Å; F199-M203 HydrophobicContact CD2-CE 4.09Å; F199-M203 HydrophobicContact CD2-CG 4.39Å; F199-M203 HydrophobicContact CE1-CG 3.73Å; F199-M203 HydrophobicContact CE1-SD 4.41Å; F199-M203 HydrophobicContact CE2-CE 3.69Å; F199-M203 HydrophobicContact CE2-CG 4.03Å; F199-M203 HydrophobicContact CE2-SD 3.88Å; F199-M203 HydrophobicContact CG-CG 4.43Å; F199-M203 HydrophobicContact CZ-CE 4.19Å; F199-M203 HydrophobicContact CZ-CG 3.68Å; F199-M203 HydrophobicContact CZ-SD 3.75Å; F199-M203 WeakPolarHBondContact O-CG 3.31Å; F199-M203 PolarHBondContact O-N 3.47Å; M200-M203 PolarHBondContact O-N 3.47Å; M203-V205 VanDerWaalsContact C-N 3.34Å; M203-V205 PolarHBondContact O-N 3.24Å; M203-L206 HydrophobicContact CE-CD1 3.66Å; M203-L206 PolarHBondContact O-N 3.04Å; M203-Q207 WeakPolarHBondContact O-CB 3.5Å; M203-Q207 PolarHBondContact O-N 3.07Å; M203-A230 HydrophobicContact CE-CB 3.9Å; M203-V274 HydrophobicContact SD-CG1 4.23Å; M203-L277 HydrophobicContact SD-CD2 4.34Å; M203-F278 HydrophobicContact CE-CE2 4.16Å; M203-F278 HydrophobicContact CE-CZ 3.66Å; M203-F278 HydrophobicContact SD-CE2 3.79Å; M203-F278 HydrophobicContact SD-CZ 3.92Å
204E92.9Very high92Very high123 Ų12355.3 Ų55.358%0.57526%0.255SS*.Hα-helixtrans-58.7-45.8174.8-74.1175.8-176.500111.5M200 T202 E208M200-E204 WeakPolarHBondContact O-CG 3.43Å; M200-E204 PolarHBondContact O-N 3.21Å; T202-E204 PolarHBondContact O-N 3.28Å; E204-E208 PolarHBondContact O-N 2.85Å
205V94.3Very high91.9Very high2 Ų257 Ų571%0.01226%0.263CS..Hα-helixtrans-65.3-51177176.50000110.7I145 L201 T202 M203 Q207 E208 F209 Y226I145-V205 HydrophobicContact CD1-CG2 4.44Å; I145-V205 HydrophobicContact CG2-CG2 3.52Å; L201-V205 WeakPolarHBondContact O-CG2 3.22Å; L201-V205 PolarHBondContact O-N 3.4Å; T202-V205 PolarHBondContact O-N 2.99Å; M203-V205 VanDerWaalsContact C-N 3.34Å; M203-V205 PolarHBondContact O-N 3.24Å; V205-Q207 VanDerWaalsContact C-N 3.26Å; V205-Q207 PolarHBondContact O-N 3.11Å; V205-E208 WeakPolarHBondContact O-CB 3.25Å; V205-E208 PolarHBondContact O-N 3.03Å; V205-F209 HydrophobicContact CG1-CD2 3.63Å; V205-F209 HydrophobicContact CG1-CE2 3.66Å; V205-F209 VanDerWaalsContact O-CD2 3.27Å; V205-F209 WeakPolarHBondContact O-CD2 3.32Å; V205-F209 PolarHBondContact O-N 2.82Å; V205-Y226 HydrophobicContact CB-CD1 3.95Å; V205-Y226 HydrophobicContact CB-CE1 4.19Å; V205-Y226 HydrophobicContact CB-CG 4.18Å; V205-Y226 HydrophobicContact CG1-CD1 3.92Å; V205-Y226 HydrophobicContact CG1-CD2 3.74Å; V205-Y226 HydrophobicContact CG1-CE1 4.27Å; V205-Y226 HydrophobicContact CG1-CE2 4.11Å; V205-Y226 HydrophobicContact CG1-CG 3.65Å; V205-Y226 HydrophobicContact CG2-CD1 4.13Å; V205-Y226 HydrophobicContact CG2-CE1 3.84Å
206L95.6Very high91.7Very high0 Ų060.8 Ų60.80%028%0.283CS..Hα-helixtrans-60.3-36.6179.8-67.9-177.1000112.3T202 M203 F209 S210 F223 L227 A230 L277 F278 I281T202-L206 HydrophobicContact CG2-CD1 4.17Å; T202-L206 HydrophobicContact CG2-CG 4.33Å; T202-L206 WeakPolarHBondContact O-CG 3.48Å; T202-L206 PolarHBondContact O-N 3.21Å; M203-L206 HydrophobicContact CE-CD1 3.66Å; M203-L206 PolarHBondContact O-N 3.04Å; L206-F209 PolarHBondContact O-N 2.85Å; L206-S210 VanDerWaalsContact O-CB 3.28Å; L206-S210 WeakPolarHBondContact O-CB 3.37Å; L206-S210 PolarHBondContact O-N 3.09Å; L206-S210 PolarHBondContact O-OG 3.01Å; L206-F223 HydrophobicContact CD2-CD2 3.68Å; L206-F223 HydrophobicContact CD2-CE2 3.51Å; L206-L227 HydrophobicContact CD1-CD1 4.42Å; L206-L227 HydrophobicContact CD2-CB 4.23Å; L206-A230 HydrophobicContact CD1-CB 3.85Å; L206-L277 HydrophobicContact CB-CD2 4.35Å; L206-F278 HydrophobicContact CD1-CE1 4.18Å; L206-F278 HydrophobicContact CD1-CZ 4.42Å; L206-I281 HydrophobicContact CB-CD1 3.79Å; L206-I281 HydrophobicContact CD1-CD1 4.26Å; L206-I281 HydrophobicContact CG-CD1 4.41Å
207Q94.6Very high91.6Very high77 Ų7760.9 Ų60.936%0.3630%0.302SS..Hα-helixtrans-66.8-37.5174.5-167.4-177.861.300112.2M203 V205 S210 R211 L277M203-Q207 WeakPolarHBondContact O-CB 3.5Å; M203-Q207 PolarHBondContact O-N 3.07Å; V205-Q207 VanDerWaalsContact C-N 3.26Å; V205-Q207 PolarHBondContact O-N 3.11Å; Q207-S210 WeakPolarHBondContact CA-OG 3.36Å; Q207-S210 PolarHBondContact O-OG 3.19Å; Q207-R211 VanDerWaalsContact NE2-NH2 3.15Å; Q207-R211 WeakPolarHBondContact O-CG 3.35Å; Q207-R211 PolarHBondContact O-N 2.96Å; Q207-L277 HydrophobicContact CB-CD1 4.38Å; Q207-L277 HydrophobicContact CB-CD2 4.17Å
208E91.8Very high91.4Very high79 Ų7963.9 Ų63.937%0.36932%0.316SS..Hα-helixtrans-67.1-45.4174.8-171.8-179.8-175.800111.7E204 V205 R211 R212E204-E208 PolarHBondContact O-N 2.85Å; V205-E208 WeakPolarHBondContact O-CB 3.25Å; V205-E208 PolarHBondContact O-N 3.03Å; E208-R211 PolarHBondContact O-N 3.24Å; E208-R212 WeakPolarHBondContact O-CG 3.47Å; E208-R212 IonicContact OE1-CZ 3.53Å; E208-R212 IonicContact OE1-NE 3.77Å; E208-R212 IonicContact OE1-NH2 2.64Å; E208-R212 PolarHBondContact OE1-NH2 3.29Å
209F90.9Very high91.2Very high1 Ų165.9 Ų65.90%0.00433%0.326CS..Hα-helixtrans-71.3-33.3-178.6-83.3-101.3000112.9V205 L206 R211 R212 L215 M219 V222 F223 K284V205-F209 HydrophobicContact CG1-CD2 3.63Å; V205-F209 HydrophobicContact CG1-CE2 3.66Å; V205-F209 VanDerWaalsContact O-CD2 3.27Å; V205-F209 WeakPolarHBondContact O-CD2 3.32Å; V205-F209 PolarHBondContact O-N 2.82Å; L206-F209 PolarHBondContact O-N 2.85Å; F209-R211 PolarHBondContact O-N 3.47Å; F209-R212 PolarHBondContact O-N 3.43Å; F209-L215 HydrophobicContact CD1-CD1 4.04Å; F209-L215 HydrophobicContact CD1-CD2 3.79Å; F209-L215 HydrophobicContact CE1-CD2 4.33Å; F209-M219 HydrophobicContact CE1-CB 3.86Å; F209-M219 HydrophobicContact CE1-CG 4.33Å; F209-M219 VanDerWaalsContact CE1-O 3.23Å; F209-M219 WeakPolarHBondContact CE1-O 3.28Å; F209-V222 HydrophobicContact CE1-CB 4.32Å; F209-V222 HydrophobicContact CE1-CG1 4.29Å; F209-V222 HydrophobicContact CE2-CG1 4.14Å; F209-V222 HydrophobicContact CZ-CB 4.06Å; F209-V222 HydrophobicContact CZ-CG1 3.62Å; F209-F223 HydrophobicContact CB-CD1 4.45Å; F209-F223 HydrophobicContact CB-CD2 3.66Å; F209-F223 HydrophobicContact CB-CE2 3.88Å; F209-F223 HydrophobicContact CB-CG 3.98Å; F209-F223 HydrophobicContact CB-CZ 4.38Å; F209-F223 HydrophobicContact CD1-CB 3.75Å; F209-F223 HydrophobicContact CD1-CD2 4.46Å; F209-F223 HydrophobicContact CD1-CG 4.1Å; F209-F223 HydrophobicContact CE1-CB 4.28Å; F209-F223 HydrophobicContact CG-CB 4.32Å; F209-F223 HydrophobicContact CG-CD2 4.21Å; F209-F223 HydrophobicContact CG-CG 4.3Å; F209-K284 PolarHBondContact O-NZ 3.41Å
210S90.9Very high90.9Very high27 Ų2768 Ų6819%0.18934%0.34CS..Hα-helixtrans-63.1-39.7174.3580000112.1L206 Q207 R212 L277 K284L206-S210 VanDerWaalsContact O-CB 3.28Å; L206-S210 WeakPolarHBondContact O-CB 3.37Å; L206-S210 PolarHBondContact O-N 3.09Å; L206-S210 PolarHBondContact O-OG 3.01Å; Q207-S210 WeakPolarHBondContact CA-OG 3.36Å; Q207-S210 PolarHBondContact O-OG 3.19Å; S210-R212 VanDerWaalsContact C-N 3.32Å; S210-R212 PolarHBondContact O-N 3.07Å; S210-L277 WeakPolarHBondContact OG-CD1 3.26Å; S210-K284 PolarHBondContact O-NZ 2.98Å
211R90.4Very high90.9Very high175 Ų17566.2 Ų66.266%0.6634%0.336SS*.Hα-helixtrans-68.6-21.1178.5-71.2175.8-177.1144.93.6115Q207 E208 F209Q207-R211 VanDerWaalsContact NE2-NH2 3.15Å; Q207-R211 WeakPolarHBondContact O-CG 3.35Å; Q207-R211 PolarHBondContact O-N 2.96Å; E208-R211 PolarHBondContact O-N 3.24Å; F209-R211 PolarHBondContact O-N 3.47Å
212R89.8Confident90.8Very high81 Ų8164.9 Ų64.931%0.30633%0.329SS..  trans-87.5115.6-177.2-69175.2-179.1-161.62.2110.9E208 F209 S210 N214 L215 K284E208-R212 WeakPolarHBondContact O-CG 3.47Å; E208-R212 IonicContact OE1-CZ 3.53Å; E208-R212 IonicContact OE1-NE 3.77Å; E208-R212 IonicContact OE1-NH2 2.64Å; E208-R212 PolarHBondContact OE1-NH2 3.29Å; F209-R212 PolarHBondContact O-N 3.43Å; S210-R212 VanDerWaalsContact C-N 3.32Å; S210-R212 PolarHBondContact O-N 3.07Å; R212-N214 PolarHBondContact O-N 2.92Å; R212-L215 HydrophobicContact CB-CD2 3.97Å; R212-K284 PolarHBondContact O-NZ 2.86Å
213E82.4Confident90.8Very high172 Ų17265 Ų6580%0.80433%0.33SS*.SBendtrans-62.2-45.4-176.5-70.2-178.7172.800114
214N84.6Confident90.8Very high145 Ų14567.2 Ų67.278%0.77534%0.34SS*.  trans-114.6118.2-175.8-66.9-53.3000111.5R212R212-N214 PolarHBondContact O-N 2.92Å
215L87.3Confident90.9Very high41 Ų4165.1 Ų65.122%0.21533%0.327CS..  trans-101.8135.9174-57.6179.8000109.7F209 R212 M219 S220 F223F209-L215 HydrophobicContact CD1-CD1 4.04Å; F209-L215 HydrophobicContact CD1-CD2 3.79Å; F209-L215 HydrophobicContact CE1-CD2 4.33Å; R212-L215 HydrophobicContact CB-CD2 3.97Å; L215-M219 HydrophobicContact CB-CB 4.1Å; L215-M219 HydrophobicContact CD2-CB 4.24Å; L215-S220 WeakPolarHBondContact CB-OG 3.15Å; L215-F223 HydrophobicContact CD1-CB 4.21Å; L215-F223 HydrophobicContact CD1-CD1 3.52Å; L215-F223 HydrophobicContact CD1-CE1 4.23Å; L215-F223 HydrophobicContact CD1-CG 4.19Å
216N88.8Confident91Very high80 Ų8065.1 Ų65.143%0.42833%0.327SS..  trans-78.4166.6167.869.538.1000110.3Q218 M219 S220N216-Q218 VanDerWaalsContact C-N 3.26Å; N216-Q218 PolarHBondContact O-N 3.44Å; N216-Q218 VanDerWaalsContact O-N 3.13Å; N216-Q218 PolarHBondContact OD1-N 2.86Å; N216-Q218 VanDerWaalsContact OD1-N 3.15Å; N216-M219 CarbonylContact O-C 3.57Å; N216-M219 WeakPolarHBondContact O-CA 3.49Å; N216-M219 WeakPolarHBondContact O-CB 3.1Å; N216-M219 PolarHBondContact O-N 3Å; N216-M219 WeakPolarHBondContact OD1-CB 3.48Å; N216-M219 WeakPolarHBondContact OD1-CG 3.5Å; N216-M219 PolarHBondContact OD1-N 2.85Å; N216-S220 PolarHBondContact O-N 2.95Å; N216-S220 PolarHBondContact O-OG 3.15Å
217A88.1Confident91Very high88 Ų8865.1 Ų65.173%0.72733%0.327SS*.Hα-helixtrans-54.5-36.9-176.200000114.4C221A217-C221 WeakPolarHBondContact O-CB 3.25Å; A217-C221 PolarHBondContact O-N 2.65Å; A217-C221 VanDerWaalsContact O-N 3.08Å
218Q88.4Confident91.1Very high119 Ų11962.7 Ų62.756%0.55632%0.32SS*.Hα-helixtrans-71-39.2177.1-67.8-177.9-9.100111.7P150 N216 C221 V222P150-Q218 HydrophobicContact CB-CB 3.97Å; P150-Q218 HydrophobicContact CG-CB 4.31Å; N216-Q218 VanDerWaalsContact C-N 3.26Å; N216-Q218 PolarHBondContact O-N 3.44Å; N216-Q218 VanDerWaalsContact O-N 3.13Å; N216-Q218 PolarHBondContact OD1-N 2.86Å; N216-Q218 VanDerWaalsContact OD1-N 3.15Å; Q218-C221 PolarHBondContact O-N 3.31Å; Q218-V222 WeakPolarHBondContact O-CG2 3.47Å; Q218-V222 PolarHBondContact O-N 3.47Å
219M89.6Confident91.3Very high42 Ų4259 Ų5921%0.20730%0.302CS..Hα-helixtrans-67-41.1175.4-73.7-180-178.500111.4P150 F209 L215 N216 C221 V222 F223P150-M219 HydrophobicContact CG-CG 4.44Å; F209-M219 HydrophobicContact CE1-CB 3.86Å; F209-M219 HydrophobicContact CE1-CG 4.33Å; F209-M219 VanDerWaalsContact CE1-O 3.23Å; F209-M219 WeakPolarHBondContact CE1-O 3.28Å; L215-M219 HydrophobicContact CB-CB 4.1Å; L215-M219 HydrophobicContact CD2-CB 4.24Å; N216-M219 CarbonylContact O-C 3.57Å; N216-M219 WeakPolarHBondContact O-CA 3.49Å; N216-M219 WeakPolarHBondContact O-CB 3.1Å; N216-M219 PolarHBondContact O-N 3Å; N216-M219 WeakPolarHBondContact OD1-CB 3.48Å; N216-M219 WeakPolarHBondContact OD1-CG 3.5Å; N216-M219 PolarHBondContact OD1-N 2.85Å; M219-C221 VanDerWaalsContact C-N 3.33Å; M219-C221 PolarHBondContact O-N 3.02Å; M219-V222 PolarHBondContact O-N 2.93Å; M219-F223 WeakPolarHBondContact O-CB 3.37Å; M219-F223 PolarHBondContact O-N 3.46Å
220S90.9Very high91.6Very high43 Ų4358.9 Ų58.930%0.30130%0.302SS..Hα-helixtrans-61.2-42.5173.6-56.80000111.3L215 N216 V222 F223 Q224L215-S220 WeakPolarHBondContact CB-OG 3.15Å; N216-S220 PolarHBondContact O-N 2.95Å; N216-S220 PolarHBondContact O-OG 3.15Å; S220-V222 VanDerWaalsContact C-N 3.33Å; S220-V222 PolarHBondContact O-N 2.95Å; S220-F223 WeakPolarHBondContact O-CB 3.5Å; S220-F223 PolarHBondContact O-N 3Å; S220-F223 VanDerWaalsContact O-N 3.12Å; S220-Q224 PolarHBondContact O-N 2.86Å
221C91.3Very high91.8Very high52 Ų5258.8 Ų58.835%0.35130%0.299SS..Hα-helixtrans-62.9-37.6174.9-174.60000112.7A217 Q218 M219 R225A217-C221 WeakPolarHBondContact O-CB 3.25Å; A217-C221 PolarHBondContact O-N 2.65Å; A217-C221 VanDerWaalsContact O-N 3.08Å; Q218-C221 PolarHBondContact O-N 3.31Å; M219-C221 VanDerWaalsContact C-N 3.33Å; M219-C221 PolarHBondContact O-N 3.02Å; C221-R225 WeakPolarHBondContact O-CG 3.28Å; C221-R225 PolarHBondContact O-N 3.45Å
222V93.5Very high92Very high0 Ų054.4 Ų54.40%029%0.286CS..Hα-helixtrans-63.9-46.1171.91730000110P150 Q153 T154 F209 Q218 M219 S220 Q224 R225 Y226P150-V222 HydrophobicContact CB-CG2 3.87Å; P150-V222 WeakPolarHBondContact O-CG2 3.38Å; Q153-V222 HydrophobicContact CB-CG1 4.02Å; Q153-V222 HydrophobicContact CB-CG2 4.39Å; T154-V222 WeakPolarHBondContact OG1-CG2 3.49Å; F209-V222 HydrophobicContact CE1-CB 4.32Å; F209-V222 HydrophobicContact CE1-CG1 4.29Å; F209-V222 HydrophobicContact CE2-CG1 4.14Å; F209-V222 HydrophobicContact CZ-CB 4.06Å; F209-V222 HydrophobicContact CZ-CG1 3.62Å; Q218-V222 WeakPolarHBondContact O-CG2 3.47Å; Q218-V222 PolarHBondContact O-N 3.47Å; M219-V222 PolarHBondContact O-N 2.93Å; S220-V222 VanDerWaalsContact C-N 3.33Å; S220-V222 PolarHBondContact O-N 2.95Å; V222-Q224 PolarHBondContact O-N 3.18Å; V222-R225 PolarHBondContact O-N 2.9Å; V222-Y226 HydrophobicContact CG1-CD2 3.66Å; V222-Y226 HydrophobicContact CG1-CE2 3.78Å; V222-Y226 WeakPolarHBondContact O-CD2 3.4Å; V222-Y226 PolarHBondContact O-N 3.06Å
223F94.9Very high92.2Very high2 Ų250.7 Ų50.71%0.00927%0.273CS..Hα-helixtrans-59.9-47.6-179.2-169.5-157.2000111.9L206 F209 L215 M219 S220 R225 Y226 L227 I281 I285 M291L206-F223 HydrophobicContact CD2-CD2 3.68Å; L206-F223 HydrophobicContact CD2-CE2 3.51Å; F209-F223 HydrophobicContact CB-CD1 4.45Å; F209-F223 HydrophobicContact CB-CD2 3.66Å; F209-F223 HydrophobicContact CB-CE2 3.88Å; F209-F223 HydrophobicContact CB-CG 3.98Å; F209-F223 HydrophobicContact CB-CZ 4.38Å; F209-F223 HydrophobicContact CD1-CB 3.75Å; F209-F223 HydrophobicContact CD1-CD2 4.46Å; F209-F223 HydrophobicContact CD1-CG 4.1Å; F209-F223 HydrophobicContact CE1-CB 4.28Å; F209-F223 HydrophobicContact CG-CB 4.32Å; F209-F223 HydrophobicContact CG-CD2 4.21Å; F209-F223 HydrophobicContact CG-CG 4.3Å; L215-F223 HydrophobicContact CD1-CB 4.21Å; L215-F223 HydrophobicContact CD1-CD1 3.52Å; L215-F223 HydrophobicContact CD1-CE1 4.23Å; L215-F223 HydrophobicContact CD1-CG 4.19Å; M219-F223 WeakPolarHBondContact O-CB 3.37Å; M219-F223 PolarHBondContact O-N 3.46Å; S220-F223 WeakPolarHBondContact O-CB 3.5Å; S220-F223 PolarHBondContact O-N 3Å; S220-F223 VanDerWaalsContact O-N 3.12Å; F223-R225 VanDerWaalsContact C-N 3.35Å; F223-R225 PolarHBondContact O-N 2.75Å; F223-Y226 PolarHBondContact O-N 2.91Å; F223-L227 WeakPolarHBondContact O-CB 3.35Å; F223-L227 PolarHBondContact O-N 3.43Å; F223-I281 HydrophobicContact CE2-CD1 4.44Å; F223-I281 HydrophobicContact CE2-CG2 4.38Å; F223-I281 HydrophobicContact CZ-CG1 4.14Å; F223-I281 HydrophobicContact CZ-CG2 3.84Å; F223-I285 HydrophobicContact CD1-CG2 4.28Å; F223-I285 HydrophobicContact CE1-CG2 3.57Å; F223-I285 HydrophobicContact CZ-CG2 4.34Å; F223-M291 HydrophobicContact CB-CE 4.27Å; F223-M291 HydrophobicContact CD1-CE 3.57Å; F223-M291 HydrophobicContact CE1-CE 4Å; F223-M291 HydrophobicContact CG-CE 3.89Å
224Q94.8Very high92.8Very high63 Ų6342.7 Ų42.729%0.29424%0.235SC..Hα-helixtrans-55-47.4174.1-175.2-177.822.500111.7S220 V222 Y226 L227 A228 M291S220-Q224 PolarHBondContact O-N 2.86Å; V222-Q224 PolarHBondContact O-N 3.18Å; Q224-Y226 PolarHBondContact O-N 3.2Å; Q224-L227 PolarHBondContact O-N 3.47Å; Q224-A228 WeakPolarHBondContact O-CB 3.45Å; Q224-A228 PolarHBondContact O-N 3.3Å; Q224-M291 HydrophobicContact CB-CE 4.3Å; Q224-M291 HydrophobicContact CB-CG 4.06Å; Q224-M291 HydrophobicContact CB-SD 3.98Å; Q224-M291 HydrophobicContact CG-CG 3.9Å; Q224-M291 HydrophobicContact CG-SD 4.48Å
225R94.8Very high93.1Very high79 Ų7937.3 Ų37.330%0.29821%0.209SC..Hα-helixtrans-63.6-40.7179.7-74.1175.7175.6-118.8-5.7113.3T154 C157 C221 V222 F223 L229T154-R225 VanDerWaalsContact CG2-CZ 3.41Å; C157-R225 PolarHBondContact SG-O 3.36Å; C221-R225 WeakPolarHBondContact O-CG 3.28Å; C221-R225 PolarHBondContact O-N 3.45Å; V222-R225 PolarHBondContact O-N 2.9Å; F223-R225 VanDerWaalsContact C-N 3.35Å; F223-R225 PolarHBondContact O-N 2.75Å; R225-L229 WeakPolarHBondContact O-CB 3.37Å; R225-L229 PolarHBondContact O-N 2.98Å
226Y96.8Very high93.3Very high1 Ų135.5 Ų35.50%0.00420%0.199CC..Hα-helixtrans-72.5-30.6177.2-85.7-84.8000112.3I145 Q153 C157 T202 V205 V222 F223 Q224 L229 A230I145-Y226 HydrophobicContact CD1-CE1 4.25Å; I145-Y226 WeakPolarHBondContact CD1-OH 3.41Å; I145-Y226 VanDerWaalsContact CG1-OH 3.3Å; I145-Y226 WeakPolarHBondContact CG1-OH 3.47Å; Q153-Y226 HydrophobicContact CB-CE2 4.43Å; Q153-Y226 PolarHBondContact O-OH 3.5Å; C157-Y226 HydrophobicContact CB-CD2 4.22Å; C157-Y226 HydrophobicContact CB-CE1 4.35Å; C157-Y226 HydrophobicContact CB-CE2 3.74Å; T202-Y226 HydrophobicContact CG2-CD1 4.23Å; T202-Y226 WeakPolarHBondContact CG2-O 3.42Å; V205-Y226 HydrophobicContact CB-CD1 3.95Å; V205-Y226 HydrophobicContact CB-CE1 4.19Å; V205-Y226 HydrophobicContact CB-CG 4.18Å; V205-Y226 HydrophobicContact CG1-CD1 3.92Å; V205-Y226 HydrophobicContact CG1-CD2 3.74Å; V205-Y226 HydrophobicContact CG1-CE1 4.27Å; V205-Y226 HydrophobicContact CG1-CE2 4.11Å; V205-Y226 HydrophobicContact CG1-CG 3.65Å; V205-Y226 HydrophobicContact CG2-CD1 4.13Å; V205-Y226 HydrophobicContact CG2-CE1 3.84Å; V222-Y226 HydrophobicContact CG1-CD2 3.66Å; V222-Y226 HydrophobicContact CG1-CE2 3.78Å; V222-Y226 WeakPolarHBondContact O-CD2 3.4Å; V222-Y226 PolarHBondContact O-N 3.06Å; F223-Y226 PolarHBondContact O-N 2.91Å; Q224-Y226 PolarHBondContact O-N 3.2Å; Y226-L229 HydrophobicContact CD1-CD2 4.27Å; Y226-L229 HydrophobicContact CE1-CD2 4.42Å; Y226-L229 PolarHBondContact O-N 3.46Å; Y226-A230 PolarHBondContact O-N 2.88Å
227L97Very high93.3Very high0 Ų032.8 Ų32.80%019%0.185CC..Hα-helixtrans-68.6-47173.3-175.464000110.9L206 F223 Q224 L229 A230 N231 F278 I281 I285 M291 D294L206-L227 HydrophobicContact CD1-CD1 4.42Å; L206-L227 HydrophobicContact CD2-CB 4.23Å; F223-L227 WeakPolarHBondContact O-CB 3.35Å; F223-L227 PolarHBondContact O-N 3.43Å; Q224-L227 PolarHBondContact O-N 3.47Å; L227-L229 VanDerWaalsContact C-N 3.26Å; L227-L229 PolarHBondContact O-N 3.2Å; L227-A230 WeakPolarHBondContact O-CA 3.36Å; L227-A230 WeakPolarHBondContact O-CB 3.45Å; L227-A230 PolarHBondContact O-N 2.86Å; L227-N231 PolarHBondContact O-N 3.48Å; L227-F278 HydrophobicContact CD1-CE1 4.31Å; L227-I281 HydrophobicContact CD1-CG2 4.16Å; L227-I285 HydrophobicContact CD2-CD1 3.48Å; L227-I285 VanDerWaalsContact CD2-CD1 3.48Å; L227-M291 HydrophobicContact CD2-CB 4.38Å; L227-M291 HydrophobicContact CD2-CE 4.14Å; L227-M291 WeakPolarHBondContact CD2-O 3.38Å; L227-D294 HydrophobicContact CD2-CB 3.92Å; L227-D294 HydrophobicContact CG-CB 3.92Å
228A95.9Very high93.3Very high26 Ų2629 Ų2922%0.21515%0.152CC..Hα-helixtrans-59-37.1171.900000112Q224 N231 Q232Q224-A228 WeakPolarHBondContact O-CB 3.45Å; Q224-A228 PolarHBondContact O-N 3.3Å; A228-N231 WeakPolarHBondContact O-CB 3.26Å; A228-N231 PolarHBondContact O-N 3.37Å; A228-Q232 WeakPolarHBondContact O-CG 3.37Å; A228-Q232 PolarHBondContact O-N 3.33Å
229L96.2Very high93Very high1 Ų123.6 Ų23.61%0.00513%0.127CC..Hα-helixtrans-64.3-41.9173179.563.1000111.7L160 L164 I198 T202 R225 Y226 L227 N231 Q232 V233L160-L229 HydrophobicContact CB-CD1 4.31Å; L160-L229 HydrophobicContact CB-CD2 3.78Å; L160-L229 HydrophobicContact CD1-CD2 3.83Å; L160-L229 HydrophobicContact CG-CD2 4.46Å; L164-L229 HydrophobicContact CD2-CD1 4.01Å; I198-L229 HydrophobicContact CG2-CD1 4.25Å; I198-L229 HydrophobicContact CG2-CD2 4.25Å; I198-L229 HydrophobicContact CG2-CG 4.37Å; T202-L229 WeakPolarHBondContact OG1-CD2 3.31Å; R225-L229 WeakPolarHBondContact O-CB 3.37Å; R225-L229 PolarHBondContact O-N 2.98Å; Y226-L229 HydrophobicContact CD1-CD2 4.27Å; Y226-L229 HydrophobicContact CE1-CD2 4.42Å; Y226-L229 PolarHBondContact O-N 3.46Å; L227-L229 VanDerWaalsContact C-N 3.26Å; L227-L229 PolarHBondContact O-N 3.2Å; L229-N231 VanDerWaalsContact C-N 3.33Å; L229-Q232 PolarHBondContact O-N 2.91Å; L229-V233 HydrophobicContact CD1-CG2 4.42Å; L229-V233 VanDerWaalsContact O-CG2 3.26Å; L229-V233 WeakPolarHBondContact O-CG2 3.29Å; L229-V233 PolarHBondContact O-N 3.39Å
230A97.2Very high92.2Very high0 Ų024 Ų240%013%0.133CC..Hα-helixtrans-61.5-43.2174.700000111.5T202 M203 L206 Y226 L227 Q232 V233 L234 F278T202-A230 HydrophobicContact CG2-CB 3.74Å; M203-A230 HydrophobicContact CE-CB 3.9Å; L206-A230 HydrophobicContact CD1-CB 3.85Å; Y226-A230 PolarHBondContact O-N 2.88Å; L227-A230 WeakPolarHBondContact O-CA 3.36Å; L227-A230 WeakPolarHBondContact O-CB 3.45Å; L227-A230 PolarHBondContact O-N 2.86Å; A230-Q232 PolarHBondContact O-N 3.18Å; A230-V233 PolarHBondContact O-N 3.06Å; A230-L234 WeakPolarHBondContact O-CG 3.37Å; A230-L234 PolarHBondContact O-N 2.9Å; A230-F278 HydrophobicContact CB-CE1 4.15Å; A230-F278 HydrophobicContact CB-CZ 4.07Å
231N95.2Very high91Very high24 Ų2427 Ų2713%0.12815%0.151CC..Hα-helixtrans-56.9-49.6175.3-1775.9000111.1L227 A228 L229 V233 L234 S235 D294 Q297 C298L227-N231 PolarHBondContact O-N 3.48Å; A228-N231 WeakPolarHBondContact O-CB 3.26Å; A228-N231 PolarHBondContact O-N 3.37Å; L229-N231 VanDerWaalsContact C-N 3.33Å; N231-V233 VanDerWaalsContact C-N 3.31Å; N231-V233 PolarHBondContact O-N 3.24Å; N231-L234 PolarHBondContact O-N 3.02Å; N231-S235 VanDerWaalsContact O-CB 3.27Å; N231-S235 WeakPolarHBondContact O-CB 3.23Å; N231-S235 PolarHBondContact O-N 3.09Å; N231-S235 PolarHBondContact O-OG 3.11Å; N231-S235 PolarHBondContact OD1-OG 3.03Å; N231-D294 PolarHBondContact ND2-OD1 2.89Å; N231-Q297 WeakPolarHBondContact OD1-CG 3.44Å; N231-C298 WeakPolarHBondContact CA-SG 3.38Å; N231-C298 PolarHBondContact N-SG 3.45Å; N231-C298 VanDerWaalsContact N-SG 3.43Å
232Q93.5Very high89.6Confident83 Ų8331.7 Ų31.739%0.38817%0.173SC..Hα-helixtrans-63-34.6177.1-70179.60.800113.4L164 A228 L229 A230 W236L164-Q232 HydrophobicContact CD2-CB 3.47Å; L164-Q232 VanDerWaalsContact CD2-CB 3.47Å; A228-Q232 WeakPolarHBondContact O-CG 3.37Å; A228-Q232 PolarHBondContact O-N 3.33Å; L229-Q232 PolarHBondContact O-N 2.91Å; A230-Q232 PolarHBondContact O-N 3.18Å; Q232-W236 PolarHBondContact O-N 2.97Å
233V94.8Very high88.1Confident3 Ų333 Ų332%0.01818%0.18CC..Hα-helixtrans-70.1-43.3177.4168.80000111.2L164 L195 I198 F199 L229 A230 N231 S235 W236L164-V233 HydrophobicContact CD1-CG2 4.17Å; L164-V233 HydrophobicContact CD2-CG2 3.84Å; L195-V233 HydrophobicContact CD1-CB 4.4Å; L195-V233 HydrophobicContact CD1-CG1 3.92Å; L195-V233 HydrophobicContact CD1-CG2 4.21Å; L195-V233 HydrophobicContact CG-CG1 4.32Å; I198-V233 HydrophobicContact CG2-CG2 3.75Å; F199-V233 HydrophobicContact CB-CG1 3.86Å; F199-V233 HydrophobicContact CD2-CG1 3.78Å; F199-V233 HydrophobicContact CG-CG1 4.26Å; L229-V233 HydrophobicContact CD1-CG2 4.42Å; L229-V233 VanDerWaalsContact O-CG2 3.26Å; L229-V233 WeakPolarHBondContact O-CG2 3.29Å; L229-V233 PolarHBondContact O-N 3.39Å; A230-V233 PolarHBondContact O-N 3.06Å; N231-V233 VanDerWaalsContact C-N 3.31Å; N231-V233 PolarHBondContact O-N 3.24Å; V233-S235 VanDerWaalsContact C-N 3.34Å; V233-W236 WeakPolarHBondContact O-CB 3.04Å; V233-W236 PolarHBondContact O-N 3.5Å
234L94.4Very high86.3Confident4 Ų435 Ų352%0.02120%0.2CC..Hα-helixtrans-71.2-31.1178-68.4174.4000111.9F199 A230 N231 W236 L259 L269 F278 C298 Q301 L302F199-L234 HydrophobicContact CD2-CD2 4.48Å; F199-L234 HydrophobicContact CE2-CD2 3.85Å; F199-L234 HydrophobicContact CE2-CG 4.34Å; A230-L234 WeakPolarHBondContact O-CG 3.37Å; A230-L234 PolarHBondContact O-N 2.9Å; N231-L234 PolarHBondContact O-N 3.02Å; L234-W236 PolarHBondContact O-N 2.82Å; L234-L259 HydrophobicContact CD2-CD2 4Å; L234-L269 HydrophobicContact CD2-CD2 4.03Å; L234-F278 HydrophobicContact CD1-CE2 4.21Å; L234-F278 HydrophobicContact CD1-CZ 3.9Å; L234-C298 HydrophobicContact CD1-CB 3.82Å; L234-Q301 HydrophobicContact CB-CB 3.78Å; L234-Q301 HydrophobicContact CB-CG 4.27Å; L234-L302 HydrophobicContact CD1-CD2 4.34Å; L234-L302 HydrophobicContact CD1-CG 4.24Å; L234-L302 HydrophobicContact CD2-CD2 3.99Å
235S92.7Very high84.4Confident33 Ų3334.4 Ų34.423%0.23120%0.196CC..THydrogen-bonded Turntrans-80.915173.8-56.60000113.4N231 V233 N237N231-S235 VanDerWaalsContact O-CB 3.27Å; N231-S235 WeakPolarHBondContact O-CB 3.23Å; N231-S235 PolarHBondContact O-N 3.09Å; N231-S235 PolarHBondContact O-OG 3.11Å; N231-S235 PolarHBondContact OD1-OG 3.03Å; V233-S235 VanDerWaalsContact C-N 3.34Å; S235-N237 PolarHBondContact O-N 3.43Å
236W91.1Very high82.4Confident2 Ų237.8 Ų37.81%0.00821%0.214CC..  trans-68.7131178.5-177.8-91.1000111.6L164 F167 K187 F190 L195 Q232 V233 L234 F238L164-W236 HydrophobicContact CD1-CE3 3.53Å; L164-W236 HydrophobicContact CD1-CZ3 3.48Å; L164-W236 VanDerWaalsContact CD1-CZ3 3.48Å; L164-W236 HydrophobicContact CG-CE3 4.23Å; L164-W236 HydrophobicContact CG-CZ3 4.07Å; L164-W236 WeakPolarHBondContact O-CZ3 3.35Å; F167-W236 VanDerWaalsContact C-CH2 3.46Å; F167-W236 HydrophobicContact CB-CH2 3.84Å; K187-W236 HydrophobicContact CD-CZ2 4.37Å; K187-W236 HydrophobicContact CG-CH2 4.4Å; K187-W236 HydrophobicContact CG-CZ2 3.61Å; F190-W236 AromaticContact CD1-CH2 3.63Å; F190-W236 HydrophobicContact CD1-CH2 3.63Å; F190-W236 AromaticContact CD1-CZ2 3.91Å; F190-W236 HydrophobicContact CD1-CZ2 3.91Å; F190-W236 HydrophobicContact CD1-CZ3 4.4Å; F190-W236 AromaticContact CE1-CH2 3.87Å; F190-W236 HydrophobicContact CE1-CH2 3.87Å; F190-W236 HydrophobicContact CE1-CZ2 4.49Å; F190-W236 HydrophobicContact CE1-CZ3 4.21Å; L195-W236 HydrophobicContact CD1-CB 4.47Å; L195-W236 HydrophobicContact CD1-CD2 4.08Å; L195-W236 HydrophobicContact CD1-CE3 4Å; L195-W236 HydrophobicContact CD1-CG 4.32Å; L195-W236 HydrophobicContact CD1-CZ3 4.49Å; L195-W236 HydrophobicContact CD2-CB 3.88Å; L195-W236 HydrophobicContact CD2-CD2 3.76Å; L195-W236 HydrophobicContact CD2-CG 3.44Å; L195-W236 VanDerWaalsContact CD2-CG 3.44Å; Q232-W236 PolarHBondContact O-N 2.97Å; V233-W236 WeakPolarHBondContact O-CB 3.04Å; V233-W236 PolarHBondContact O-N 3.5Å; L234-W236 PolarHBondContact O-N 2.82Å; W236-F238 HydrophobicContact CB-CE2 4.1Å; W236-F238 AromaticContact CD1-CD2 3.9Å; W236-F238 AromaticContact CD1-CE2 3.94Å; W236-F238 HydrophobicContact CG-CE2 4.43Å; W236-F238 WeakPolarHBondContact O-CD2 3.3Å; W236-F238 WeakPolarHBondContact O-CE2 3.45Å; W236-F238 PolarHBondContact O-N 2.88Å
237N88.4Confident80.4Confident23 Ų2344.1 Ų44.112%0.12324%0.239CC..  trans-83101.5177.8-171.1-4.5000111.4K187 S235 F251 V257K187-N237 WeakPolarHBondContact CE-O 3.25Å; K187-N237 PolarHBondContact NZ-O 3.24Å; S235-N237 PolarHBondContact O-N 3.43Å; N237-F251 PolarHBondContact ND2-O 3.01Å; N237-V257 VanDerWaalsContact CA-CG1 3.49Å; N237-V257 HydrophobicContact CB-CG1 3.64Å; N237-V257 HydrophobicContact CB-CG2 4.07Å
238F87.4Confident78.7Confident8 Ų844.2 Ų44.24%0.03524%0.24CC..PPolyproline II helixtrans-72.8128.2-174.8-76.4-102.2000112.6Q191 L195 W236 P240 L259 K260 P261 W265Q191-F238 HydrophobicContact CG-CD1 3.48Å; Q191-F238 VanDerWaalsContact CG-CD1 3.48Å; Q191-F238 HydrophobicContact CG-CE1 3.57Å; Q191-F238 HydrophobicContact CG-CG 4.42Å; Q191-F238 VanDerWaalsContact OE1-CA 3.29Å; L195-F238 HydrophobicContact CD2-CE1 4.42Å; L195-F238 HydrophobicContact CD2-CZ 4.04Å; W236-F238 HydrophobicContact CB-CE2 4.1Å; W236-F238 AromaticContact CD1-CD2 3.9Å; W236-F238 AromaticContact CD1-CE2 3.94Å; W236-F238 HydrophobicContact CG-CE2 4.43Å; W236-F238 WeakPolarHBondContact O-CD2 3.3Å; W236-F238 WeakPolarHBondContact O-CE2 3.45Å; W236-F238 PolarHBondContact O-N 2.88Å; F238-P240 WeakPolarHBondContact O-CD 3.37Å; F238-L259 HydrophobicContact CD2-CD1 4.25Å; F238-L259 HydrophobicContact CE2-CD1 3.48Å; F238-L259 VanDerWaalsContact CE2-CD1 3.48Å; F238-L259 HydrophobicContact CZ-CD1 4.13Å; F238-K260 HydrophobicContact CB-CB 4.17Å; F238-K260 WeakPolarHBondContact CB-O 3.43Å; F238-K260 WeakPolarHBondContact CD1-O 3.38Å; F238-K260 WeakPolarHBondContact CG-O 3.3Å; F238-P261 HydrophobicContact CD1-CB 4.45Å; F238-P261 HydrophobicContact CE1-CB 3.88Å; F238-P261 HydrophobicContact CZ-CB 3.95Å; F238-W265 AromaticContact CE1-NE1 3.96Å
239L81.8Confident76.9Confident6 Ų644.9 Ų44.93%0.03125%0.245CC..PPolyproline II helixtrans-90.4125.9174.8-66.6-177.5000111.4K187 R188 Q191 L243 I248K187-L239 HydrophobicContact CB-CD1 4.08Å; K187-L239 HydrophobicContact CD-CD1 3.83Å; K187-L239 HydrophobicContact CD-CG 4.12Å; K187-L239 HydrophobicContact CG-CD1 4.07Å; K187-L239 HydrophobicContact CG-CG 4.49Å; R188-L239 HydrophobicContact CG-CB 3.74Å; R188-L239 HydrophobicContact CG-CD1 4.12Å; Q191-L239 PolarHBondContact NE2-O 2.96Å; L239-L243 HydrophobicContact CB-CD1 4.38Å; L239-L243 HydrophobicContact CD2-CD1 4.25Å; L239-I248 HydrophobicContact CD1-CG2 4.47Å
240P73.2Confident75.1Confident52 Ų5250.4 Ų50.434%0.33827%0.273SS..PPolyproline II helixtrans-53.5151.8168.6-22.916.4000115F238 N242 L243 F251F238-P240 WeakPolarHBondContact O-CD 3.37Å; P240-N242 PolarHBondContact O-N 2.99Å; P240-L243 HydrophobicContact CB-CD1 3.7Å; P240-L243 HydrophobicContact CB-CG 3.98Å; P240-L243 HydrophobicContact CG-CD1 3.37Å; P240-L243 HydrophobicContact CG-CG 3.99Å; P240-F251 HydrophobicContact CG-CZ 4.46Å
241P65.5Low73.3Confident105 Ų10552.9 Ų52.968%0.68228%0.283SS*.THydrogen-bonded Turntrans-65.4125.9169.326.7-31000110.1
242N62.6Low71.7Confident151 Ų15154.3 Ų54.381%0.80729%0.289SS*.THydrogen-bonded Turntrans78.627.9175.2-47.7-43.2000118.3P240 G244P240-N242 PolarHBondContact O-N 2.99Å; N242-G244 PolarHBondContact O-N 3.21Å
243L61.5Low69.9Low28 Ų2854.2 Ų54.215%0.14730%0.302CS..  trans-65.7127.5171.7-87.7157.3000113.4L239 P240 Y247 I248 F251L239-L243 HydrophobicContact CB-CD1 4.38Å; L239-L243 HydrophobicContact CD2-CD1 4.25Å; P240-L243 HydrophobicContact CB-CD1 3.7Å; P240-L243 HydrophobicContact CB-CG 3.98Å; P240-L243 HydrophobicContact CG-CD1 3.37Å; P240-L243 HydrophobicContact CG-CG 3.99Å; L243-Y247 HydrophobicContact CD2-CD2 4.39Å; L243-Y247 HydrophobicContact CD2-CG 3.85Å; L243-I248 HydrophobicContact CB-CG1 4.41Å; L243-F251 HydrophobicContact CD1-CD2 4.48Å; L243-F251 HydrophobicContact CD1-CE2 4.42Å; L243-F251 HydrophobicContact CD2-CD2 4.24Å; L243-F251 HydrophobicContact CD2-CE2 3.87Å
244G57Low68.2Low42 Ų4257.5 Ų57.543%0.43332%0.323SS..  trans-72.7159168.500000112.7N242 H246 Y247N242-G244 PolarHBondContact O-N 3.21Å; G244-H246 VanDerWaalsContact C-N 3.33Å; G244-H246 PolarHBondContact O-N 3.16Å; G244-H246 VanDerWaalsContact O-N 3.15Å; G244-Y247 PolarHBondContact O-N 3.03Å; G244-Y247 VanDerWaalsContact O-N 3.12Å
245R55.6Low66.2Low52 Ų5266.2 Ų66.220%0.19636%0.363CS..Hα-helixtrans-48-43.1-172.2-173.3179.4-179179.2-0.9115.6M180 Y247 I248 T1072 E1142M180-R245 HydrophobicContact CB-CG 4.49Å; R245-Y247 VanDerWaalsContact C-N 3.28Å; R245-Y247 PolarHBondContact O-N 3.31Å; R245-I248 PolarHBondContact O-N 2.92Å; R245-T1072 PolarHBondContact NH2-O 3.3Å; R245-E1142 IonicContact CZ-OE1 2.75Å; R245-E1142 IonicContact NH1-OE1 2.6Å; R245-E1142 PolarHBondContact NH1-OE1 3.35Å
246H53.2Low64.9Low149 Ų14970.9 Ų70.969%0.6939%0.386SS*.Hα-helixtrans-65-33.1-175.3-74.349.8000112.4G244G244-H246 VanDerWaalsContact C-N 3.33Å; G244-H246 PolarHBondContact O-N 3.16Å; G244-H246 VanDerWaalsContact O-N 3.15Å
247Y55.3Low64.4Low134 Ų13472.5 Ų72.553%0.52540%0.396SS..Hα-helixtrans-77.8-30.3-179.4-66.7-82.2000111.9L243 G244 R245 A249 M250 F251L243-Y247 HydrophobicContact CD2-CD2 4.39Å; L243-Y247 HydrophobicContact CD2-CG 3.85Å; G244-Y247 PolarHBondContact O-N 3.03Å; G244-Y247 VanDerWaalsContact O-N 3.12Å; R245-Y247 VanDerWaalsContact C-N 3.28Å; R245-Y247 PolarHBondContact O-N 3.31Å; Y247-A249 VanDerWaalsContact C-N 3.29Å; Y247-A249 PolarHBondContact O-N 2.87Å; Y247-M250 HydrophobicContact CD1-CE 4.32Å; Y247-M250 WeakPolarHBondContact O-CB 3.45Å; Y247-M250 PolarHBondContact O-N 3.39Å; Y247-M250 VanDerWaalsContact O-N 3.15Å; Y247-F251 VanDerWaalsContact O-CD2 3.24Å; Y247-F251 WeakPolarHBondContact O-CD2 3.47Å; Y247-F251 PolarHBondContact O-N 3.35Å
248I60.9Low64.3Low2 Ų273 Ų731%0.0140%0.4CS..Hα-helixtrans-60.8-39.8-178.2-49.3-179.8000111.2M180 L239 L243 R245 E252M180-I248 HydrophobicContact CE-CB 3.98Å; M180-I248 HydrophobicContact CE-CG2 3.6Å; M180-I248 HydrophobicContact CG-CB 4.39Å; M180-I248 HydrophobicContact CG-CG2 4.42Å; L239-I248 HydrophobicContact CD1-CG2 4.47Å; L243-I248 HydrophobicContact CB-CG1 4.41Å; R245-I248 PolarHBondContact O-N 2.92Å; I248-E252 PolarHBondContact O-N 3.44Å
249A57.8Low64.5Low40 Ų4072.8 Ų72.833%0.33140%0.399SS..Hα-helixtrans-67.7-43.1175.800000112.1M180 Y247 F251 E252 A253M180-A249 HydrophobicContact CE-CB 4.25Å; Y247-A249 VanDerWaalsContact C-N 3.29Å; Y247-A249 PolarHBondContact O-N 2.87Å; A249-F251 VanDerWaalsContact C-N 3.33Å; A249-F251 PolarHBondContact O-N 3.14Å; A249-E252 PolarHBondContact O-N 3.25Å; A249-E252 VanDerWaalsContact O-N 3.11Å; A249-A253 PolarHBondContact O-N 3.33Å
250M58.3Low64.8Low118 Ų11876.9 Ų76.958%0.58142%0.416SS*.Hα-helixtrans-59.6-42176.9-166.5-176.294.700112.3Y247 E252 A253Y247-M250 HydrophobicContact CD1-CE 4.32Å; Y247-M250 WeakPolarHBondContact O-CB 3.45Å; Y247-M250 PolarHBondContact O-N 3.39Å; Y247-M250 VanDerWaalsContact O-N 3.15Å; M250-E252 VanDerWaalsContact C-N 3.3Å; M250-E252 PolarHBondContact O-N 2.78Å; M250-A253 PolarHBondContact O-N 2.94Å
251F60.1Low65.6Low52 Ų5274.4 Ų74.423%0.22840%0.4CS..Hα-helixtrans-68.2-26.8177.3-87.9-89.5000112.6N237 P240 L243 Y247 A249 T254N237-F251 PolarHBondContact ND2-O 3.01Å; P240-F251 HydrophobicContact CG-CZ 4.46Å; L243-F251 HydrophobicContact CD1-CD2 4.48Å; L243-F251 HydrophobicContact CD1-CE2 4.42Å; L243-F251 HydrophobicContact CD2-CD2 4.24Å; L243-F251 HydrophobicContact CD2-CE2 3.87Å; Y247-F251 VanDerWaalsContact O-CD2 3.24Å; Y247-F251 WeakPolarHBondContact O-CD2 3.47Å; Y247-F251 PolarHBondContact O-N 3.35Å; A249-F251 VanDerWaalsContact C-N 3.33Å; A249-F251 PolarHBondContact O-N 3.14Å; F251-T254 PolarHBondContact O-OG1 3.08Å
252E60.1Low66.6Low54 Ų5470.8 Ų70.825%0.25238%0.376SS..Hα-helixtrans-80-18.4177.6-75-162165.900114.4S170 I248 A249 M250 T254S170-E252 WeakPolarHBondContact CB-OE1 3.42Å; S170-E252 PolarHBondContact N-OE1 3.44Å; S170-E252 PolarHBondContact OG-OE1 3.34Å; S170-E252 PolarHBondContact OG-OE2 3.47Å; I248-E252 PolarHBondContact O-N 3.44Å; A249-E252 PolarHBondContact O-N 3.25Å; A249-E252 VanDerWaalsContact O-N 3.11Å; M250-E252 VanDerWaalsContact C-N 3.3Å; M250-E252 PolarHBondContact O-N 2.78Å; E252-T254 VanDerWaalsContact C-N 3.32Å
253A55.7Low67.9Low80 Ų8069 Ų6966%0.66136%0.363SS*.THydrogen-bonded Turntrans-82-7.8176.900000113.6A249 M250 Q255A249-A253 PolarHBondContact O-N 3.33Å; M250-A253 PolarHBondContact O-N 2.94Å; A253-Q255 PolarHBondContact O-N 2.87Å
254T58.9Low69.2Low73 Ų7369.9 Ų69.945%0.44837%0.372SS..  trans-72.5118.7-177.9-44.60000111.2F251 E252F251-T254 PolarHBondContact O-OG1 3.08Å; E252-T254 VanDerWaalsContact C-N 3.32Å
255Q52.5Low70.9Confident187 Ų18768.1 Ų68.187%0.87435%0.352SS*.SBendtrans-74.3-32-179.1-67.9-179.9-11.700113A253A253-Q255 PolarHBondContact O-N 2.87Å
256N66.1Low72.6Confident131 Ų13168.8 Ų68.870%0.70135%0.354SS*.SBendtrans-104.995178.8-68.3-23.2000111.5
257V80.6Confident74.4Confident36 Ų3670.3 Ų70.322%0.21836%0.362CS..  trans-82.8125.3179.3-177.30000110.1N237 Q301N237-V257 VanDerWaalsContact CA-CG1 3.49Å; N237-V257 HydrophobicContact CB-CG1 3.64Å; N237-V257 HydrophobicContact CB-CG2 4.07Å; V257-Q301 PolarHBondContact O-NE2 3.25Å; V257-Q301 PolarHBondContact O-OE1 2.99Å
258T85.9Confident76.1Confident34 Ų3464.4 Ų64.421%0.20934%0.341CS..  trans-103.9148.2175.447.20000111.1K260 H306 M354T258-K260 PolarHBondContact O-N 3.23Å; T258-K260 WeakPolarHBondContact OG1-CE 3.43Å; T258-H306 PolarHBondContact OG1-CE1 2.92Å; T258-M354 HydrophobicContact CG2-CE 3.85Å; T258-M354 HydrophobicContact CG2-SD 4.1Å
259L91.9Very high77.7Confident2 Ų264.5 Ų64.51%0.0134%0.341CS..  trans-76.7104.7-174.9-179.653.9000111.2L234 F238 P261 L269 Q301 L302 S304 M305 H306L234-L259 HydrophobicContact CD2-CD2 4Å; F238-L259 HydrophobicContact CD2-CD1 4.25Å; F238-L259 HydrophobicContact CE2-CD1 3.48Å; F238-L259 VanDerWaalsContact CE2-CD1 3.48Å; F238-L259 HydrophobicContact CZ-CD1 4.13Å; L259-P261 HydrophobicContact CD1-CG 4.28Å; L259-P261 HydrophobicContact CG-CG 4.3Å; L259-P261 VanDerWaalsContact O-CD 3.24Å; L259-P261 WeakPolarHBondContact O-CD 3.35Å; L259-L269 HydrophobicContact CD2-CD1 4.41Å; L259-Q301 WeakPolarHBondContact CB-O 3.31Å; L259-Q301 WeakPolarHBondContact CD2-O 3.44Å; L259-L302 HydrophobicContact CD2-CD2 4.32Å; L259-S304 PolarHBondContact N-OG 3.39Å; L259-M305 HydrophobicContact CD2-CB 4.28Å; L259-M305 HydrophobicContact CD2-CG 4.44Å; L259-M305 HydrophobicContact CD2-SD 4.48Å; L259-M305 HydrophobicContact CG-CB 4.38Å; L259-M305 HydrophobicContact CG-CG 4.34Å; L259-M305 VanDerWaalsContact O-CA 3.3Å; L259-M305 WeakPolarHBondContact O-CA 3.28Å; L259-H306 PolarHBondContact O-N 3.04Å; L259-H306 VanDerWaalsContact O-N 3.14Å
260K89Confident79.4Confident93 Ų9364.9 Ų64.940%0.40434%0.337SS..  trans-118.461.4-179-58.6-171-150.7-1350114.4F238 T258 H306F238-K260 HydrophobicContact CB-CB 4.17Å; F238-K260 WeakPolarHBondContact CB-O 3.43Å; F238-K260 WeakPolarHBondContact CD1-O 3.38Å; F238-K260 WeakPolarHBondContact CG-O 3.3Å; T258-K260 PolarHBondContact O-N 3.23Å; T258-K260 WeakPolarHBondContact OG1-CE 3.43Å; K260-H306 WeakPolarHBondContact CD-NE2 3.47Å; K260-H306 WeakPolarHBondContact CE-CE1 3.43Å; K260-H306 WeakPolarHBondContact CE-NE2 3.42Å; K260-H306 WeakPolarHBondContact CG-CE1 3.41Å; K260-H306 WeakPolarHBondContact CG-NE2 3.47Å; K260-H306 PolarHBondContact NZ-CE1 3.41Å; K260-H306 PolarHBondContact NZ-NE2 2.95Å
261P88.8Confident81Confident0 Ų061.3 Ų61.30%032%0.321CS..  trans-69.8154.2-176.128.4-33.6000113.3F238 L259 W265 L269 M305 I309F238-P261 HydrophobicContact CD1-CB 4.45Å; F238-P261 HydrophobicContact CE1-CB 3.88Å; F238-P261 HydrophobicContact CZ-CB 3.95Å; L259-P261 HydrophobicContact CD1-CG 4.28Å; L259-P261 HydrophobicContact CG-CG 4.3Å; L259-P261 VanDerWaalsContact O-CD 3.24Å; L259-P261 WeakPolarHBondContact O-CD 3.35Å; P261-W265 HydrophobicContact CB-CB 3.76Å; P261-W265 HydrophobicContact CB-CG 3.89Å; P261-L269 HydrophobicContact CB-CD1 4Å; P261-L269 HydrophobicContact CG-CD1 3.74Å; P261-M305 HydrophobicContact CG-CG 4.18Å; P261-M305 HydrophobicContact CG-SD 4.14Å; P261-I309 HydrophobicContact CB-CD1 3.99Å; P261-I309 HydrophobicContact CG-CB 3.92Å; P261-I309 HydrophobicContact CG-CD1 3.42Å; P261-I309 VanDerWaalsContact CG-CD1 3.42Å; P261-I309 HydrophobicContact CG-CG1 4.24Å; P261-I309 HydrophobicContact CG-CG2 3.96Å
262T87.8Confident82.5Confident28 Ų2862 Ų6217%0.17233%0.33CS..  trans-81171.6175.458.60000111.5S264 W265T262-S264 PolarHBondContact O-N 3.31Å; T262-S264 PolarHBondContact OG1-OG 3.48Å; T262-W265 WeakPolarHBondContact O-CB 3.37Å; T262-W265 PolarHBondContact O-N 3.33Å; T262-W265 VanDerWaalsContact O-N 3.09Å
263E89Confident84.1Confident114 Ų11467.5 Ų67.553%0.53335%0.348SS..G310 helixtrans-57.2-25.9-179.7-52.3-166133.800113.9W265 R266 P308E263-W265 PolarHBondContact O-N 3.31Å; E263-R266 VanDerWaalsContact CD-NH2 3.32Å; E263-R266 WeakPolarHBondContact O-CB 3.27Å; E263-R266 VanDerWaalsContact O-CG 3.23Å; E263-R266 WeakPolarHBondContact O-CG 3.27Å; E263-R266 PolarHBondContact O-N 2.73Å; E263-R266 IonicContact OE1-CZ 3.47Å; E263-R266 IonicContact OE1-NH1 3.08Å; E263-R266 IonicContact OE1-NH2 3.81Å; E263-R266 PolarHBondContact OE1-NH2 3.28Å; E263-P308 HydrophobicContact CG-CB 4.4Å
264S88.7Confident85.9Confident47 Ų4764.5 Ų64.533%0.32932%0.321SS..G310 helixtrans-67.6-13.2179.962.50000114.1R196 T262R196-S264 PolarHBondContact NH1-O 2.89Å; T262-S264 PolarHBondContact O-N 3.31Å; T262-S264 PolarHBondContact OG1-OG 3.48Å
265W92.7Very high87.6Confident4 Ų461.2 Ų61.22%0.01530%0.301CS..G310 helixtrans-93.8-6.1178.4-76.183.2000113.6Q191 L195 R196 F199 F238 P261 T262 E263 E267 A268 L269 I309Q191-W265 WeakPolarHBondContact O-CZ2 3.45Å; Q191-W265 PolarHBondContact O-NE1 3.22Å; Q191-W265 VanDerWaalsContact O-NE1 3.11Å; L195-W265 HydrophobicContact CB-CH2 4.27Å; L195-W265 HydrophobicContact CB-CZ2 3.9Å; L195-W265 HydrophobicContact CD2-CH2 4.14Å; L195-W265 HydrophobicContact CD2-CZ2 3.76Å; L195-W265 HydrophobicContact CG-CH2 3.77Å; L195-W265 HydrophobicContact CG-CZ2 3.7Å; R196-W265 VanDerWaalsContact CA-CZ2 3.5Å; R196-W265 HydrophobicContact CB-CD2 4.42Å; R196-W265 HydrophobicContact CB-CH2 3.81Å; R196-W265 HydrophobicContact CB-CZ2 3.61Å; R196-W265 HydrophobicContact CB-CZ3 4.25Å; R196-W265 HydrophobicContact CG-CD2 4.27Å; R196-W265 HydrophobicContact CG-CE3 4.18Å; R196-W265 HydrophobicContact CG-CH2 4.25Å; R196-W265 HydrophobicContact CG-CZ2 4.28Å; R196-W265 HydrophobicContact CG-CZ3 4.17Å; R196-W265 VanDerWaalsContact N-CZ2 3.33Å; F199-W265 HydrophobicContact CB-CH2 3.98Å; F199-W265 HydrophobicContact CB-CZ3 3.77Å; F199-W265 AromaticContact CD1-CZ3 3.99Å; F199-W265 HydrophobicContact CD1-CZ3 3.99Å; F199-W265 AromaticContact CG-CZ3 3.88Å; F199-W265 HydrophobicContact CG-CZ3 3.88Å; F238-W265 AromaticContact CE1-NE1 3.96Å; P261-W265 HydrophobicContact CB-CB 3.76Å; P261-W265 HydrophobicContact CB-CG 3.89Å; T262-W265 WeakPolarHBondContact O-CB 3.37Å; T262-W265 PolarHBondContact O-N 3.33Å; T262-W265 VanDerWaalsContact O-N 3.09Å; E263-W265 PolarHBondContact O-N 3.31Å; W265-E267 PolarHBondContact O-N 2.89Å; W265-A268 HydrophobicContact CE3-CB 4.42Å; W265-A268 PolarHBondContact O-N 3.08Å; W265-L269 HydrophobicContact CB-CD1 4.26Å; W265-L269 HydrophobicContact CE3-CD1 3.92Å; W265-L269 HydrophobicContact CE3-CG 4.13Å; W265-L269 PolarHBondContact O-N 3.32Å; W265-I309 HydrophobicContact CB-CD1 4Å
266R92.1Very high89.7Confident66 Ų6655.3 Ų55.325%0.24928%0.275CS..Hα-helixtrans-49.1-52.9-177.4-80.9176.7-178.5161.67.7113.1E263 A268 L270 P308 I309E263-R266 VanDerWaalsContact CD-NH2 3.32Å; E263-R266 WeakPolarHBondContact O-CB 3.27Å; E263-R266 VanDerWaalsContact O-CG 3.23Å; E263-R266 WeakPolarHBondContact O-CG 3.27Å; E263-R266 PolarHBondContact O-N 2.73Å; E263-R266 IonicContact OE1-CZ 3.47Å; E263-R266 IonicContact OE1-NH1 3.08Å; E263-R266 IonicContact OE1-NH2 3.81Å; E263-R266 PolarHBondContact OE1-NH2 3.28Å; R266-A268 PolarHBondContact O-N 2.79Å; R266-L270 HydrophobicContact CB-CD1 4.29Å; R266-L270 HydrophobicContact CG-CD1 4.07Å; R266-L270 VanDerWaalsContact O-CB 3.27Å; R266-L270 WeakPolarHBondContact O-CB 3.45Å; R266-L270 PolarHBondContact O-N 3.01Å; R266-P308 PolarHBondContact NH2-O 3.38Å; R266-I309 WeakPolarHBondContact CD-O 3.4Å; R266-I309 HydrophobicContact CG-CG1 3.85Å; R266-I309 WeakPolarHBondContact CG-O 3.4Å; R266-I309 PolarHBondContact NE-O 3.33Å
267E90.3Very high91.2Very high181 Ų18150 Ų5085%0.84625%0.246SC*.Hα-helixtrans-65-23.4-178-64.7-177172.900113.3W265W265-E267 PolarHBondContact O-N 2.89Å
268A91.8Very high92Very high10 Ų1048.2 Ų48.28%0.08324%0.236CC..Hα-helixtrans-89.6-40.7-178.200000112.7F199 M200 W265 R266 V274F199-A268 HydrophobicContact CD1-CB 4.3Å; F199-A268 HydrophobicContact CE1-CB 4.27Å; M200-A268 HydrophobicContact SD-CB 4.09Å; W265-A268 HydrophobicContact CE3-CB 4.42Å; W265-A268 PolarHBondContact O-N 3.08Å; R266-A268 PolarHBondContact O-N 2.79Å; A268-V274 WeakPolarHBondContact O-CG2 3.43Å
269L93.9Very high92.5Very high4 Ų447 Ų472%0.02123%0.228CC..Hα-helixtrans-102.3-24.6-172.6-67.3173.4000114.3F199 L234 L259 P261 W265 D271 L302 M305 I309F199-L269 HydrophobicContact CE1-CD2 3.84Å; F199-L269 HydrophobicContact CE2-CD2 4.17Å; F199-L269 HydrophobicContact CZ-CD2 3.55Å; L234-L269 HydrophobicContact CD2-CD2 4.03Å; L259-L269 HydrophobicContact CD2-CD1 4.41Å; P261-L269 HydrophobicContact CB-CD1 4Å; P261-L269 HydrophobicContact CG-CD1 3.74Å; W265-L269 HydrophobicContact CB-CD1 4.26Å; W265-L269 HydrophobicContact CE3-CD1 3.92Å; W265-L269 HydrophobicContact CE3-CG 4.13Å; W265-L269 PolarHBondContact O-N 3.32Å; L269-D271 VanDerWaalsContact C-N 3.29Å; L269-L302 HydrophobicContact CD2-CD2 4.18Å; L269-M305 HydrophobicContact CB-SD 4.04Å; L269-M305 HydrophobicContact CD1-SD 4.21Å; L269-I309 HydrophobicContact CB-CD1 3.88Å; L269-I309 HydrophobicContact CD1-CD1 4.01Å
270L93.4Very high92.6Very high48 Ų4849.2 Ų49.225%0.25124%0.243SC..SBendtrans-85.9-0.4175.6-56.8-177.5000113R266 T272 M305 I309 F310 Y319R266-L270 HydrophobicContact CB-CD1 4.29Å; R266-L270 HydrophobicContact CG-CD1 4.07Å; R266-L270 VanDerWaalsContact O-CB 3.27Å; R266-L270 WeakPolarHBondContact O-CB 3.45Å; R266-L270 PolarHBondContact O-N 3.01Å; L270-T272 PolarHBondContact O-N 3.34Å; L270-M305 HydrophobicContact CD2-CE 3.55Å; L270-I309 HydrophobicContact CD1-CG1 4.42Å; L270-I309 HydrophobicContact CD2-CG1 4.48Å; L270-I309 HydrophobicContact CG-CD1 4.49Å; L270-I309 HydrophobicContact CG-CG1 4.3Å; L270-F310 HydrophobicContact CD2-CD1 3.92Å; L270-F310 HydrophobicContact CD2-CE1 3.58Å; L270-F310 HydrophobicContact CD2-CZ 4.35Å; L270-Y319 HydrophobicContact CD2-CD2 3.98Å; L270-Y319 HydrophobicContact CD2-CE2 4.37Å
271D92.4Very high92.9Very high44 Ų4444.8 Ų44.824%0.23522%0.224CC..  trans-73.1113.7170.8-174-14.2000109.7L269 R273 V274L269-D271 VanDerWaalsContact C-N 3.29Å; D271-R273 PolarHBondContact O-N 2.93Å; D271-R273 VanDerWaalsContact OD1-CB 3.3Å; D271-R273 WeakPolarHBondContact OD1-CB 3.17Å; D271-R273 VanDerWaalsContact OD1-CG 3.3Å; D271-R273 WeakPolarHBondContact OD1-CG 3.31Å; D271-R273 IonicContact OD1-CZ 3.86Å; D271-R273 PolarHBondContact OD1-N 2.96Å; D271-R273 VanDerWaalsContact OD1-N 3.08Å; D271-R273 IonicContact OD1-NE 3.42Å; D271-R273 PolarHBondContact OD1-NE 3.43Å; D271-R273 IonicContact OD1-NH2 3.89Å; D271-R273 IonicContact OD2-CZ 3.18Å; D271-R273 IonicContact OD2-NE 3.78Å; D271-R273 PolarHBondContact OD2-NE 2.87Å; D271-R273 IonicContact OD2-NH2 3.17Å; D271-R273 PolarHBondContact OD2-NH2 3.39Å; D271-V274 HydrophobicContact CB-CG2 4.45Å; D271-V274 WeakPolarHBondContact O-CB 3.45Å; D271-V274 PolarHBondContact O-N 3.34Å
272T91.7Very high93.2Very high67 Ų6744.9 Ų44.941%0.41123%0.225SC..Hα-helixtrans-55.8-26.4-177.459.60000112.8L270 V274 M275 D276L270-T272 PolarHBondContact O-N 3.34Å; T272-V274 PolarHBondContact O-N 2.7Å; T272-M275 PolarHBondContact O-N 3.26Å; T272-D276 VanDerWaalsContact O-CG 3.24Å; T272-D276 PolarHBondContact O-N 2.82Å
273R93.4Very high93.4Very high169 Ų16949.8 Ų49.864%0.63824%0.24SC*.Hα-helixtrans-63.1-26.8178.6-62.4178.1-69.9179.3-0.9113.3D271 L277D271-R273 PolarHBondContact O-N 2.93Å; D271-R273 VanDerWaalsContact OD1-CB 3.3Å; D271-R273 WeakPolarHBondContact OD1-CB 3.17Å; D271-R273 VanDerWaalsContact OD1-CG 3.3Å; D271-R273 WeakPolarHBondContact OD1-CG 3.31Å; D271-R273 IonicContact OD1-CZ 3.86Å; D271-R273 PolarHBondContact OD1-N 2.96Å; D271-R273 VanDerWaalsContact OD1-N 3.08Å; D271-R273 IonicContact OD1-NE 3.42Å; D271-R273 PolarHBondContact OD1-NE 3.43Å; D271-R273 IonicContact OD1-NH2 3.89Å; D271-R273 IonicContact OD2-CZ 3.18Å; D271-R273 IonicContact OD2-NE 3.78Å; D271-R273 PolarHBondContact OD2-NE 2.87Å; D271-R273 IonicContact OD2-NH2 3.17Å; D271-R273 PolarHBondContact OD2-NH2 3.39Å; R273-L277 VanDerWaalsContact O-CB 3.22Å; R273-L277 WeakPolarHBondContact O-CB 3.41Å; R273-L277 PolarHBondContact O-N 2.92Å
274V94.1Very high93.6Very high16 Ų1648.1 Ų48.110%0.09723%0.231CC..Hα-helixtrans-71.5-46.6176.6173.20000109.9F199 M203 A268 D271 T272 L277 F278F199-V274 HydrophobicContact CZ-CG1 3.93Å; M203-V274 HydrophobicContact SD-CG1 4.23Å; A268-V274 WeakPolarHBondContact O-CG2 3.43Å; D271-V274 HydrophobicContact CB-CG2 4.45Å; D271-V274 WeakPolarHBondContact O-CB 3.45Å; D271-V274 PolarHBondContact O-N 3.34Å; T272-V274 PolarHBondContact O-N 2.7Å; V274-L277 WeakPolarHBondContact O-CB 3.38Å; V274-L277 PolarHBondContact O-N 3.11Å; V274-F278 HydrophobicContact CG1-CD2 4.07Å; V274-F278 HydrophobicContact CG1-CE2 3.85Å; V274-F278 VanDerWaalsContact O-CD2 3.25Å; V274-F278 WeakPolarHBondContact O-CD2 3.39Å; V274-F278 PolarHBondContact O-N 2.66Å; V274-F278 VanDerWaalsContact O-N 3.13Å
275M94.6Very high93.7Very high5 Ų546.7 Ų46.73%0.02522%0.219CC..Hα-helixtrans-61.9-47.1176.1-170.2-173.7-63.700111.2T272 L277 F278 F279 Y319 H322 L323T272-M275 PolarHBondContact O-N 3.26Å; M275-L277 PolarHBondContact O-N 3.27Å; M275-F278 PolarHBondContact O-N 2.91Å; M275-F278 VanDerWaalsContact O-N 3.17Å; M275-F279 HydrophobicContact CG-CD2 3.92Å; M275-F279 HydrophobicContact CG-CE2 3.65Å; M275-F279 WeakPolarHBondContact O-CD2 3.12Å; M275-F279 PolarHBondContact O-N 3.35Å; M275-F279 VanDerWaalsContact O-N 3.07Å; M275-F279 HydrophobicContact SD-CE2 4.12Å; M275-Y319 HydrophobicContact CE-CD1 4.28Å; M275-Y319 HydrophobicContact CE-CD2 3.71Å; M275-Y319 HydrophobicContact CE-CE1 3.88Å; M275-Y319 HydrophobicContact CE-CE2 3.24Å; M275-Y319 HydrophobicContact CE-CG 4.21Å; M275-H322 HydrophobicContact SD-CB 4.42Å; M275-H322 VanDerWaalsContact SD-CD2 3.55Å; M275-L323 HydrophobicContact CE-CB 3.74Å; M275-L323 HydrophobicContact CE-CD1 3.89Å; M275-L323 HydrophobicContact CE-CD2 4.42Å; M275-L323 HydrophobicContact CE-CG 4.22Å; M275-L323 HydrophobicContact CG-CD1 3.83Å; M275-L323 WeakPolarHBondContact SD-CA 3.27Å; M275-L323 HydrophobicContact SD-CB 3.58Å; M275-L323 VanDerWaalsContact SD-CB 3.58Å; M275-L323 HydrophobicContact SD-CD1 3.47Å; M275-L323 WeakPolarHBondContact SD-CD1 3.26Å; M275-L323 HydrophobicContact SD-CG 4.08Å
276D96.1Very high93.7Very high63 Ų6348.1 Ų48.134%0.33723%0.225SC..Hα-helixtrans-58-36.9175.8-66.3-24.3000112.2T272 S280 H322T272-D276 VanDerWaalsContact O-CG 3.24Å; T272-D276 PolarHBondContact O-N 2.82Å; D276-S280 VanDerWaalsContact O-CB 3.25Å; D276-S280 WeakPolarHBondContact O-CB 3.38Å; D276-S280 PolarHBondContact O-N 3.41Å; D276-S280 PolarHBondContact O-OG 2.84Å; D276-H322 IonicContact OD1-CD2 2.73Å; D276-H322 IonicContact OD1-CE1 3.44Å; D276-H322 IonicContact OD1-NE2 3.19Å; D276-H322 PolarHBondContact OD1-NE2 2.85Å; D276-H322 IonicContact OD2-NE2 3.66Å
277L96.7Very high93.5Very high18 Ų1853.7 Ų53.79%0.09425%0.254CS..Hα-helixtrans-63.4-49.1177175.164000110.8M203 L206 Q207 S210 R273 V274 M275 S280 I281M203-L277 HydrophobicContact SD-CD2 4.34Å; L206-L277 HydrophobicContact CB-CD2 4.35Å; Q207-L277 HydrophobicContact CB-CD1 4.38Å; Q207-L277 HydrophobicContact CB-CD2 4.17Å; S210-L277 WeakPolarHBondContact OG-CD1 3.26Å; R273-L277 VanDerWaalsContact O-CB 3.22Å; R273-L277 WeakPolarHBondContact O-CB 3.41Å; R273-L277 PolarHBondContact O-N 2.92Å; V274-L277 WeakPolarHBondContact O-CB 3.38Å; V274-L277 PolarHBondContact O-N 3.11Å; M275-L277 PolarHBondContact O-N 3.27Å; L277-S280 PolarHBondContact O-N 3.06Å; L277-I281 HydrophobicContact CD1-CD1 3.74Å; L277-I281 HydrophobicContact CD1-CG1 4.02Å; L277-I281 HydrophobicContact CD2-CD1 4.4Å; L277-I281 HydrophobicContact CG-CD1 3.69Å; L277-I281 HydrophobicContact CG-CG1 4.35Å; L277-I281 WeakPolarHBondContact O-CB 3.46Å; L277-I281 VanDerWaalsContact O-CG1 3.22Å; L277-I281 WeakPolarHBondContact O-CG1 3.11Å; L277-I281 PolarHBondContact O-N 3.25Å
278F97.4Very high93.6Very high0 Ų048.5 Ų48.50%023%0.232CC..Hα-helixtrans-64.4-42.1179.4-78.1-74.3000112.6M203 L206 L227 A230 L234 V274 M275 S280 I281 H282 C298 L299 L302M203-F278 HydrophobicContact CE-CE2 4.16Å; M203-F278 HydrophobicContact CE-CZ 3.66Å; M203-F278 HydrophobicContact SD-CE2 3.79Å; M203-F278 HydrophobicContact SD-CZ 3.92Å; L206-F278 HydrophobicContact CD1-CE1 4.18Å; L206-F278 HydrophobicContact CD1-CZ 4.42Å; L227-F278 HydrophobicContact CD1-CE1 4.31Å; A230-F278 HydrophobicContact CB-CE1 4.15Å; A230-F278 HydrophobicContact CB-CZ 4.07Å; L234-F278 HydrophobicContact CD1-CE2 4.21Å; L234-F278 HydrophobicContact CD1-CZ 3.9Å; V274-F278 HydrophobicContact CG1-CD2 4.07Å; V274-F278 HydrophobicContact CG1-CE2 3.85Å; V274-F278 VanDerWaalsContact O-CD2 3.25Å; V274-F278 WeakPolarHBondContact O-CD2 3.39Å; V274-F278 PolarHBondContact O-N 2.66Å; V274-F278 VanDerWaalsContact O-N 3.13Å; M275-F278 PolarHBondContact O-N 2.91Å; M275-F278 VanDerWaalsContact O-N 3.17Å; F278-S280 VanDerWaalsContact C-N 3.29Å; F278-S280 PolarHBondContact O-N 3.5Å; F278-I281 PolarHBondContact O-N 3.09Å; F278-H282 WeakPolarHBondContact O-CB 3.24Å; F278-H282 PolarHBondContact O-N 2.89Å; F278-C298 HydrophobicContact CD1-CB 3.62Å; F278-C298 HydrophobicContact CE1-CB 3.5Å; F278-C298 HydrophobicContact CG-CB 4.38Å; F278-C298 HydrophobicContact CZ-CB 4.17Å; F278-L299 HydrophobicContact CB-CD2 3.71Å; F278-L299 HydrophobicContact CB-CG 4.12Å; F278-L302 HydrophobicContact CD2-CD1 3.64Å; F278-L302 HydrophobicContact CE2-CD1 4.13Å; F278-L302 HydrophobicContact CG-CD1 4.3Å
279F96.1Very high93.4Very high7 Ų750.9 Ų50.93%0.03125%0.248CC..Hα-helixtrans-61.7-36.5172.6-78.8-60.6000112.7M275 R283 L299 L323 G326 L327 M330M275-F279 HydrophobicContact CG-CD2 3.92Å; M275-F279 HydrophobicContact CG-CE2 3.65Å; M275-F279 WeakPolarHBondContact O-CD2 3.12Å; M275-F279 PolarHBondContact O-N 3.35Å; M275-F279 VanDerWaalsContact O-N 3.07Å; M275-F279 HydrophobicContact SD-CE2 4.12Å; F279-R283 WeakPolarHBondContact O-CG 3.13Å; F279-R283 PolarHBondContact O-N 2.94Å; F279-R283 PolarHBondContact O-NE 3.47Å; F279-L299 HydrophobicContact CD1-CD1 3.8Å; F279-L299 HydrophobicContact CD1-CD2 3.97Å; F279-L299 HydrophobicContact CD2-CD2 4.11Å; F279-L299 HydrophobicContact CE1-CD1 3.87Å; F279-L299 HydrophobicContact CE1-CD2 3.88Å; F279-L299 HydrophobicContact CE1-CG 4.49Å; F279-L299 HydrophobicContact CE2-CD2 4.05Å; F279-L299 HydrophobicContact CG-CD2 4.07Å; F279-L299 HydrophobicContact CZ-CD2 3.93Å; F279-L323 HydrophobicContact CE2-CD1 3.81Å; F279-L323 HydrophobicContact CZ-CD1 3.8Å; F279-G326 VanDerWaalsContact CZ-C 3.48Å; F279-L327 HydrophobicContact CE1-CB 4.4Å; F279-L327 HydrophobicContact CZ-CB 4.24Å; F279-L327 VanDerWaalsContact CZ-N 3.31Å; F279-M330 HydrophobicContact CD1-CB 4.31Å; F279-M330 HydrophobicContact CD1-SD 3.69Å; F279-M330 HydrophobicContact CE1-SD 3.97Å
280S94.8Very high93.2Very high49 Ų4955 Ų5534%0.34327%0.27SS..Hα-helixtrans-73-35.6177-58.10000112.5D276 L277 F278 R283 K284D276-S280 VanDerWaalsContact O-CB 3.25Å; D276-S280 WeakPolarHBondContact O-CB 3.38Å; D276-S280 PolarHBondContact O-N 3.41Å; D276-S280 PolarHBondContact O-OG 2.84Å; L277-S280 PolarHBondContact O-N 3.06Å; F278-S280 VanDerWaalsContact C-N 3.29Å; F278-S280 PolarHBondContact O-N 3.5Å; S280-R283 PolarHBondContact OG-NH2 3.38Å; S280-R283 VanDerWaalsContact OG-NH2 3.14Å; S280-K284 PolarHBondContact O-N 3.38Å
281I95.3Very high93.2Very high0 Ų053 Ų530%026%0.259CS..Hα-helixtrans-64.9-52.1175.4-75.6170.3000109.8L206 F223 L227 L277 F278 R283 K284 I285L206-I281 HydrophobicContact CB-CD1 3.79Å; L206-I281 HydrophobicContact CD1-CD1 4.26Å; L206-I281 HydrophobicContact CG-CD1 4.41Å; F223-I281 HydrophobicContact CE2-CD1 4.44Å; F223-I281 HydrophobicContact CE2-CG2 4.38Å; F223-I281 HydrophobicContact CZ-CG1 4.14Å; F223-I281 HydrophobicContact CZ-CG2 3.84Å; L227-I281 HydrophobicContact CD1-CG2 4.16Å; L277-I281 HydrophobicContact CD1-CD1 3.74Å; L277-I281 HydrophobicContact CD1-CG1 4.02Å; L277-I281 HydrophobicContact CD2-CD1 4.4Å; L277-I281 HydrophobicContact CG-CD1 3.69Å; L277-I281 HydrophobicContact CG-CG1 4.35Å; L277-I281 WeakPolarHBondContact O-CB 3.46Å; L277-I281 VanDerWaalsContact O-CG1 3.22Å; L277-I281 WeakPolarHBondContact O-CG1 3.11Å; L277-I281 PolarHBondContact O-N 3.25Å; F278-I281 PolarHBondContact O-N 3.09Å; I281-R283 PolarHBondContact O-N 3.44Å; I281-K284 WeakPolarHBondContact O-CB 3.14Å; I281-K284 PolarHBondContact O-N 2.63Å; I281-I285 HydrophobicContact CG2-CD1 3.42Å; I281-I285 VanDerWaalsContact CG2-CD1 3.42Å; I281-I285 HydrophobicContact CG2-CG1 4.45Å; I281-I285 VanDerWaalsContact O-CG1 3.31Å; I281-I285 WeakPolarHBondContact O-CG1 3.29Å; I281-I285 PolarHBondContact O-N 2.81Å; I281-I285 VanDerWaalsContact O-N 3.12Å
282H95.2Very high93.3Very high2 Ų250.9 Ų50.91%0.00925%0.248CC..Hα-helixtrans-55.5-51.5179.9175.769.6000111.4F278 K284 I285 R286 S295 L299 M330 E340F278-H282 WeakPolarHBondContact O-CB 3.24Å; F278-H282 PolarHBondContact O-N 2.89Å; H282-K284 PolarHBondContact O-N 2.92Å; H282-I285 PolarHBondContact O-N 3.2Å; H282-R286 PolarHBondContact O-N 3.07Å; H282-S295 PolarHBondContact ND1-OG 2.73Å; H282-L299 HydrophobicContact CB-CD1 4.42Å; H282-M330 PolarHBondContact CD2-SD 2.9Å; H282-E340 IonicContact CE1-OE1 3.77Å; H282-E340 PolarHBondContact CE1-OE1 3.11Å; H282-E340 VanDerWaalsContact CE1-OE1 3.3Å; H282-E340 IonicContact NE2-OE1 3.73Å; H282-E340 PolarHBondContact NE2-OE1 3.35Å
283R92.3Very high93.3Very high132 Ų13252.8 Ų52.850%0.49825%0.252SS..Hα-helixtrans-54.9-26.9176.5-75.9-178.7-69.5165.9-3.5114.3F279 S280 I281 M330F279-R283 WeakPolarHBondContact O-CG 3.13Å; F279-R283 PolarHBondContact O-N 2.94Å; F279-R283 PolarHBondContact O-NE 3.47Å; S280-R283 PolarHBondContact OG-NH2 3.38Å; S280-R283 VanDerWaalsContact OG-NH2 3.14Å; I281-R283 PolarHBondContact O-N 3.44Å; R283-M330 HydrophobicContact CG-CG 4.41Å
284K91.9Very high93.4Very high78 Ų7846.3 Ų46.334%0.33923%0.23SC..Hα-helixtrans-85.1-31.7-179.6-179-179.5178-178.50113.3F209 S210 R212 S280 I281 H282F209-K284 PolarHBondContact O-NZ 3.41Å; S210-K284 PolarHBondContact O-NZ 2.98Å; R212-K284 PolarHBondContact O-NZ 2.86Å; S280-K284 PolarHBondContact O-N 3.38Å; I281-K284 WeakPolarHBondContact O-CB 3.14Å; I281-K284 PolarHBondContact O-N 2.63Å; H282-K284 PolarHBondContact O-N 2.92Å
285I92Very high93.5Very high17 Ų1745.5 Ų45.59%0.08723%0.226CC..Hα-helixtrans-111.36.1-172.468.7-164.9000113F223 L227 I281 H282 E287 D288 M291F223-I285 HydrophobicContact CD1-CG2 4.28Å; F223-I285 HydrophobicContact CE1-CG2 3.57Å; F223-I285 HydrophobicContact CZ-CG2 4.34Å; L227-I285 HydrophobicContact CD2-CD1 3.48Å; L227-I285 VanDerWaalsContact CD2-CD1 3.48Å; I281-I285 HydrophobicContact CG2-CD1 3.42Å; I281-I285 VanDerWaalsContact CG2-CD1 3.42Å; I281-I285 HydrophobicContact CG2-CG1 4.45Å; I281-I285 VanDerWaalsContact O-CG1 3.31Å; I281-I285 WeakPolarHBondContact O-CG1 3.29Å; I281-I285 PolarHBondContact O-N 2.81Å; I281-I285 VanDerWaalsContact O-N 3.12Å; H282-I285 PolarHBondContact O-N 3.2Å; I285-E287 PolarHBondContact O-N 3.1Å; I285-E287 VanDerWaalsContact O-N 3.15Å; I285-D288 WeakPolarHBondContact O-CB 3.37Å; I285-D288 PolarHBondContact O-N 2.89Å; I285-M291 HydrophobicContact CB-CB 4.17Å; I285-M291 HydrophobicContact CB-CE 4.31Å; I285-M291 HydrophobicContact CD1-CB 3.98Å; I285-M291 HydrophobicContact CD1-CE 4.03Å; I285-M291 HydrophobicContact CG1-CB 4.12Å; I285-M291 HydrophobicContact CG2-CE 3.94Å
286R91.3Very high93.6Very high34 Ų3445.3 Ų45.313%0.12823%0.225CC..THydrogen-bonded Turntrans-47.5-41.8-175.4-175.4-179.9-164.9-109.78.8114.7H282 D288 I334 E335 E337 E340H282-R286 PolarHBondContact O-N 3.07Å; R286-D288 PolarHBondContact O-N 3.46Å; R286-I334 VanDerWaalsContact NH1-CG2 3.27Å; R286-E335 VanDerWaalsContact CZ-O 3.27Å; R286-E335 PolarHBondContact NH1-O 3.34Å; R286-E335 PolarHBondContact NH2-O 2.88Å; R286-E337 IonicContact CZ-OE1 2.96Å; R286-E337 IonicContact NH1-OE1 3.78Å; R286-E337 PolarHBondContact NH1-OE1 3.14Å; R286-E337 VanDerWaalsContact NH1-OE1 3.08Å; R286-E340 WeakPolarHBondContact CD-OE1 3.4Å; R286-E340 VanDerWaalsContact CG-OE1 3.25Å; R286-E340 WeakPolarHBondContact CG-OE1 3.31Å; R286-E340 IonicContact CZ-OE1 3.9Å; R286-E340 IonicContact CZ-OE2 2.96Å; R286-E340 IonicContact NE-OE1 3.86Å; R286-E340 PolarHBondContact NE-OE1 3.36Å; R286-E340 IonicContact NE-OE2 2.75Å; R286-E340 PolarHBondContact NE-OE2 3.07Å; R286-E340 VanDerWaalsContact NE-OE2 3.09Å; R286-E340 IonicContact NH1-OE2 2.64Å; R286-E340 IonicContact NH2-OE1 2.85Å; R286-E340 IonicContact NH2-OE2 2.67Å; R286-E340 PolarHBondContact NH2-OE2 2.89Å
287E89.7Confident93.6Very high183 Ų18345.5 Ų45.586%0.85522%0.223SC*.THydrogen-bonded Turntrans-71.6-9.6-178.1-59.5-179.9174.800113.5I285I285-E287 PolarHBondContact O-N 3.1Å; I285-E287 VanDerWaalsContact O-N 3.15Å
288D91.3Very high93.6Very high73 Ų7344.6 Ų44.639%0.3922%0.219SC..SBendtrans-98.4103.7173.6-175.2-53.7000108.6I285 R286 D290 M291 A292I285-D288 WeakPolarHBondContact O-CB 3.37Å; I285-D288 PolarHBondContact O-N 2.89Å; R286-D288 PolarHBondContact O-N 3.46Å; D288-D290 VanDerWaalsContact C-N 3.3Å; D288-D290 PolarHBondContact O-N 2.92Å; D288-D290 PolarHBondContact OD1-N 3.36Å; D288-M291 HydrophobicContact CB-CB 4.06Å; D288-M291 HydrophobicContact CB-CG 4.42Å; D288-M291 PolarHBondContact O-N 3.41Å; D288-M291 WeakPolarHBondContact OD1-CG 3.42Å; D288-M291 PolarHBondContact OD1-N 3.03Å; D288-M291 VanDerWaalsContact OD1-N 3.11Å; D288-A292 VanDerWaalsContact O-CB 3.28Å; D288-A292 WeakPolarHBondContact O-CB 3.43Å; D288-A292 PolarHBondContact O-N 2.84Å
289S88.8Confident93.6Very high60 Ų6044.6 Ų44.642%0.4222%0.219SC..Hα-helixtrans-53.9-42.5-17255.80000113.5Q293S289-Q293 VanDerWaalsContact O-CG 3.31Å; S289-Q293 WeakPolarHBondContact O-CG 3.37Å; S289-Q293 PolarHBondContact O-N 3.29Å; S289-Q293 VanDerWaalsContact O-N 3.11Å
290D89.1Confident93.6Very high89 Ų8944.3 Ų44.348%0.47622%0.218SC..Hα-helixtrans-68.6-45.8-177.7-65.9-6.9000110.4D288 D294D288-D290 VanDerWaalsContact C-N 3.3Å; D288-D290 PolarHBondContact O-N 2.92Å; D288-D290 PolarHBondContact OD1-N 3.36Å; D290-D294 PolarHBondContact O-N 2.96Å
291M92.8Very high93.7Very high7 Ų742.6 Ų42.63%0.03420%0.204CC..Hα-helixtrans-71.2-33.8179.8-70.9-165.96800112.5F223 Q224 L227 I285 D288 D294 S295F223-M291 HydrophobicContact CB-CE 4.27Å; F223-M291 HydrophobicContact CD1-CE 3.57Å; F223-M291 HydrophobicContact CE1-CE 4Å; F223-M291 HydrophobicContact CG-CE 3.89Å; Q224-M291 HydrophobicContact CB-CE 4.3Å; Q224-M291 HydrophobicContact CB-CG 4.06Å; Q224-M291 HydrophobicContact CB-SD 3.98Å; Q224-M291 HydrophobicContact CG-CG 3.9Å; Q224-M291 HydrophobicContact CG-SD 4.48Å; L227-M291 HydrophobicContact CD2-CB 4.38Å; L227-M291 HydrophobicContact CD2-CE 4.14Å; L227-M291 WeakPolarHBondContact CD2-O 3.38Å; I285-M291 HydrophobicContact CB-CB 4.17Å; I285-M291 HydrophobicContact CB-CE 4.31Å; I285-M291 HydrophobicContact CD1-CB 3.98Å; I285-M291 HydrophobicContact CD1-CE 4.03Å; I285-M291 HydrophobicContact CG1-CB 4.12Å; I285-M291 HydrophobicContact CG2-CE 3.94Å; D288-M291 HydrophobicContact CB-CB 4.06Å; D288-M291 HydrophobicContact CB-CG 4.42Å; D288-M291 PolarHBondContact O-N 3.41Å; D288-M291 WeakPolarHBondContact OD1-CG 3.42Å; D288-M291 PolarHBondContact OD1-N 3.03Å; D288-M291 VanDerWaalsContact OD1-N 3.11Å; M291-D294 PolarHBondContact O-N 2.85Å; M291-S295 WeakPolarHBondContact O-CB 3.4Å; M291-S295 PolarHBondContact O-N 3.22Å; M291-S295 PolarHBondContact O-OG 2.88Å
292A93.8Very high93.7Very high0 Ų042.7 Ų42.70%021%0.205CC..Hα-helixtrans-61.1-49.2174.200000110.5D288 D294 S295 L296D288-A292 VanDerWaalsContact O-CB 3.28Å; D288-A292 WeakPolarHBondContact O-CB 3.43Å; D288-A292 PolarHBondContact O-N 2.84Å; A292-D294 PolarHBondContact O-N 3.05Å; A292-S295 PolarHBondContact O-N 3.36Å; A292-S295 PolarHBondContact O-OG 3.45Å; A292-L296 WeakPolarHBondContact O-CG 3.42Å; A292-L296 PolarHBondContact O-N 2.92Å
293Q93.3Very high93.8Very high107 Ų10742.6 Ų42.650%0.520%0.204SC..Hα-helixtrans-56.7-49.6175.7-74.2176.6-5.600112.2S289 S295 L296 Q297S289-Q293 VanDerWaalsContact O-CG 3.31Å; S289-Q293 WeakPolarHBondContact O-CG 3.37Å; S289-Q293 PolarHBondContact O-N 3.29Å; S289-Q293 VanDerWaalsContact O-N 3.11Å; Q293-S295 VanDerWaalsContact C-N 3.3Å; Q293-S295 PolarHBondContact O-N 3.27Å; Q293-L296 PolarHBondContact O-N 3.32Å; Q293-Q297 WeakPolarHBondContact O-CB 3.19Å; Q293-Q297 PolarHBondContact O-N 3.39Å
294D94.2Very high94Very high32 Ų3236.3 Ų36.317%0.17118%0.181CC..Hα-helixtrans-59.6-40.1178.2-89.9-35.5000112.4L227 N231 D290 M291 A292 C298L227-D294 HydrophobicContact CD2-CB 3.92Å; L227-D294 HydrophobicContact CG-CB 3.92Å; N231-D294 PolarHBondContact ND2-OD1 2.89Å; D290-D294 PolarHBondContact O-N 2.96Å; M291-D294 PolarHBondContact O-N 2.85Å; A292-D294 PolarHBondContact O-N 3.05Å; D294-C298 PolarHBondContact O-N 3.47Å; D294-C298 PolarHBondContact O-SG 2.92Å
295S96.5Very high94.1Very high0 Ų032.6 Ų32.60%017%0.165CC..Hα-helixtrans-70.6-39.217965.70000113.4H282 M291 A292 Q293 C298 L299H282-S295 PolarHBondContact ND1-OG 2.73Å; M291-S295 WeakPolarHBondContact O-CB 3.4Å; M291-S295 PolarHBondContact O-N 3.22Å; M291-S295 PolarHBondContact O-OG 2.88Å; A292-S295 PolarHBondContact O-N 3.36Å; A292-S295 PolarHBondContact O-OG 3.45Å; Q293-S295 VanDerWaalsContact C-N 3.3Å; Q293-S295 PolarHBondContact O-N 3.27Å; S295-C298 WeakPolarHBondContact O-CB 3.11Å; S295-C298 PolarHBondContact O-N 2.86Å; S295-L299 PolarHBondContact O-N 2.99Å; S295-L299 VanDerWaalsContact O-N 3.08Å
296L96.6Very high94Very high1 Ų133.7 Ų33.71%0.00517%0.169CC..Hα-helixtrans-69-37.2175.5-71.5170.8000111.1A292 Q293 C298 L299 A300 M330 E340 I344 I347A292-L296 WeakPolarHBondContact O-CG 3.42Å; A292-L296 PolarHBondContact O-N 2.92Å; Q293-L296 PolarHBondContact O-N 3.32Å; L296-C298 VanDerWaalsContact C-N 3.32Å; L296-C298 PolarHBondContact O-N 3.47Å; L296-L299 HydrophobicContact CD2-CD1 4.39Å; L296-L299 CarbonylContact O-C 3.58Å; L296-L299 PolarHBondContact O-N 3.43Å; L296-L299 VanDerWaalsContact O-N 3.16Å; L296-A300 WeakPolarHBondContact O-CB 3.47Å; L296-A300 PolarHBondContact O-N 3.4Å; L296-M330 HydrophobicContact CD2-CE 4.05Å; L296-E340 HydrophobicContact CD1-CB 3.72Å; L296-E340 HydrophobicContact CD1-CG 3.96Å; L296-I344 HydrophobicContact CD2-CG1 4.15Å; L296-I347 HydrophobicContact CD2-CD1 3.86Å
297Q95.7Very high93.8Very high66 Ų6633.8 Ų33.831%0.30818%0.18SC..Hα-helixtrans-63.8-38.5173.5-170.665.66.300111.8N231 Q293 A300 Q301N231-Q297 WeakPolarHBondContact OD1-CG 3.44Å; Q293-Q297 WeakPolarHBondContact O-CB 3.19Å; Q293-Q297 PolarHBondContact O-N 3.39Å; Q297-A300 PolarHBondContact O-N 3.11Å; Q297-Q301 WeakPolarHBondContact O-CG 3.22Å; Q297-Q301 PolarHBondContact O-N 3.36Å
298C97.1Very high93.7Very high0 Ų028.7 Ų28.70%016%0.163CC..Hα-helixtrans-59.6-46.2171.4-67.90000111.6N231 L234 F278 D294 S295 L296 Q301 L302N231-C298 WeakPolarHBondContact CA-SG 3.38Å; N231-C298 PolarHBondContact N-SG 3.45Å; N231-C298 VanDerWaalsContact N-SG 3.43Å; L234-C298 HydrophobicContact CD1-CB 3.82Å; F278-C298 HydrophobicContact CD1-CB 3.62Å; F278-C298 HydrophobicContact CE1-CB 3.5Å; F278-C298 HydrophobicContact CG-CB 4.38Å; F278-C298 HydrophobicContact CZ-CB 4.17Å; D294-C298 PolarHBondContact O-N 3.47Å; D294-C298 PolarHBondContact O-SG 2.92Å; S295-C298 WeakPolarHBondContact O-CB 3.11Å; S295-C298 PolarHBondContact O-N 2.86Å; L296-C298 VanDerWaalsContact C-N 3.32Å; L296-C298 PolarHBondContact O-N 3.47Å; C298-Q301 PolarHBondContact O-N 3.49Å; C298-L302 WeakPolarHBondContact O-CG 3.12Å; C298-L302 PolarHBondContact O-N 2.91Å
299L97.7Very high93.8Very high0 Ų025.2 Ų25.20%015%0.145CC..Hα-helixtrans-64.4-39.4177.2-73.2168.5000111.9F278 F279 H282 S295 L296 Q301 L302 A303 M330 I347F278-L299 HydrophobicContact CB-CD2 3.71Å; F278-L299 HydrophobicContact CB-CG 4.12Å; F279-L299 HydrophobicContact CD1-CD1 3.8Å; F279-L299 HydrophobicContact CD1-CD2 3.97Å; F279-L299 HydrophobicContact CD2-CD2 4.11Å; F279-L299 HydrophobicContact CE1-CD1 3.87Å; F279-L299 HydrophobicContact CE1-CD2 3.88Å; F279-L299 HydrophobicContact CE1-CG 4.49Å; F279-L299 HydrophobicContact CE2-CD2 4.05Å; F279-L299 HydrophobicContact CG-CD2 4.07Å; F279-L299 HydrophobicContact CZ-CD2 3.93Å; H282-L299 HydrophobicContact CB-CD1 4.42Å; S295-L299 PolarHBondContact O-N 2.99Å; S295-L299 VanDerWaalsContact O-N 3.08Å; L296-L299 HydrophobicContact CD2-CD1 4.39Å; L296-L299 CarbonylContact O-C 3.58Å; L296-L299 PolarHBondContact O-N 3.43Å; L296-L299 VanDerWaalsContact O-N 3.16Å; L299-Q301 VanDerWaalsContact C-N 3.33Å; L299-Q301 PolarHBondContact O-N 2.84Å; L299-L302 PolarHBondContact O-N 3.14Å; L299-A303 WeakPolarHBondContact O-CB 3.19Å; L299-A303 PolarHBondContact O-N 3.41Å; L299-M330 HydrophobicContact CD1-SD 4.28Å; L299-I347 HydrophobicContact CB-CD1 3.61Å; L299-I347 HydrophobicContact CB-CG1 4.06Å; L299-I347 HydrophobicContact CD1-CD1 4.33Å
300A96.8Very high94Very high1 Ų123 Ų231%0.00813%0.127CC..Hα-helixtrans-63.2-39.7176.200000111.2L296 Q297 A303 S304 N346 I347 N350L296-A300 WeakPolarHBondContact O-CB 3.47Å; L296-A300 PolarHBondContact O-N 3.4Å; Q297-A300 PolarHBondContact O-N 3.11Å; A300-A303 CarbonylContact O-C 3.55Å; A300-A303 WeakPolarHBondContact O-CB 3.36Å; A300-A303 PolarHBondContact O-N 2.83Å; A300-S304 PolarHBondContact O-N 3Å; A300-N346 HydrophobicContact CB-CB 4.25Å; A300-I347 HydrophobicContact CB-CG1 3.89Å; A300-N350 PolarHBondContact O-ND2 2.8Å
301Q96.1Very high94.2Very high13 Ų1322.1 Ų22.16%0.06113%0.126CC..Hα-helixtrans-67.5-37.6173.4-72.1-61.5-26.300112.8L234 V257 L259 Q297 C298 L299 A303 S304L234-Q301 HydrophobicContact CB-CB 3.78Å; L234-Q301 HydrophobicContact CB-CG 4.27Å; V257-Q301 PolarHBondContact O-NE2 3.25Å; V257-Q301 PolarHBondContact O-OE1 2.99Å; L259-Q301 WeakPolarHBondContact CB-O 3.31Å; L259-Q301 WeakPolarHBondContact CD2-O 3.44Å; Q297-Q301 WeakPolarHBondContact O-CG 3.22Å; Q297-Q301 PolarHBondContact O-N 3.36Å; C298-Q301 PolarHBondContact O-N 3.49Å; L299-Q301 VanDerWaalsContact C-N 3.33Å; L299-Q301 PolarHBondContact O-N 2.84Å; Q301-A303 VanDerWaalsContact C-N 3.26Å; Q301-A303 PolarHBondContact O-N 3.4Å; Q301-S304 PolarHBondContact O-N 3.25Å; Q301-S304 VanDerWaalsContact O-N 3.16Å; Q301-S304 PolarHBondContact O-OG 2.8Å; Q301-S304 PolarHBondContact OE1-OG 2.74Å
302L96.8Very high94.3Very high1 Ų125.9 Ų25.91%0.00515%0.147CC..Hα-helixtrans-65.1-31.6172.1-68.6177000112.3L234 L259 L269 F278 C298 L299 M305 Y319L234-L302 HydrophobicContact CD1-CD2 4.34Å; L234-L302 HydrophobicContact CD1-CG 4.24Å; L234-L302 HydrophobicContact CD2-CD2 3.99Å; L259-L302 HydrophobicContact CD2-CD2 4.32Å; L269-L302 HydrophobicContact CD2-CD2 4.18Å; F278-L302 HydrophobicContact CD2-CD1 3.64Å; F278-L302 HydrophobicContact CE2-CD1 4.13Å; F278-L302 HydrophobicContact CG-CD1 4.3Å; C298-L302 WeakPolarHBondContact O-CG 3.12Å; C298-L302 PolarHBondContact O-N 2.91Å; L299-L302 PolarHBondContact O-N 3.14Å; L302-M305 WeakPolarHBondContact O-CB 3.29Å; L302-Y319 PolarHBondContact O-OH 3.43Å
303A96.6Very high94.3Very high0 Ų031.7 Ų31.70%017%0.174CC..Hα-helixtrans-74.4-24.1172.400000113.3L299 A300 Q301 M305 L323 I347 N350 L351 F355L299-A303 WeakPolarHBondContact O-CB 3.19Å; L299-A303 PolarHBondContact O-N 3.41Å; A300-A303 CarbonylContact O-C 3.55Å; A300-A303 WeakPolarHBondContact O-CB 3.36Å; A300-A303 PolarHBondContact O-N 2.83Å; Q301-A303 VanDerWaalsContact C-N 3.26Å; Q301-A303 PolarHBondContact O-N 3.4Å; A303-M305 PolarHBondContact O-N 2.77Å; A303-L323 HydrophobicContact CB-CD2 3.89Å; A303-I347 HydrophobicContact CB-CG2 4.11Å; A303-N350 HydrophobicContact CB-CB 3.86Å; A303-L351 HydrophobicContact CB-CD2 3.9Å; A303-L351 HydrophobicContact CB-CG 4.06Å; A303-F355 WeakPolarHBondContact O-CE2 3.48Å
304S95.8Very high94.4Very high1 Ų130.9 Ų30.91%0.00718%0.18CC..THydrogen-bonded Turntrans-84.72.8177.782.60000113.9L259 A300 Q301 H306L259-S304 PolarHBondContact N-OG 3.39Å; A300-S304 PolarHBondContact O-N 3Å; Q301-S304 PolarHBondContact O-N 3.25Å; Q301-S304 VanDerWaalsContact O-N 3.16Å; Q301-S304 PolarHBondContact O-OG 2.8Å; Q301-S304 PolarHBondContact OE1-OG 2.74Å; S304-H306 PolarHBondContact O-N 3.18Å; S304-H306 PolarHBondContact O-ND1 3.43Å
305M94.4Very high94.4Very high0 Ų030.6 Ų30.60%018%0.182CC..  trans-67.4124.6-173.3-171.9168.767.800112.1L259 P261 L269 L270 L302 A303 I309 F310 Y319L259-M305 HydrophobicContact CD2-CB 4.28Å; L259-M305 HydrophobicContact CD2-CG 4.44Å; L259-M305 HydrophobicContact CD2-SD 4.48Å; L259-M305 HydrophobicContact CG-CB 4.38Å; L259-M305 HydrophobicContact CG-CG 4.34Å; L259-M305 VanDerWaalsContact O-CA 3.3Å; L259-M305 WeakPolarHBondContact O-CA 3.28Å; P261-M305 HydrophobicContact CG-CG 4.18Å; P261-M305 HydrophobicContact CG-SD 4.14Å; L269-M305 HydrophobicContact CB-SD 4.04Å; L269-M305 HydrophobicContact CD1-SD 4.21Å; L270-M305 HydrophobicContact CD2-CE 3.55Å; L302-M305 WeakPolarHBondContact O-CB 3.29Å; A303-M305 PolarHBondContact O-N 2.77Å; M305-I309 HydrophobicContact CG-CG2 3.91Å; M305-I309 HydrophobicContact SD-CD1 3.84Å; M305-I309 HydrophobicContact SD-CG2 4.09Å; M305-F310 HydrophobicContact CE-CE1 3.94Å; M305-F310 HydrophobicContact CE-CE2 4.16Å; M305-F310 HydrophobicContact CE-CZ 3.45Å; M305-F310 VanDerWaalsContact CE-CZ 3.45Å; M305-F310 HydrophobicContact CG-CE2 4.23Å; M305-F310 HydrophobicContact CG-CZ 4.39Å; M305-F310 WeakPolarHBondContact O-CE2 3.39Å; M305-Y319 HydrophobicContact CE-CD1 4.13Å; M305-Y319 HydrophobicContact CE-CD2 3.93Å; M305-Y319 HydrophobicContact CE-CE1 3.62Å; M305-Y319 HydrophobicContact CE-CE2 3.39Å; M305-Y319 HydrophobicContact CE-CG 4.27Å; M305-Y319 WeakPolarHBondContact CE-OH 3.48Å
306H89.4Confident94.4Very high40 Ų4032.4 Ų32.419%0.18519%0.191CC..  trans-155.4176.2176.665.8-68.9000111.7T258 L259 K260 S304 M354T258-H306 PolarHBondContact OG1-CE1 2.92Å; L259-H306 PolarHBondContact O-N 3.04Å; L259-H306 VanDerWaalsContact O-N 3.14Å; K260-H306 WeakPolarHBondContact CD-NE2 3.47Å; K260-H306 WeakPolarHBondContact CE-CE1 3.43Å; K260-H306 WeakPolarHBondContact CE-NE2 3.42Å; K260-H306 WeakPolarHBondContact CG-CE1 3.41Å; K260-H306 WeakPolarHBondContact CG-NE2 3.47Å; K260-H306 PolarHBondContact NZ-CE1 3.41Å; K260-H306 PolarHBondContact NZ-NE2 2.95Å; S304-H306 PolarHBondContact O-N 3.18Å; S304-H306 PolarHBondContact O-ND1 3.43Å; H306-M354 HydrophobicContact CB-CE 4.47Å; H306-M354 WeakPolarHBondContact CE1-CE 3.44Å; H306-M354 WeakPolarHBondContact ND1-CE 3.34Å
307G86.8Confident94.4Very high35 Ų3533.6 Ų33.636%0.36120%0.198SC..SBendtrans95.3-157.4-179.600000113.5I309 F310G307-I309 PolarHBondContact O-N 3.28Å; G307-F310 PolarHBondContact O-N 3.49Å
308P88.4Confident94.4Very high76 Ų7634.1 Ų34.149%0.49421%0.209SC..THydrogen-bonded Turntrans-71.2-5.3-165.930.3-36.2000114E263 R266 F310E263-P308 HydrophobicContact CG-CB 4.4Å; R266-P308 PolarHBondContact NH2-O 3.38Å; P308-F310 PolarHBondContact O-N 3.42Å
309I92.6Very high94.4Very high0 Ų035 Ų350%021%0.212CC..THydrogen-bonded Turntrans-58.9-34.3174.3-171.6162.8000111.8P261 W265 R266 L269 L270 M305 G307 P311P261-I309 HydrophobicContact CB-CD1 3.99Å; P261-I309 HydrophobicContact CG-CB 3.92Å; P261-I309 HydrophobicContact CG-CD1 3.42Å; P261-I309 VanDerWaalsContact CG-CD1 3.42Å; P261-I309 HydrophobicContact CG-CG1 4.24Å; P261-I309 HydrophobicContact CG-CG2 3.96Å; W265-I309 HydrophobicContact CB-CD1 4Å; R266-I309 WeakPolarHBondContact CD-O 3.4Å; R266-I309 HydrophobicContact CG-CG1 3.85Å; R266-I309 WeakPolarHBondContact CG-O 3.4Å; R266-I309 PolarHBondContact NE-O 3.33Å; L269-I309 HydrophobicContact CB-CD1 3.88Å; L269-I309 HydrophobicContact CD1-CD1 4.01Å; L270-I309 HydrophobicContact CD1-CG1 4.42Å; L270-I309 HydrophobicContact CD2-CG1 4.48Å; L270-I309 HydrophobicContact CG-CD1 4.49Å; L270-I309 HydrophobicContact CG-CG1 4.3Å; M305-I309 HydrophobicContact CG-CG2 3.91Å; M305-I309 HydrophobicContact SD-CD1 3.84Å; M305-I309 HydrophobicContact SD-CG2 4.09Å; G307-I309 PolarHBondContact O-N 3.28Å; I309-P311 WeakPolarHBondContact O-CD 3.26Å
310F94.5Very high94.4Very high14 Ų1435 Ų356%0.06121%0.212CC..  trans-80.2124.3176.4-64.8-74.8000110.9L270 M305 G307 P308 A315 Q316 Y319 F355L270-F310 HydrophobicContact CD2-CD1 3.92Å; L270-F310 HydrophobicContact CD2-CE1 3.58Å; L270-F310 HydrophobicContact CD2-CZ 4.35Å; M305-F310 HydrophobicContact CE-CE1 3.94Å; M305-F310 HydrophobicContact CE-CE2 4.16Å; M305-F310 HydrophobicContact CE-CZ 3.45Å; M305-F310 VanDerWaalsContact CE-CZ 3.45Å; M305-F310 HydrophobicContact CG-CE2 4.23Å; M305-F310 HydrophobicContact CG-CZ 4.39Å; M305-F310 WeakPolarHBondContact O-CE2 3.39Å; G307-F310 PolarHBondContact O-N 3.49Å; P308-F310 PolarHBondContact O-N 3.42Å; F310-A315 HydrophobicContact CD1-CB 4.48Å; F310-Q316 HydrophobicContact CB-CG 3.48Å; F310-Q316 VanDerWaalsContact CB-CG 3.48Å; F310-Q316 HydrophobicContact CD1-CB 4.33Å; F310-Q316 HydrophobicContact CD1-CG 3.55Å; F310-Q316 HydrophobicContact CD2-CG 3.63Å; F310-Q316 HydrophobicContact CE1-CG 4.11Å; F310-Q316 HydrophobicContact CE2-CG 4.17Å; F310-Q316 HydrophobicContact CG-CB 4.46Å; F310-Q316 HydrophobicContact CG-CG 3.27Å; F310-Q316 HydrophobicContact CZ-CG 4.38Å; F310-Y319 HydrophobicContact CE1-CD1 4.08Å; F310-Y319 HydrophobicContact CE1-CD2 4.45Å; F310-Y319 AromaticContact CE1-CG 3.86Å; F310-Y319 HydrophobicContact CE1-CG 3.86Å; F310-Y319 AromaticContact CZ-CD1 3.88Å; F310-Y319 HydrophobicContact CZ-CD1 3.88Å; F310-Y319 HydrophobicContact CZ-CE1 4.35Å; F310-Y319 HydrophobicContact CZ-CG 4.13Å; F310-F355 HydrophobicContact CE2-CE1 4.41Å; F310-F355 HydrophobicContact CZ-CE1 4.13Å; F310-F355 HydrophobicContact CZ-CZ 4.44Å
311P93.2Very high94.4Very high70 Ų7035.5 Ų35.546%0.45522%0.217SC..SBendtrans-71.5-30.6179.628.4-34.9000113.1I309 A315I309-P311 WeakPolarHBondContact O-CD 3.26Å; P311-A315 HydrophobicContact CG-CB 3.83Å
312D94.1Very high94.5Very high86 Ų8637.2 Ų37.246%0.4623%0.225SC..SBendtrans-159.2171.5-177.655.661000110.9S314 A315 Q316D312-S314 VanDerWaalsContact C-N 3.29Å; D312-S314 PolarHBondContact O-N 3.38Å; D312-S314 WeakPolarHBondContact OD1-CA 3.45Å; D312-S314 VanDerWaalsContact OD1-CB 3.28Å; D312-S314 WeakPolarHBondContact OD1-CB 3.46Å; D312-S314 PolarHBondContact OD1-N 3.24Å; D312-A315 PolarHBondContact O-N 3.46Å; D312-A315 PolarHBondContact OD1-N 3.19Å; D312-Q316 PolarHBondContact O-N 3.31Å
313E93.9Very high94.5Very high123 Ų12337.1 Ų37.158%0.57522%0.224SC*.Hα-helixtrans-64.2-31.7178.1-64.9-174.516700112.5A315 Q316 V317 I359E313-A315 VanDerWaalsContact C-N 3.32Å; E313-A315 PolarHBondContact O-N 2.76Å; E313-Q316 WeakPolarHBondContact O-CB 3.42Å; E313-Q316 PolarHBondContact O-N 3.05Å; E313-Q316 VanDerWaalsContact O-N 3.14Å; E313-V317 WeakPolarHBondContact O-CG2 3.37Å; E313-V317 PolarHBondContact O-N 3.2Å; E313-I359 HydrophobicContact CB-CD1 3.7Å; E313-I359 HydrophobicContact CG-CD1 3.92Å
314S94.9Very high94.6Very high90 Ų9037.2 Ų37.263%0.62923%0.225SC*.Hα-helixtrans-65.4-37.5179.4-174.50000111.6D312 S318D312-S314 VanDerWaalsContact C-N 3.29Å; D312-S314 PolarHBondContact O-N 3.38Å; D312-S314 WeakPolarHBondContact OD1-CA 3.45Å; D312-S314 VanDerWaalsContact OD1-CB 3.28Å; D312-S314 WeakPolarHBondContact OD1-CB 3.46Å; D312-S314 PolarHBondContact OD1-N 3.24Å; S314-S318 WeakPolarHBondContact O-CB 3.43Å; S314-S318 PolarHBondContact O-N 2.97Å
315A95Very high94.6Very high26 Ų2642 Ų4222%0.21525%0.247CC..Hα-helixtrans-66.1-38173.700000111.7F310 P311 D312 E313 Y319F310-A315 HydrophobicContact CD1-CB 4.48Å; P311-A315 HydrophobicContact CG-CB 3.83Å; D312-A315 PolarHBondContact O-N 3.46Å; D312-A315 PolarHBondContact OD1-N 3.19Å; E313-A315 VanDerWaalsContact C-N 3.32Å; E313-A315 PolarHBondContact O-N 2.76Å; A315-Y319 VanDerWaalsContact O-CB 3.29Å; A315-Y319 WeakPolarHBondContact O-CB 3.46Å; A315-Y319 PolarHBondContact O-N 2.94Å
316Q95.4Very high94.7Very high37 Ų3742.7 Ų42.717%0.17326%0.255CS..Hα-helixtrans-63.4-47.8174.1-68.9-17713.700111.4F310 D312 E313 S318 Y319 L320 I359F310-Q316 HydrophobicContact CB-CG 3.48Å; F310-Q316 VanDerWaalsContact CB-CG 3.48Å; F310-Q316 HydrophobicContact CD1-CB 4.33Å; F310-Q316 HydrophobicContact CD1-CG 3.55Å; F310-Q316 HydrophobicContact CD2-CG 3.63Å; F310-Q316 HydrophobicContact CE1-CG 4.11Å; F310-Q316 HydrophobicContact CE2-CG 4.17Å; F310-Q316 HydrophobicContact CG-CB 4.46Å; F310-Q316 HydrophobicContact CG-CG 3.27Å; F310-Q316 HydrophobicContact CZ-CG 4.38Å; D312-Q316 PolarHBondContact O-N 3.31Å; E313-Q316 WeakPolarHBondContact O-CB 3.42Å; E313-Q316 PolarHBondContact O-N 3.05Å; E313-Q316 VanDerWaalsContact O-N 3.14Å; Q316-S318 PolarHBondContact O-N 2.89Å; Q316-Y319 PolarHBondContact O-N 3.14Å; Q316-L320 VanDerWaalsContact O-CB 3.26Å; Q316-L320 WeakPolarHBondContact O-CB 3.4Å; Q316-L320 PolarHBondContact O-N 3.2Å; Q316-I359 HydrophobicContact CB-CD1 4.12Å; Q316-I359 HydrophobicContact CB-CG1 4.28Å; Q316-I359 HydrophobicContact CB-CG2 3.92Å
317V96.8Very high95Very high26 Ų2640.9 Ų40.916%0.15825%0.246CC..Hα-helixtrans-60.6-45.7178.4176.10000110.9E313 Y319 L320 A321 I359 A362E313-V317 WeakPolarHBondContact O-CG2 3.37Å; E313-V317 PolarHBondContact O-N 3.2Å; V317-Y319 PolarHBondContact O-N 3.36Å; V317-L320 PolarHBondContact O-N 2.99Å; V317-A321 VanDerWaalsContact O-CB 3.26Å; V317-A321 WeakPolarHBondContact O-CB 3.44Å; V317-A321 PolarHBondContact O-N 3.45Å; V317-I359 HydrophobicContact CB-CG2 4.42Å; V317-I359 HydrophobicContact CG2-CB 4.43Å; V317-I359 HydrophobicContact CG2-CD1 4.15Å; V317-I359 HydrophobicContact CG2-CG2 3.74Å; V317-A362 HydrophobicContact CG1-CB 4.26Å; V317-A362 HydrophobicContact CG2-CB 3.63Å
318S96.4Very high95.5Very high78 Ų7839.7 Ų39.755%0.54523%0.232SC..Hα-helixtrans-64.6-39.3179-173.50000112.6S314 Q316 H322S314-S318 WeakPolarHBondContact O-CB 3.43Å; S314-S318 PolarHBondContact O-N 2.97Å; Q316-S318 PolarHBondContact O-N 2.89Å; S318-H322 PolarHBondContact O-N 3.27Å
319Y97.1Very high95.7Very high17 Ų1739.9 Ų39.97%0.06724%0.235CC..Hα-helixtrans-68-47.1177.7-180-90000111.2L270 M275 L302 M305 F310 A315 Q316 V317 A321 H322 L323 F355L270-Y319 HydrophobicContact CD2-CD2 3.98Å; L270-Y319 HydrophobicContact CD2-CE2 4.37Å; M275-Y319 HydrophobicContact CE-CD1 4.28Å; M275-Y319 HydrophobicContact CE-CD2 3.71Å; M275-Y319 HydrophobicContact CE-CE1 3.88Å; M275-Y319 HydrophobicContact CE-CE2 3.24Å; M275-Y319 HydrophobicContact CE-CG 4.21Å; L302-Y319 PolarHBondContact O-OH 3.43Å; M305-Y319 HydrophobicContact CE-CD1 4.13Å; M305-Y319 HydrophobicContact CE-CD2 3.93Å; M305-Y319 HydrophobicContact CE-CE1 3.62Å; M305-Y319 HydrophobicContact CE-CE2 3.39Å; M305-Y319 HydrophobicContact CE-CG 4.27Å; M305-Y319 WeakPolarHBondContact CE-OH 3.48Å; F310-Y319 HydrophobicContact CE1-CD1 4.08Å; F310-Y319 HydrophobicContact CE1-CD2 4.45Å; F310-Y319 AromaticContact CE1-CG 3.86Å; F310-Y319 HydrophobicContact CE1-CG 3.86Å; F310-Y319 AromaticContact CZ-CD1 3.88Å; F310-Y319 HydrophobicContact CZ-CD1 3.88Å; F310-Y319 HydrophobicContact CZ-CE1 4.35Å; F310-Y319 HydrophobicContact CZ-CG 4.13Å; A315-Y319 VanDerWaalsContact O-CB 3.29Å; A315-Y319 WeakPolarHBondContact O-CB 3.46Å; A315-Y319 PolarHBondContact O-N 2.94Å; Q316-Y319 PolarHBondContact O-N 3.14Å; V317-Y319 PolarHBondContact O-N 3.36Å; Y319-A321 PolarHBondContact O-N 3Å; Y319-H322 PolarHBondContact O-N 2.89Å; Y319-L323 HydrophobicContact CE1-CD2 4.03Å; Y319-L323 WeakPolarHBondContact O-CB 3.29Å; Y319-L323 PolarHBondContact O-N 3.24Å; Y319-F355 HydrophobicContact CD1-CE1 4.34Å; Y319-F355 AromaticContact CD1-CZ 3.92Å; Y319-F355 HydrophobicContact CD1-CZ 3.92Å; Y319-F355 HydrophobicContact CE1-CZ 4.11Å
320L97.4Very high95.7Very high0 Ų040.4 Ų40.40%024%0.237CC..Hα-helixtrans-60.4-45.4177.3178.661000111.4Q316 V317 H322 L323 V324 L351 F355 I359 L360 L363Q316-L320 VanDerWaalsContact O-CB 3.26Å; Q316-L320 WeakPolarHBondContact O-CB 3.4Å; Q316-L320 PolarHBondContact O-N 3.2Å; V317-L320 PolarHBondContact O-N 2.99Å; L320-H322 PolarHBondContact O-N 3.41Å; L320-L323 PolarHBondContact O-N 3.44Å; L320-V324 HydrophobicContact CD1-CG2 4.06Å; L320-V324 HydrophobicContact CG-CG2 4.41Å; L320-V324 VanDerWaalsContact O-CG2 3.3Å; L320-V324 WeakPolarHBondContact O-CG2 3.25Å; L320-V324 PolarHBondContact O-N 3.43Å; L320-L351 HydrophobicContact CD1-CD2 3.6Å; L320-F355 HydrophobicContact CB-CD1 4.27Å; L320-F355 HydrophobicContact CB-CE1 4.19Å; L320-F355 HydrophobicContact CD1-CD1 4.43Å; L320-F355 HydrophobicContact CD1-CD2 3.85Å; L320-F355 HydrophobicContact CD1-CE2 4.01Å; L320-F355 HydrophobicContact CD1-CG 4.06Å; L320-F355 HydrophobicContact CD1-CZ 4.38Å; L320-F355 HydrophobicContact CD2-CB 4.18Å; L320-F355 HydrophobicContact CD2-CD1 4.26Å; L320-F355 HydrophobicContact CD2-CG 4.13Å; L320-I359 HydrophobicContact CD2-CG2 3.78Å; L320-L360 HydrophobicContact CD2-CD2 3.97Å; L320-L360 HydrophobicContact CD2-CG 4.47Å; L320-L363 HydrophobicContact CB-CD2 4.34Å; L320-L363 HydrophobicContact CD2-CD1 3.89Å; L320-L363 HydrophobicContact CD2-CD2 4.08Å; L320-L363 HydrophobicContact CD2-CG 4.11Å; L320-L363 HydrophobicContact CG-CD1 4.14Å; L320-L363 HydrophobicContact CG-CD2 3.97Å; L320-L363 HydrophobicContact CG-CG 4.45Å
321A97.6Very high95.5Very high13 Ų1340.6 Ų40.611%0.10724%0.239CC..Hα-helixtrans-58.2-47.9177.700000111.7V317 Y319 L323 V324 E325 L363 L367V317-A321 VanDerWaalsContact O-CB 3.26Å; V317-A321 WeakPolarHBondContact O-CB 3.44Å; V317-A321 PolarHBondContact O-N 3.45Å; Y319-A321 PolarHBondContact O-N 3Å; A321-L323 VanDerWaalsContact C-N 3.31Å; A321-L323 PolarHBondContact O-N 2.89Å; A321-V324 PolarHBondContact O-N 2.86Å; A321-E325 WeakPolarHBondContact O-CB 3.3Å; A321-E325 WeakPolarHBondContact O-CG 3.4Å; A321-E325 PolarHBondContact O-N 3.44Å; A321-L363 HydrophobicContact CB-CD2 3.78Å; A321-L367 HydrophobicContact CB-CD2 3.89Å
322H97.8Very high95.1Very high48 Ų4842.5 Ų42.522%0.22225%0.245CC..Hα-helixtrans-62.7-37.9178.6-163.573.3000112.2M275 D276 S318 Y319 L320 E325 G326M275-H322 HydrophobicContact SD-CB 4.42Å; M275-H322 VanDerWaalsContact SD-CD2 3.55Å; D276-H322 IonicContact OD1-CD2 2.73Å; D276-H322 IonicContact OD1-CE1 3.44Å; D276-H322 IonicContact OD1-NE2 3.19Å; D276-H322 PolarHBondContact OD1-NE2 2.85Å; D276-H322 IonicContact OD2-NE2 3.66Å; S318-H322 PolarHBondContact O-N 3.27Å; Y319-H322 PolarHBondContact O-N 2.89Å; L320-H322 PolarHBondContact O-N 3.41Å; H322-E325 PolarHBondContact O-N 2.97Å; H322-G326 PolarHBondContact O-N 3.01Å
323L97.1Very high93.9Very high0 Ų042.5 Ų42.50%027%0.265CS..Hα-helixtrans-68.8-41.9178.1-170.457.7000112.3M275 F279 A303 Y319 L320 A321 G326 L327 L351M275-L323 HydrophobicContact CE-CB 3.74Å; M275-L323 HydrophobicContact CE-CD1 3.89Å; M275-L323 HydrophobicContact CE-CD2 4.42Å; M275-L323 HydrophobicContact CE-CG 4.22Å; M275-L323 HydrophobicContact CG-CD1 3.83Å; M275-L323 WeakPolarHBondContact SD-CA 3.27Å; M275-L323 HydrophobicContact SD-CB 3.58Å; M275-L323 VanDerWaalsContact SD-CB 3.58Å; M275-L323 HydrophobicContact SD-CD1 3.47Å; M275-L323 WeakPolarHBondContact SD-CD1 3.26Å; M275-L323 HydrophobicContact SD-CG 4.08Å; F279-L323 HydrophobicContact CE2-CD1 3.81Å; F279-L323 HydrophobicContact CZ-CD1 3.8Å; A303-L323 HydrophobicContact CB-CD2 3.89Å; Y319-L323 HydrophobicContact CE1-CD2 4.03Å; Y319-L323 WeakPolarHBondContact O-CB 3.29Å; Y319-L323 PolarHBondContact O-N 3.24Å; L320-L323 PolarHBondContact O-N 3.44Å; A321-L323 VanDerWaalsContact C-N 3.31Å; A321-L323 PolarHBondContact O-N 2.89Å; L323-G326 PolarHBondContact O-N 3.01Å; L323-L327 VanDerWaalsContact O-CB 3.3Å; L323-L327 WeakPolarHBondContact O-CB 3.2Å; L323-L327 PolarHBondContact O-N 3.48Å; L323-L351 HydrophobicContact CD2-CD2 3.4Å; L323-L351 HydrophobicContact CG-CD2 3.95Å
324V97.6Very high93.1Very high1 Ų140.3 Ų40.31%0.00626%0.257CS..Hα-helixtrans-65.7-42.1174.7173.80000110.8L320 A321 L327 L328 L351 L367 F371L320-V324 HydrophobicContact CD1-CG2 4.06Å; L320-V324 HydrophobicContact CG-CG2 4.41Å; L320-V324 VanDerWaalsContact O-CG2 3.3Å; L320-V324 WeakPolarHBondContact O-CG2 3.25Å; L320-V324 PolarHBondContact O-N 3.43Å; A321-V324 PolarHBondContact O-N 2.86Å; V324-L327 PolarHBondContact O-N 2.94Å; V324-L328 HydrophobicContact CG1-CD1 3.86Å; V324-L328 HydrophobicContact CG1-CG 4.25Å; V324-L328 WeakPolarHBondContact O-CB 3.48Å; V324-L328 VanDerWaalsContact O-CG 3.25Å; V324-L328 WeakPolarHBondContact O-CG 3.43Å; V324-L328 PolarHBondContact O-N 3.2Å; V324-L351 HydrophobicContact CG2-CD1 4.13Å; V324-L367 HydrophobicContact CB-CD1 4.5Å; V324-L367 HydrophobicContact CB-CD2 4.36Å; V324-L367 HydrophobicContact CB-CG 4.44Å; V324-L367 HydrophobicContact CG1-CD1 3.81Å; V324-L367 HydrophobicContact CG1-CD2 4.32Å; V324-L367 HydrophobicContact CG1-CG 3.86Å; V324-F371 HydrophobicContact CG1-CB 3.8Å; V324-F371 HydrophobicContact CG1-CD2 3.9Å; V324-F371 HydrophobicContact CG1-CG 4.05Å; V324-F371 HydrophobicContact CG2-CD2 4.36Å
325E97Very high92.6Very high101 Ų10144.3 Ų44.347%0.47227%0.266SS..Hα-helixtrans-60.4-45.5175-75.4175.5-170.500111.9A321 H322 S329 L367A321-E325 WeakPolarHBondContact O-CB 3.3Å; A321-E325 WeakPolarHBondContact O-CG 3.4Å; A321-E325 PolarHBondContact O-N 3.44Å; H322-E325 PolarHBondContact O-N 2.97Å; E325-S329 VanDerWaalsContact O-CB 3.32Å; E325-S329 WeakPolarHBondContact O-CB 3.24Å; E325-S329 PolarHBondContact O-N 3.36Å; E325-L367 HydrophobicContact CG-CD1 3.59Å; E325-L367 HydrophobicContact CG-CD2 3.96Å; E325-L367 HydrophobicContact CG-CG 4.45Å
326G96.1Very high92.3Very high16 Ų1644.5 Ų44.517%0.16526%0.263CS..Hα-helixtrans-62.3-44.5176.200000112.8F279 H322 L323 S329 M330F279-G326 VanDerWaalsContact CZ-C 3.48Å; H322-G326 PolarHBondContact O-N 3.01Å; L323-G326 PolarHBondContact O-N 3.01Å; G326-S329 PolarHBondContact O-N 2.97Å; G326-M330 WeakPolarHBondContact O-CB 3.22Å; G326-M330 PolarHBondContact O-N 3.26Å
327L96.1Very high92Very high1 Ų146.1 Ų46.11%0.00527%0.27CS..Hα-helixtrans-61.9-49.8177.3-179.964.6000111.5F279 L323 V324 S329 M330 I331 I347 I348 L351 F371F279-L327 HydrophobicContact CE1-CB 4.4Å; F279-L327 HydrophobicContact CZ-CB 4.24Å; F279-L327 VanDerWaalsContact CZ-N 3.31Å; L323-L327 VanDerWaalsContact O-CB 3.3Å; L323-L327 WeakPolarHBondContact O-CB 3.2Å; L323-L327 PolarHBondContact O-N 3.48Å; V324-L327 PolarHBondContact O-N 2.94Å; L327-S329 VanDerWaalsContact C-N 3.33Å; L327-S329 PolarHBondContact O-N 3.41Å; L327-M330 HydrophobicContact CD1-CE 3.91Å; L327-M330 WeakPolarHBondContact O-CB 3.48Å; L327-M330 PolarHBondContact O-N 3.03Å; L327-M330 VanDerWaalsContact O-N 3.11Å; L327-I331 HydrophobicContact CD1-CD1 3.58Å; L327-I331 HydrophobicContact CD1-CG1 4.31Å; L327-I331 HydrophobicContact CG-CD1 3.78Å; L327-I331 WeakPolarHBondContact O-CG1 3.11Å; L327-I331 PolarHBondContact O-N 3.4Å; L327-I347 HydrophobicContact CD1-CG2 4.01Å; L327-I347 HydrophobicContact CD2-CG2 4.02Å; L327-I348 HydrophobicContact CD2-CG1 3.84Å; L327-L351 HydrophobicContact CD2-CD1 3.77Å; L327-F371 HydrophobicContact CD2-CE2 4.23Å
328L96.3Very high91.6Very high11 Ų1148.7 Ų48.76%0.05828%0.283CS..Hα-helixtrans-62.6-40.6178-70.9175.8000111.5V324 M330 I331 N332 L367 C374V324-L328 HydrophobicContact CG1-CD1 3.86Å; V324-L328 HydrophobicContact CG1-CG 4.25Å; V324-L328 WeakPolarHBondContact O-CB 3.48Å; V324-L328 VanDerWaalsContact O-CG 3.25Å; V324-L328 WeakPolarHBondContact O-CG 3.43Å; V324-L328 PolarHBondContact O-N 3.2Å; L328-M330 PolarHBondContact O-N 3.45Å; L328-I331 PolarHBondContact O-N 3.46Å; L328-N332 WeakPolarHBondContact O-CB 3.27Å; L328-N332 PolarHBondContact O-N 3.3Å; L328-N332 PolarHBondContact O-ND2 3.24Å; L328-N332 VanDerWaalsContact O-ND2 3.08Å; L328-L367 HydrophobicContact CD1-CD1 3.86Å; L328-C374 HydrophobicContact CD2-CB 3.45Å; L328-C374 VanDerWaalsContact CD2-CB 3.45Å
329S94.1Very high91.2Very high80 Ų8046.2 Ų46.256%0.55927%0.266SS*.Hα-helixtrans-65.7-26.3175.8-178.30000113.2E325 G326 L327E325-S329 VanDerWaalsContact O-CB 3.32Å; E325-S329 WeakPolarHBondContact O-CB 3.24Å; E325-S329 PolarHBondContact O-N 3.36Å; G326-S329 PolarHBondContact O-N 2.97Å; L327-S329 VanDerWaalsContact C-N 3.33Å; L327-S329 PolarHBondContact O-N 3.41Å
330M91.8Very high91.1Very high10 Ų1045.5 Ų45.55%0.04926%0.263CS..Hα-helixtrans-78.6-40.6177.8-176.7-177.88300111.4F279 H282 R283 L296 L299 G326 L327 L328 I344F279-M330 HydrophobicContact CD1-CB 4.31Å; F279-M330 HydrophobicContact CD1-SD 3.69Å; F279-M330 HydrophobicContact CE1-SD 3.97Å; H282-M330 PolarHBondContact CD2-SD 2.9Å; R283-M330 HydrophobicContact CG-CG 4.41Å; L296-M330 HydrophobicContact CD2-CE 4.05Å; L299-M330 HydrophobicContact CD1-SD 4.28Å; G326-M330 WeakPolarHBondContact O-CB 3.22Å; G326-M330 PolarHBondContact O-N 3.26Å; L327-M330 HydrophobicContact CD1-CE 3.91Å; L327-M330 WeakPolarHBondContact O-CB 3.48Å; L327-M330 PolarHBondContact O-N 3.03Å; L327-M330 VanDerWaalsContact O-N 3.11Å; L328-M330 PolarHBondContact O-N 3.45Å; M330-I344 HydrophobicContact CE-CG1 4.27Å
331I90.1Very high90.9Very high19 Ų1945.5 Ų45.510%0.09726%0.263CS..Hα-helixtrans-82.1-37.8-175.9-63.6169.1000111.7L327 L328 G333 I334 I336 I344 L378L327-I331 HydrophobicContact CD1-CD1 3.58Å; L327-I331 HydrophobicContact CD1-CG1 4.31Å; L327-I331 HydrophobicContact CG-CD1 3.78Å; L327-I331 WeakPolarHBondContact O-CG1 3.11Å; L327-I331 PolarHBondContact O-N 3.4Å; L328-I331 PolarHBondContact O-N 3.46Å; I331-G333 PolarHBondContact O-N 3.43Å; I331-I334 PolarHBondContact O-N 2.85Å; I331-I336 HydrophobicContact CG2-CD1 4.42Å; I331-I344 HydrophobicContact CD1-CG2 3.8Å; I331-L378 HydrophobicContact CD1-CD1 4.09Å; I331-L378 HydrophobicContact CG2-CD2 4.41Å
332N84.5Confident90.9Very high109 Ų10946.2 Ų46.258%0.58327%0.266SS*.THydrogen-bonded Turntrans-66.7111.2-175.4-73.9-27.8000111.7L328L328-N332 WeakPolarHBondContact O-CB 3.27Å; L328-N332 PolarHBondContact O-N 3.3Å; L328-N332 PolarHBondContact O-ND2 3.24Å; L328-N332 VanDerWaalsContact O-ND2 3.08Å
333G69.2Low90.7Very high86 Ų8644.4 Ų44.489%0.88726%0.26SS*.THydrogen-bonded Turntrans97.813172.800000115.4I331I331-G333 PolarHBondContact O-N 3.43Å
334I77.7Confident90.7Very high78 Ų7844.5 Ų44.540%0.426%0.261SS..SBendtrans-129.8143177-48.1-177.1000109.7R286 I331R286-I334 VanDerWaalsContact NH1-CG2 3.27Å; I331-I334 PolarHBondContact O-N 2.85Å
335E83.6Confident90.7Very high173 Ų17344.5 Ų44.581%0.80826%0.261SS*.PPolyproline II helixtrans-83.2120.3174.5-177.4171.7-161.500109.9R286R286-E335 VanDerWaalsContact CZ-O 3.27Å; R286-E335 PolarHBondContact NH1-O 3.34Å; R286-E335 PolarHBondContact NH2-O 2.88Å
336I89.7Confident90.6Very high31 Ų3141.2 Ų41.216%0.15925%0.247CC..PPolyproline II helixtrans-68.3129.7-177.9-64175.7000110I331 E340 I344 L378 F382I331-I336 HydrophobicContact CG2-CD1 4.42Å; I336-E340 HydrophobicContact CG2-CB 4.15Å; I336-I344 HydrophobicContact CD1-CD1 3.86Å; I336-I344 HydrophobicContact CG1-CD1 4.02Å; I336-I344 HydrophobicContact CG2-CD1 4.03Å; I336-L378 HydrophobicContact CD1-CD2 3.2Å; I336-F382 HydrophobicContact CD1-CE1 4.13Å; I336-F382 HydrophobicContact CD1-CZ 4.02Å; I336-F382 HydrophobicContact CG2-CE1 4.07Å; I336-F382 HydrophobicContact CG2-CZ 4.13Å
337E88.5Confident90.7Very high71 Ų7140.5 Ų40.533%0.33224%0.239SC..PPolyproline II helixtrans-89.8158.3175.8-66171.9-148.200111R286 S339 E340 A341R286-E337 IonicContact CZ-OE1 2.96Å; R286-E337 IonicContact NH1-OE1 3.78Å; R286-E337 PolarHBondContact NH1-OE1 3.14Å; R286-E337 VanDerWaalsContact NH1-OE1 3.08Å; E337-S339 PolarHBondContact O-N 2.83Å; E337-E340 HydrophobicContact CB-CG 4.45Å; E337-E340 PolarHBondContact N-OE2 3.21Å; E337-E340 PolarHBondContact O-N 3.49Å; E337-A341 PolarHBondContact O-N 3.3Å
338D87.7Confident90.8Very high79 Ų7940.5 Ų40.542%0.42224%0.239SC..Hα-helixtrans-53-43-179.4-62.51.2000111.6E340 A341 K394 V398 Y399D338-E340 PolarHBondContact O-N 3.34Å; D338-E340 VanDerWaalsContact O-N 3.07Å; D338-A341 PolarHBondContact O-N 3.03Å; D338-K394 IonicContact OD2-NZ 3.42Å; D338-V398 VanDerWaalsContact O-CG1 3.24Å; D338-V398 WeakPolarHBondContact O-CG1 3.47Å; D338-Y399 HydrophobicContact CB-CE2 4.33Å; D338-Y399 WeakPolarHBondContact OD1-CE2 3.42Å; D338-Y399 VanDerWaalsContact OD1-CZ 3.31Å; D338-Y399 PolarHBondContact OD1-OH 3.46Å
339S88.4Confident90.8Very high27 Ų2740.3 Ų40.319%0.18924%0.238CC..Hα-helixtrans-64.5-14-179640000114.6E337E337-S339 PolarHBondContact O-N 2.83Å
340E94.3Very high90.9Very high2 Ų238 Ų381%0.00922%0.22CC..Hα-helixtrans-104.7-21.7-176.5-59.4178106.400113.7H282 R286 L296 I336 E337 D338 V342 G343 I344H282-E340 IonicContact CE1-OE1 3.77Å; H282-E340 PolarHBondContact CE1-OE1 3.11Å; H282-E340 VanDerWaalsContact CE1-OE1 3.3Å; H282-E340 IonicContact NE2-OE1 3.73Å; H282-E340 PolarHBondContact NE2-OE1 3.35Å; R286-E340 WeakPolarHBondContact CD-OE1 3.4Å; R286-E340 VanDerWaalsContact CG-OE1 3.25Å; R286-E340 WeakPolarHBondContact CG-OE1 3.31Å; R286-E340 IonicContact CZ-OE1 3.9Å; R286-E340 IonicContact CZ-OE2 2.96Å; R286-E340 IonicContact NE-OE1 3.86Å; R286-E340 PolarHBondContact NE-OE1 3.36Å; R286-E340 IonicContact NE-OE2 2.75Å; R286-E340 PolarHBondContact NE-OE2 3.07Å; R286-E340 VanDerWaalsContact NE-OE2 3.09Å; R286-E340 IonicContact NH1-OE2 2.64Å; R286-E340 IonicContact NH2-OE1 2.85Å; R286-E340 IonicContact NH2-OE2 2.67Å; R286-E340 PolarHBondContact NH2-OE2 2.89Å; L296-E340 HydrophobicContact CD1-CB 3.72Å; L296-E340 HydrophobicContact CD1-CG 3.96Å; I336-E340 HydrophobicContact CG2-CB 4.15Å; E337-E340 HydrophobicContact CB-CG 4.45Å; E337-E340 PolarHBondContact N-OE2 3.21Å; E337-E340 PolarHBondContact O-N 3.49Å; D338-E340 PolarHBondContact O-N 3.34Å; D338-E340 VanDerWaalsContact O-N 3.07Å; E340-V342 PolarHBondContact O-N 2.94Å; E340-G343 PolarHBondContact O-N 3.24Å; E340-G343 VanDerWaalsContact O-N 3.08Å; E340-I344 HydrophobicContact CB-CD1 4.03Å; E340-I344 WeakPolarHBondContact O-CG1 3.49Å; E340-I344 PolarHBondContact O-N 3.49Å
341A95.1Very high91.1Very high0 Ų037.5 Ų37.50%022%0.217CC..Hα-helixtrans-55.3-50.8-169.300000112.2E337 D338 I344 S345 F382 V398 Y399 A402E337-A341 PolarHBondContact O-N 3.3Å; D338-A341 PolarHBondContact O-N 3.03Å; A341-I344 PolarHBondContact O-N 3.46Å; A341-S345 PolarHBondContact O-N 3.33Å; A341-S345 PolarHBondContact O-OG 2.98Å; A341-F382 HydrophobicContact CB-CE1 4.15Å; A341-F382 HydrophobicContact CB-CE2 4.23Å; A341-F382 HydrophobicContact CB-CZ 3.9Å; A341-V398 HydrophobicContact CB-CG1 4.46Å; A341-Y399 HydrophobicContact CB-CD1 3.83Å; A341-Y399 HydrophobicContact CB-CE1 3.66Å; A341-A402 HydrophobicContact CB-CB 4.02Å
342V95.7Very high91.3Very high27 Ų2736.9 Ų36.916%0.16421%0.214CC..Hα-helixtrans-65.9-38.2178.2174.30000111.8E340 S345 N346 V398 E401 A402E340-V342 PolarHBondContact O-N 2.94Å; V342-S345 WeakPolarHBondContact CA-OG 3.31Å; V342-S345 PolarHBondContact O-OG 3.32Å; V342-N346 WeakPolarHBondContact CG1-ND2 3.35Å; V342-N346 VanDerWaalsContact O-CB 3.26Å; V342-N346 WeakPolarHBondContact O-CB 3.35Å; V342-N346 PolarHBondContact O-N 2.93Å; V342-N346 PolarHBondContact O-ND2 3.46Å; V342-N346 VanDerWaalsContact O-ND2 3.13Å; V342-V398 HydrophobicContact CG2-CG1 3.71Å; V342-V398 VanDerWaalsContact CG2-O 3.29Å; V342-V398 WeakPolarHBondContact CG2-O 3.37Å; V342-E401 HydrophobicContact CG2-CB 4.2Å; V342-E401 HydrophobicContact CG2-CG 4.28Å; V342-A402 HydrophobicContact CG2-CB 4.15Å
343G95.3Very high91.7Very high10 Ų1034.3 Ų34.310%0.10320%0.203CC..Hα-helixtrans-63.9-43.2177.400000112.2E340 I347E340-G343 PolarHBondContact O-N 3.24Å; E340-G343 VanDerWaalsContact O-N 3.08Å; G343-I347 VanDerWaalsContact O-CG1 3.27Å; G343-I347 WeakPolarHBondContact O-CG1 3.47Å; G343-I347 PolarHBondContact O-N 3.08Å; G343-I347 VanDerWaalsContact O-N 3.11Å
344I96.9Very high92.8Very high3 Ų332.2 Ų32.22%0.01517%0.17CC..Hα-helixtrans-69.1-44.4178.4-67.3170.3000111.1L296 M330 I331 I336 E340 A341 N346 I347 I348 L378L296-I344 HydrophobicContact CD2-CG1 4.15Å; M330-I344 HydrophobicContact CE-CG1 4.27Å; I331-I344 HydrophobicContact CD1-CG2 3.8Å; I336-I344 HydrophobicContact CD1-CD1 3.86Å; I336-I344 HydrophobicContact CG1-CD1 4.02Å; I336-I344 HydrophobicContact CG2-CD1 4.03Å; E340-I344 HydrophobicContact CB-CD1 4.03Å; E340-I344 WeakPolarHBondContact O-CG1 3.49Å; E340-I344 PolarHBondContact O-N 3.49Å; A341-I344 PolarHBondContact O-N 3.46Å; I344-N346 VanDerWaalsContact C-N 3.31Å; I344-N346 PolarHBondContact O-N 2.88Å; I344-I347 PolarHBondContact O-N 3.49Å; I344-I348 HydrophobicContact CG2-CD1 3.98Å; I344-I348 WeakPolarHBondContact O-CG1 3.42Å; I344-I348 PolarHBondContact O-N 3.46Å; I344-I348 VanDerWaalsContact O-N 3.08Å; I344-L378 HydrophobicContact CG2-CD1 4.01Å
345S96.9Very high93.5Very high0 Ų028.8 Ų28.80%015%0.153CC..Hα-helixtrans-62.1-39.5177.265.60000111.7A341 V342 I348 S349 A402A341-S345 PolarHBondContact O-N 3.33Å; A341-S345 PolarHBondContact O-OG 2.98Å; V342-S345 WeakPolarHBondContact CA-OG 3.31Å; V342-S345 PolarHBondContact O-OG 3.32Å; S345-I348 PolarHBondContact O-N 3.23Å; S345-S349 VanDerWaalsContact O-CB 3.3Å; S345-S349 WeakPolarHBondContact O-CB 3.3Å; S345-S349 PolarHBondContact O-N 2.94Å; S345-A402 WeakPolarHBondContact CB-O 3.36Å; S345-A402 WeakPolarHBondContact OG-CA 3.13Å
346N96.1Very high93.8Very high33 Ų3323.6 Ų23.618%0.17613%0.134CC..Hα-helixtrans-64.2-39.4175.1-79-30000113A300 V342 I344 N350A300-N346 HydrophobicContact CB-CB 4.25Å; V342-N346 WeakPolarHBondContact CG1-ND2 3.35Å; V342-N346 VanDerWaalsContact O-CB 3.26Å; V342-N346 WeakPolarHBondContact O-CB 3.35Å; V342-N346 PolarHBondContact O-N 2.93Å; V342-N346 PolarHBondContact O-ND2 3.46Å; V342-N346 VanDerWaalsContact O-ND2 3.13Å; I344-N346 VanDerWaalsContact C-N 3.31Å; I344-N346 PolarHBondContact O-N 2.88Å; N346-N350 VanDerWaalsContact O-CB 3.31Å; N346-N350 WeakPolarHBondContact O-CB 3.31Å; N346-N350 PolarHBondContact O-N 3.4Å; N346-N350 PolarHBondContact O-ND2 3.39Å
347I97.6Very high93.8Very high0 Ų027.7 Ų27.70%015%0.147CC..Hα-helixtrans-60.1-50.9173.7-66.2161.4000109.7L296 L299 A300 A303 L327 G343 I344 S349 N350 L351L296-I347 HydrophobicContact CD2-CD1 3.86Å; L299-I347 HydrophobicContact CB-CD1 3.61Å; L299-I347 HydrophobicContact CB-CG1 4.06Å; L299-I347 HydrophobicContact CD1-CD1 4.33Å; A300-I347 HydrophobicContact CB-CG1 3.89Å; A303-I347 HydrophobicContact CB-CG2 4.11Å; L327-I347 HydrophobicContact CD1-CG2 4.01Å; L327-I347 HydrophobicContact CD2-CG2 4.02Å; G343-I347 VanDerWaalsContact O-CG1 3.27Å; G343-I347 WeakPolarHBondContact O-CG1 3.47Å; G343-I347 PolarHBondContact O-N 3.08Å; G343-I347 VanDerWaalsContact O-N 3.11Å; I344-I347 PolarHBondContact O-N 3.49Å; I347-S349 PolarHBondContact O-N 3.5Å; I347-N350 PolarHBondContact O-N 3.49Å; I347-L351 HydrophobicContact CG2-CD1 4.26Å; I347-L351 HydrophobicContact CG2-CG 4.47Å; I347-L351 VanDerWaalsContact O-CG 3.29Å; I347-L351 WeakPolarHBondContact O-CG 3.42Å; I347-L351 PolarHBondContact O-N 3.24Å
348I97.3Very high93.9Very high1 Ų127.2 Ų27.21%0.00515%0.151CC..Hα-helixtrans-62.3-44.9-178.2-68169.3000111.1L327 I344 S345 L351 I352 F371 L375 L378 L406L327-I348 HydrophobicContact CD2-CG1 3.84Å; I344-I348 HydrophobicContact CG2-CD1 3.98Å; I344-I348 WeakPolarHBondContact O-CG1 3.42Å; I344-I348 PolarHBondContact O-N 3.46Å; I344-I348 VanDerWaalsContact O-N 3.08Å; S345-I348 PolarHBondContact O-N 3.23Å; I348-L351 WeakPolarHBondContact O-CB 3.46Å; I348-L351 PolarHBondContact O-N 2.97Å; I348-I352 HydrophobicContact CG2-CD1 3.87Å; I348-I352 WeakPolarHBondContact O-CG1 3.47Å; I348-I352 PolarHBondContact O-N 3.13Å; I348-I352 VanDerWaalsContact O-N 3.14Å; I348-F371 HydrophobicContact CG1-CE2 4.44Å; I348-F371 HydrophobicContact CG2-CE2 4.37Å; I348-F371 HydrophobicContact CG2-CZ 4.08Å; I348-L375 HydrophobicContact CG2-CD1 3.8Å; I348-L378 HydrophobicContact CD1-CD1 3.48Å; I348-L378 VanDerWaalsContact CD1-CD1 3.48Å; I348-L406 HydrophobicContact CB-CD2 4.09Å; I348-L406 HydrophobicContact CD1-CD2 4.18Å; I348-L406 HydrophobicContact CG2-CD2 3.93Å
349S96.3Very high94.2Very high7 Ų723.5 Ų23.55%0.04913%0.131CC..Hα-helixtrans-60.8-45.7177.4179.70000111.7S345 I347 L351 I352 T353 S409S345-S349 VanDerWaalsContact O-CB 3.3Å; S345-S349 WeakPolarHBondContact O-CB 3.3Å; S345-S349 PolarHBondContact O-N 2.94Å; I347-S349 PolarHBondContact O-N 3.5Å; S349-L351 VanDerWaalsContact C-N 3.34Å; S349-L351 PolarHBondContact O-N 2.97Å; S349-I352 PolarHBondContact O-N 3.02Å; S349-T353 WeakPolarHBondContact O-CB 3.26Å; S349-T353 WeakPolarHBondContact O-CG2 3.31Å; S349-T353 PolarHBondContact O-N 3.03Å; S349-T353 PolarHBondContact O-OG1 3.39Å; S349-S409 WeakPolarHBondContact CA-OG 2.76Å; S349-S409 VanDerWaalsContact CB-OG 3.27Å; S349-S409 WeakPolarHBondContact CB-OG 3.29Å; S349-S409 PolarHBondContact OG-OG 3.11Å
350N96.2Very high94.4Very high31 Ų3122.4 Ų22.417%0.16612%0.124CC..Hα-helixtrans-62.6-39.9175.9-73.8-19.9000112.3A300 A303 N346 I347 I352 M354A300-N350 PolarHBondContact O-ND2 2.8Å; A303-N350 HydrophobicContact CB-CB 3.86Å; N346-N350 VanDerWaalsContact O-CB 3.31Å; N346-N350 WeakPolarHBondContact O-CB 3.31Å; N346-N350 PolarHBondContact O-N 3.4Å; N346-N350 PolarHBondContact O-ND2 3.39Å; I347-N350 PolarHBondContact O-N 3.49Å; N350-I352 PolarHBondContact O-N 2.9Å; N350-M354 HydrophobicContact CB-CG 4.38Å; N350-M354 WeakPolarHBondContact O-CB 3.41Å; N350-M354 WeakPolarHBondContact O-CG 3.33Å; N350-M354 PolarHBondContact O-N 2.96Å
351L96.3Very high94.2Very high0 Ų025.3 Ų25.30%014%0.141CC..Hα-helixtrans-59.5-37176.3-73179.2000112.6A303 L320 L323 V324 L327 I347 I348 S349 F355 F371A303-L351 HydrophobicContact CB-CD2 3.9Å; A303-L351 HydrophobicContact CB-CG 4.06Å; L320-L351 HydrophobicContact CD1-CD2 3.6Å; L323-L351 HydrophobicContact CD2-CD2 3.4Å; L323-L351 HydrophobicContact CG-CD2 3.95Å; V324-L351 HydrophobicContact CG2-CD1 4.13Å; L327-L351 HydrophobicContact CD2-CD1 3.77Å; I347-L351 HydrophobicContact CG2-CD1 4.26Å; I347-L351 HydrophobicContact CG2-CG 4.47Å; I347-L351 VanDerWaalsContact O-CG 3.29Å; I347-L351 WeakPolarHBondContact O-CG 3.42Å; I347-L351 PolarHBondContact O-N 3.24Å; I348-L351 WeakPolarHBondContact O-CB 3.46Å; I348-L351 PolarHBondContact O-N 2.97Å; S349-L351 VanDerWaalsContact C-N 3.34Å; S349-L351 PolarHBondContact O-N 2.97Å; L351-F355 HydrophobicContact CD2-CD2 4.37Å; L351-F355 HydrophobicContact CD2-CE2 4Å; L351-F355 WeakPolarHBondContact O-CD2 3.47Å; L351-F371 HydrophobicContact CB-CZ 4.34Å; L351-F371 HydrophobicContact CD1-CE2 4Å; L351-F371 HydrophobicContact CD1-CZ 4.28Å
352I94.9Very high94.2Very high6 Ų627.9 Ų27.93%0.03116%0.163CC..Hα-helixtrans-82-44.1-177.2-71.7165.6000111.5I348 S349 N350 F371 L375 T412 L413I348-I352 HydrophobicContact CG2-CD1 3.87Å; I348-I352 WeakPolarHBondContact O-CG1 3.47Å; I348-I352 PolarHBondContact O-N 3.13Å; I348-I352 VanDerWaalsContact O-N 3.14Å; S349-I352 PolarHBondContact O-N 3.02Å; N350-I352 PolarHBondContact O-N 2.9Å; I352-F371 HydrophobicContact CD1-CE1 4.14Å; I352-F371 HydrophobicContact CD1-CZ 4.12Å; I352-F371 HydrophobicContact CG1-CE1 4.01Å; I352-F371 HydrophobicContact CG1-CZ 4.09Å; I352-L375 HydrophobicContact CD1-CD2 3.96Å; I352-T412 HydrophobicContact CG2-CG2 4.08Å; I352-L413 HydrophobicContact CD1-CD1 3.75Å; I352-L413 HydrophobicContact CD1-CG 4.22Å; I352-L413 HydrophobicContact CG1-CD1 4.21Å; I352-L413 HydrophobicContact CG1-CD2 4.33Å; I352-L413 HydrophobicContact CG1-CG 4.3Å; I352-L413 HydrophobicContact CG2-CD1 4.42Å; I352-L413 HydrophobicContact CG2-CD2 3.9Å; I352-L413 HydrophobicContact CG2-CG 3.68Å
353T92.1Very high94.2Very high55 Ų5527.1 Ų27.134%0.33716%0.158SC..Hα-helixtrans-81.1-30.6-173.355.30000113.1S349 T412S349-T353 WeakPolarHBondContact O-CB 3.26Å; S349-T353 WeakPolarHBondContact O-CG2 3.31Å; S349-T353 PolarHBondContact O-N 3.03Å; S349-T353 PolarHBondContact O-OG1 3.39Å; T353-T412 HydrophobicContact CG2-CG2 4.4Å
354M92.4Very high94.2Very high42 Ų4230 Ų3021%0.20718%0.175CC..Hα-helixtrans-94.1-27.2-171.7-56.5-56.9-59.300113.7T258 H306 N350T258-M354 HydrophobicContact CG2-CE 3.85Å; T258-M354 HydrophobicContact CG2-SD 4.1Å; H306-M354 HydrophobicContact CB-CE 4.47Å; H306-M354 WeakPolarHBondContact CE1-CE 3.44Å; H306-M354 WeakPolarHBondContact ND1-CE 3.34Å; N350-M354 HydrophobicContact CB-CG 4.38Å; N350-M354 WeakPolarHBondContact O-CB 3.41Å; N350-M354 WeakPolarHBondContact O-CG 3.33Å; N350-M354 PolarHBondContact O-N 2.96Å
355F92.8Very high93.9Very high7 Ų734.3 Ų34.33%0.03121%0.205CC..SBendtrans-91.9129.3178.1-71.7-88.8000110.9A303 F310 Y319 L320 L351 I359A303-F355 WeakPolarHBondContact O-CE2 3.48Å; F310-F355 HydrophobicContact CE2-CE1 4.41Å; F310-F355 HydrophobicContact CZ-CE1 4.13Å; F310-F355 HydrophobicContact CZ-CZ 4.44Å; Y319-F355 HydrophobicContact CD1-CE1 4.34Å; Y319-F355 AromaticContact CD1-CZ 3.92Å; Y319-F355 HydrophobicContact CD1-CZ 3.92Å; Y319-F355 HydrophobicContact CE1-CZ 4.11Å; L320-F355 HydrophobicContact CB-CD1 4.27Å; L320-F355 HydrophobicContact CB-CE1 4.19Å; L320-F355 HydrophobicContact CD1-CD1 4.43Å; L320-F355 HydrophobicContact CD1-CD2 3.85Å; L320-F355 HydrophobicContact CD1-CE2 4.01Å; L320-F355 HydrophobicContact CD1-CG 4.06Å; L320-F355 HydrophobicContact CD1-CZ 4.38Å; L320-F355 HydrophobicContact CD2-CB 4.18Å; L320-F355 HydrophobicContact CD2-CD1 4.26Å; L320-F355 HydrophobicContact CD2-CG 4.13Å; L351-F355 HydrophobicContact CD2-CD2 4.37Å; L351-F355 HydrophobicContact CD2-CE2 4Å; L351-F355 WeakPolarHBondContact O-CD2 3.47Å; F355-I359 HydrophobicContact CD1-CG2 4.25Å
356P90.4Very high93.9Very high63 Ų6342 Ų4241%0.40924%0.241SC..  trans-58.9150177.6-22.331.4000112.3S358 I359 L360P356-S358 PolarHBondContact O-N 3.47Å; P356-S358 VanDerWaalsContact O-N 3.16Å; P356-I359 HydrophobicContact CB-CG1 4.19Å; P356-I359 HydrophobicContact CG-CG1 4.25Å; P356-I359 WeakPolarHBondContact O-CA 3.29Å; P356-I359 VanDerWaalsContact O-CB 3.3Å; P356-I359 WeakPolarHBondContact O-CB 3.15Å; P356-I359 PolarHBondContact O-N 2.77Å; P356-L360 PolarHBondContact O-N 3.19Å
357R88.4Confident93.9Very high118 Ų11841.4 Ų41.445%0.44524%0.238SC..Hα-helixtrans-55.2-35.4179.7-55167.4-161.3163.5-2.6113.2I359 L360 T361 D416R357-I359 PolarHBondContact O-N 3.36Å; R357-L360 PolarHBondContact O-N 2.96Å; R357-T361 WeakPolarHBondContact O-CB 3.29Å; R357-T361 WeakPolarHBondContact O-CG2 3.38Å; R357-T361 PolarHBondContact O-N 3.4Å; R357-T361 PolarHBondContact O-OG1 3.26Å; R357-D416 IonicContact CZ-OD1 3.02Å; R357-D416 IonicContact CZ-OD2 3.39Å; R357-D416 VanDerWaalsContact NE-CG 3.26Å; R357-D416 IonicContact NE-OD1 3.69Å; R357-D416 IonicContact NE-OD2 2.92Å; R357-D416 PolarHBondContact NE-OD2 3.26Å; R357-D416 IonicContact NH1-OD1 3.62Å; R357-D416 PolarHBondContact NH1-OD1 3Å; R357-D416 IonicContact NH1-OD2 2.91Å; R357-D416 PolarHBondContact NH1-OD2 2.92Å; R357-D416 IonicContact NH2-OD1 2.86Å; R357-D416 PolarHBondContact NH2-OD1 3.22Å; R357-D416 IonicContact NH2-OD2 3.45Å; R357-D416 PolarHBondContact NH2-OD2 3.18Å
358S90.6Very high93.7Very high60 Ų6042.4 Ų42.442%0.4224%0.242SC..Hα-helixtrans-61.2-29.717554.20000112.9P356 T361 A362P356-S358 PolarHBondContact O-N 3.47Å; P356-S358 VanDerWaalsContact O-N 3.16Å; S358-T361 PolarHBondContact O-OG1 2.95Å; S358-A362 WeakPolarHBondContact O-CB 3.4Å; S358-A362 PolarHBondContact O-N 2.76Å
359I94.2Very high93.6Very high1 Ų145.9 Ų45.91%0.00526%0.264CS..Hα-helixtrans-81.9-43.5178.5-51.7-56.1000110.4E313 Q316 V317 L320 F355 P356 R357 T361 A362 L363E313-I359 HydrophobicContact CB-CD1 3.7Å; E313-I359 HydrophobicContact CG-CD1 3.92Å; Q316-I359 HydrophobicContact CB-CD1 4.12Å; Q316-I359 HydrophobicContact CB-CG1 4.28Å; Q316-I359 HydrophobicContact CB-CG2 3.92Å; V317-I359 HydrophobicContact CB-CG2 4.42Å; V317-I359 HydrophobicContact CG2-CB 4.43Å; V317-I359 HydrophobicContact CG2-CD1 4.15Å; V317-I359 HydrophobicContact CG2-CG2 3.74Å; L320-I359 HydrophobicContact CD2-CG2 3.78Å; F355-I359 HydrophobicContact CD1-CG2 4.25Å; P356-I359 HydrophobicContact CB-CG1 4.19Å; P356-I359 HydrophobicContact CG-CG1 4.25Å; P356-I359 WeakPolarHBondContact O-CA 3.29Å; P356-I359 VanDerWaalsContact O-CB 3.3Å; P356-I359 WeakPolarHBondContact O-CB 3.15Å; P356-I359 PolarHBondContact O-N 2.77Å; R357-I359 PolarHBondContact O-N 3.36Å; I359-T361 VanDerWaalsContact C-N 3.33Å; I359-T361 PolarHBondContact O-N 3.26Å; I359-A362 PolarHBondContact O-N 2.8Å; I359-A362 VanDerWaalsContact O-N 3.15Å; I359-L363 PolarHBondContact O-N 3.17Å
360L92.9Very high93.6Very high5 Ų548.2 Ų48.23%0.02628%0.28CS..Hα-helixtrans-58.4-44.5176-73.1165.8000111.7L320 P356 R357 A362 L363 L413 F420L320-L360 HydrophobicContact CD2-CD2 3.97Å; L320-L360 HydrophobicContact CD2-CG 4.47Å; P356-L360 PolarHBondContact O-N 3.19Å; R357-L360 PolarHBondContact O-N 2.96Å; L360-A362 VanDerWaalsContact C-N 3.27Å; L360-A362 PolarHBondContact O-N 3.4Å; L360-L363 WeakPolarHBondContact O-CB 3.28Å; L360-L363 WeakPolarHBondContact O-CG 3.33Å; L360-L363 PolarHBondContact O-N 3.32Å; L360-L413 HydrophobicContact CD1-CD2 4.31Å; L360-F420 HydrophobicContact CB-CE1 4.43Å
361T90.7Very high93.6Very high62 Ų6246.9 Ų46.938%0.3827%0.273SS..THydrogen-bonded Turntrans-72.4-18.1178.752.10000113.7R357 S358 I359 L363 F420R357-T361 WeakPolarHBondContact O-CB 3.29Å; R357-T361 WeakPolarHBondContact O-CG2 3.38Å; R357-T361 PolarHBondContact O-N 3.4Å; R357-T361 PolarHBondContact O-OG1 3.26Å; S358-T361 PolarHBondContact O-OG1 2.95Å; I359-T361 VanDerWaalsContact C-N 3.33Å; I359-T361 PolarHBondContact O-N 3.26Å; T361-L363 VanDerWaalsContact C-N 3.33Å; T361-F420 HydrophobicContact CG2-CD1 3.6Å; T361-F420 HydrophobicContact CG2-CE1 3.61Å; T361-F420 HydrophobicContact CG2-CG 4.21Å; T361-F420 HydrophobicContact CG2-CZ 4.25Å
362A94.6Very high93.6Very high54 Ų5447.2 Ų47.245%0.44627%0.274SS..THydrogen-bonded Turntrans-84.9-4.717600000113.6V317 S358 I359 L360V317-A362 HydrophobicContact CG1-CB 4.26Å; V317-A362 HydrophobicContact CG2-CB 3.63Å; S358-A362 WeakPolarHBondContact O-CB 3.4Å; S358-A362 PolarHBondContact O-N 2.76Å; I359-A362 PolarHBondContact O-N 2.8Å; I359-A362 VanDerWaalsContact O-N 3.15Å; L360-A362 VanDerWaalsContact C-N 3.27Å; L360-A362 PolarHBondContact O-N 3.4Å
363L95.1Very high93.7Very high12 Ų1250.7 Ų50.76%0.06329%0.293CS..SBendtrans-63.1152.1173.8-69.8173.6000111.8L320 A321 I359 L360 T361 S365 L367 F368L320-L363 HydrophobicContact CB-CD2 4.34Å; L320-L363 HydrophobicContact CD2-CD1 3.89Å; L320-L363 HydrophobicContact CD2-CD2 4.08Å; L320-L363 HydrophobicContact CD2-CG 4.11Å; L320-L363 HydrophobicContact CG-CD1 4.14Å; L320-L363 HydrophobicContact CG-CD2 3.97Å; L320-L363 HydrophobicContact CG-CG 4.45Å; A321-L363 HydrophobicContact CB-CD2 3.78Å; I359-L363 PolarHBondContact O-N 3.17Å; L360-L363 WeakPolarHBondContact O-CB 3.28Å; L360-L363 WeakPolarHBondContact O-CG 3.33Å; L360-L363 PolarHBondContact O-N 3.32Å; T361-L363 VanDerWaalsContact C-N 3.33Å; L363-S365 PolarHBondContact O-N 3.04Å; L363-L367 HydrophobicContact CD2-CD2 4.48Å; L363-F368 HydrophobicContact CB-CB 4.35Å; L363-F368 HydrophobicContact CD1-CD2 4.44Å
364P95.3Very high93.8Very high70 Ų7048.5 Ų48.546%0.45528%0.28SS..  trans-54.2129.7170.4-23.633.3000110.9E366 L367 F368P364-E366 VanDerWaalsContact C-N 3.3Å; P364-E366 PolarHBondContact O-N 3.07Å; P364-L367 HydrophobicContact CB-CB 4.1Å; P364-L367 HydrophobicContact CG-CB 4.47Å; P364-L367 WeakPolarHBondContact O-CA 3.41Å; P364-L367 WeakPolarHBondContact O-CB 3.37Å; P364-L367 PolarHBondContact O-N 3.33Å; P364-F368 PolarHBondContact O-N 3.29Å
365S91.9Very high94.1Very high93 Ų9346.6 Ų46.665%0.6527%0.27SS*.Hα-helixtrans-52.2-43.1-174.256.50000114.1L363 L367 F368 T369L363-S365 PolarHBondContact O-N 3.04Å; S365-L367 VanDerWaalsContact C-N 3.32Å; S365-L367 PolarHBondContact O-N 3.23Å; S365-F368 PolarHBondContact O-N 3.25Å; S365-T369 WeakPolarHBondContact O-CB 3.42Å; S365-T369 PolarHBondContact O-N 3.36Å; S365-T369 PolarHBondContact O-OG1 3.02Å
366E94.9Very high94.3Very high161 Ų16146.3 Ų46.375%0.75227%0.269SS*.Hα-helixtrans-63.5-36.8176.8-64.5-175.2175.600112.7P364 S370P364-E366 VanDerWaalsContact C-N 3.3Å; P364-E366 PolarHBondContact O-N 3.07Å; E366-S370 WeakPolarHBondContact O-CB 3.48Å; E366-S370 PolarHBondContact O-N 3.22Å; E366-S370 PolarHBondContact O-OG 2.87Å
367L96.4Very high94.6Very high21 Ų2148.9 Ų48.911%0.1128%0.279CS..Hα-helixtrans-70.4-46178.2-174.964.1000110.7A321 V324 E325 L328 L363 P364 S365 S370 F371A321-L367 HydrophobicContact CB-CD2 3.89Å; V324-L367 HydrophobicContact CB-CD1 4.5Å; V324-L367 HydrophobicContact CB-CD2 4.36Å; V324-L367 HydrophobicContact CB-CG 4.44Å; V324-L367 HydrophobicContact CG1-CD1 3.81Å; V324-L367 HydrophobicContact CG1-CD2 4.32Å; V324-L367 HydrophobicContact CG1-CG 3.86Å; E325-L367 HydrophobicContact CG-CD1 3.59Å; E325-L367 HydrophobicContact CG-CD2 3.96Å; E325-L367 HydrophobicContact CG-CG 4.45Å; L328-L367 HydrophobicContact CD1-CD1 3.86Å; L363-L367 HydrophobicContact CD2-CD2 4.48Å; P364-L367 HydrophobicContact CB-CB 4.1Å; P364-L367 HydrophobicContact CG-CB 4.47Å; P364-L367 WeakPolarHBondContact O-CA 3.41Å; P364-L367 WeakPolarHBondContact O-CB 3.37Å; P364-L367 PolarHBondContact O-N 3.33Å; S365-L367 VanDerWaalsContact C-N 3.32Å; S365-L367 PolarHBondContact O-N 3.23Å; L367-S370 PolarHBondContact O-N 3.19Å; L367-F371 WeakPolarHBondContact O-CB 3.39Å; L367-F371 PolarHBondContact O-N 2.91Å
368F94.7Very high95Very high21 Ų2143.7 Ų43.79%0.09226%0.26CS..Hα-helixtrans-60.1-47175.6-178.7-100.4000111.4L363 P364 S365 S370 F371 I372 F420 F425L363-F368 HydrophobicContact CB-CB 4.35Å; L363-F368 HydrophobicContact CD1-CD2 4.44Å; P364-F368 PolarHBondContact O-N 3.29Å; S365-F368 PolarHBondContact O-N 3.25Å; F368-S370 VanDerWaalsContact C-N 3.31Å; F368-S370 PolarHBondContact O-N 3.09Å; F368-F371 WeakPolarHBondContact O-CB 3.25Å; F368-F371 PolarHBondContact O-N 3.49Å; F368-I372 HydrophobicContact CD1-CG1 4.19Å; F368-I372 HydrophobicContact CE1-CD1 4.43Å; F368-I372 HydrophobicContact CE1-CG1 3.76Å; F368-I372 HydrophobicContact CE2-CD1 4.12Å; F368-I372 HydrophobicContact CE2-CG1 4.13Å; F368-I372 HydrophobicContact CZ-CD1 3.89Å; F368-I372 HydrophobicContact CZ-CG1 3.73Å; F368-I372 WeakPolarHBondContact O-CG1 3.46Å; F368-I372 PolarHBondContact O-N 3.03Å; F368-F420 HydrophobicContact CE1-CD1 4.22Å; F368-F420 HydrophobicContact CE2-CD1 4.29Å; F368-F420 AromaticContact CE2-CE1 3.83Å; F368-F420 HydrophobicContact CE2-CE1 3.83Å; F368-F420 AromaticContact CZ-CD1 3.61Å; F368-F420 HydrophobicContact CZ-CD1 3.61Å; F368-F420 AromaticContact CZ-CE1 3.57Å; F368-F420 HydrophobicContact CZ-CE1 3.57Å; F368-F425 HydrophobicContact CE1-CE1 4.47Å; F368-F425 HydrophobicContact CZ-CE1 4.12Å; F368-F425 HydrophobicContact CZ-CZ 4.11Å
369T94.6Very high95.4Very high75 Ų7540.9 Ų40.946%0.4624%0.24SC..Hα-helixtrans-59.8-41.5175.7-60.70000112S365 F371 I372 N373S365-T369 WeakPolarHBondContact O-CB 3.42Å; S365-T369 PolarHBondContact O-N 3.36Å; S365-T369 PolarHBondContact O-OG1 3.02Å; T369-F371 VanDerWaalsContact C-N 3.35Å; T369-I372 PolarHBondContact O-N 2.92Å; T369-N373 WeakPolarHBondContact O-CB 3.48Å; T369-N373 PolarHBondContact O-N 3.24Å; T369-N373 PolarHBondContact O-ND2 3.28Å
370S96.1Very high95.5Very high56 Ų5641.4 Ų41.439%0.39224%0.244SC..Hα-helixtrans-65.4-38.5177.1-59.10000112.2E366 L367 F368 N373 C374E366-S370 WeakPolarHBondContact O-CB 3.48Å; E366-S370 PolarHBondContact O-N 3.22Å; E366-S370 PolarHBondContact O-OG 2.87Å; L367-S370 PolarHBondContact O-N 3.19Å; F368-S370 VanDerWaalsContact C-N 3.31Å; F368-S370 PolarHBondContact O-N 3.09Å; S370-N373 PolarHBondContact O-N 2.93Å; S370-C374 WeakPolarHBondContact O-CB 3.3Å; S370-C374 PolarHBondContact O-N 3.5Å
371F96.5Very high95.6Very high3 Ų342.9 Ų42.91%0.01325%0.254CS..Hα-helixtrans-63-48.9174.9179-114000112.1V324 L327 I348 L351 I352 L367 F368 T369 N373 C374 L375V324-F371 HydrophobicContact CG1-CB 3.8Å; V324-F371 HydrophobicContact CG1-CD2 3.9Å; V324-F371 HydrophobicContact CG1-CG 4.05Å; V324-F371 HydrophobicContact CG2-CD2 4.36Å; L327-F371 HydrophobicContact CD2-CE2 4.23Å; I348-F371 HydrophobicContact CG1-CE2 4.44Å; I348-F371 HydrophobicContact CG2-CE2 4.37Å; I348-F371 HydrophobicContact CG2-CZ 4.08Å; L351-F371 HydrophobicContact CB-CZ 4.34Å; L351-F371 HydrophobicContact CD1-CE2 4Å; L351-F371 HydrophobicContact CD1-CZ 4.28Å; I352-F371 HydrophobicContact CD1-CE1 4.14Å; I352-F371 HydrophobicContact CD1-CZ 4.12Å; I352-F371 HydrophobicContact CG1-CE1 4.01Å; I352-F371 HydrophobicContact CG1-CZ 4.09Å; L367-F371 WeakPolarHBondContact O-CB 3.39Å; L367-F371 PolarHBondContact O-N 2.91Å; F368-F371 WeakPolarHBondContact O-CB 3.25Å; F368-F371 PolarHBondContact O-N 3.49Å; T369-F371 VanDerWaalsContact C-N 3.35Å; F371-N373 VanDerWaalsContact C-N 3.35Å; F371-N373 PolarHBondContact O-N 2.8Å; F371-C374 WeakPolarHBondContact O-CB 3.39Å; F371-C374 PolarHBondContact O-N 3.15Å; F371-L375 PolarHBondContact O-N 2.79Å
372I96.1Very high95.9Very high6 Ų640 Ų403%0.03124%0.237CC..Hα-helixtrans-62.3-42.3177.4-64-55.1000111.2F368 T369 C374 L375 T376 W410 L413 F425 P428F368-I372 HydrophobicContact CD1-CG1 4.19Å; F368-I372 HydrophobicContact CE1-CD1 4.43Å; F368-I372 HydrophobicContact CE1-CG1 3.76Å; F368-I372 HydrophobicContact CE2-CD1 4.12Å; F368-I372 HydrophobicContact CE2-CG1 4.13Å; F368-I372 HydrophobicContact CZ-CD1 3.89Å; F368-I372 HydrophobicContact CZ-CG1 3.73Å; F368-I372 WeakPolarHBondContact O-CG1 3.46Å; F368-I372 PolarHBondContact O-N 3.03Å; T369-I372 PolarHBondContact O-N 2.92Å; I372-C374 VanDerWaalsContact C-N 3.33Å; I372-C374 PolarHBondContact O-N 3.29Å; I372-L375 PolarHBondContact O-N 3.09Å; I372-T376 PolarHBondContact O-N 3.15Å; I372-T376 PolarHBondContact O-OG1 2.91Å; I372-W410 HydrophobicContact CG2-CH2 3.92Å; I372-L413 HydrophobicContact CD1-CD1 3.9Å; I372-F425 HydrophobicContact CD1-CE1 3.97Å; I372-F425 HydrophobicContact CG1-CE1 4.28Å; I372-F425 HydrophobicContact CG2-CD1 4.46Å; I372-P428 HydrophobicContact CG2-CB 4.25Å; I372-P428 HydrophobicContact CG2-CG 3.79Å
373N96Very high96Very high79 Ų7937.5 Ų37.542%0.42222%0.217SC..Hα-helixtrans-61.5-41.3175.5-71.8-25.3000112T369 S370 F371 T376 L377T369-N373 WeakPolarHBondContact O-CB 3.48Å; T369-N373 PolarHBondContact O-N 3.24Å; T369-N373 PolarHBondContact O-ND2 3.28Å; S370-N373 PolarHBondContact O-N 2.93Å; F371-N373 VanDerWaalsContact C-N 3.35Å; F371-N373 PolarHBondContact O-N 2.8Å; N373-T376 PolarHBondContact O-N 3.42Å; N373-L377 WeakPolarHBondContact O-CB 3.47Å; N373-L377 VanDerWaalsContact O-CG 3.25Å; N373-L377 WeakPolarHBondContact O-CG 3.28Å; N373-L377 PolarHBondContact O-N 3.1Å
374C96.2Very high95.9Very high10 Ų1042.1 Ų42.17%0.06823%0.233CC..Hα-helixtrans-62.6-47.6175.2-173.80000111.1L328 S370 F371 I372 T376 L377 L378L328-C374 HydrophobicContact CD2-CB 3.45Å; L328-C374 VanDerWaalsContact CD2-CB 3.45Å; S370-C374 WeakPolarHBondContact O-CB 3.3Å; S370-C374 PolarHBondContact O-N 3.5Å; F371-C374 WeakPolarHBondContact O-CB 3.39Å; F371-C374 PolarHBondContact O-N 3.15Å; I372-C374 VanDerWaalsContact C-N 3.33Å; I372-C374 PolarHBondContact O-N 3.29Å; C374-T376 PolarHBondContact O-N 3.2Å; C374-L377 PolarHBondContact O-N 3.05Å; C374-L378 WeakPolarHBondContact O-CB 3.34Å; C374-L378 VanDerWaalsContact O-CG 3.27Å; C374-L378 WeakPolarHBondContact O-CG 3.49Å; C374-L378 PolarHBondContact O-N 3.48Å
375L97.4Very high95.8Very high1 Ų140.4 Ų40.41%0.00522%0.223CC..Hα-helixtrans-54.7-50.3175170.263.3000110.7I348 I352 F371 I372 L377 L378 T379 L406 W410 L413I348-L375 HydrophobicContact CG2-CD1 3.8Å; I352-L375 HydrophobicContact CD1-CD2 3.96Å; F371-L375 PolarHBondContact O-N 2.79Å; I372-L375 PolarHBondContact O-N 3.09Å; L375-L377 PolarHBondContact O-N 3.22Å; L375-L378 PolarHBondContact O-N 3.38Å; L375-T379 WeakPolarHBondContact O-CB 3.3Å; L375-T379 PolarHBondContact O-N 3.38Å; L375-T379 PolarHBondContact O-OG1 3.06Å; L375-L406 HydrophobicContact CD1-CB 4.3Å; L375-L406 HydrophobicContact CD1-CD2 3.81Å; L375-L406 HydrophobicContact CD1-CG 4.47Å; L375-W410 HydrophobicContact CB-CZ2 4.3Å; L375-W410 HydrophobicContact CD2-CD2 3.97Å; L375-W410 HydrophobicContact CD2-CE3 4.37Å; L375-W410 HydrophobicContact CD2-CH2 4.01Å; L375-W410 HydrophobicContact CD2-CZ2 3.58Å; L375-W410 HydrophobicContact CD2-CZ3 4.39Å; L375-W410 HydrophobicContact CG-CD2 4.42Å; L375-W410 HydrophobicContact CG-CH2 4.37Å; L375-W410 HydrophobicContact CG-CZ2 3.53Å; L375-L413 HydrophobicContact CD2-CD1 3.81Å
376T98Very high95.9Very high2 Ų236 Ų361%0.01219%0.192CC..Hα-helixtrans-57.1-47.6177.7-55.60000112.4I372 N373 C374 L378 T379 C380 W410 P428 Q431 V432I372-T376 PolarHBondContact O-N 3.15Å; I372-T376 PolarHBondContact O-OG1 2.91Å; N373-T376 PolarHBondContact O-N 3.42Å; C374-T376 PolarHBondContact O-N 3.2Å; T376-L378 VanDerWaalsContact C-N 3.34Å; T376-L378 PolarHBondContact O-N 3.45Å; T376-T379 PolarHBondContact O-N 3.23Å; T376-C380 PolarHBondContact O-N 3.29Å; T376-C380 PolarHBondContact O-SG 3.1Å; T376-W410 WeakPolarHBondContact OG1-CZ2 3.4Å; T376-P428 WeakPolarHBondContact OG1-CB 3.13Å; T376-Q431 HydrophobicContact CG2-CB 3.76Å; T376-V432 HydrophobicContact CG2-CG2 4.12Å
377L96.4Very high95.7Very high116 Ų11628.8 Ų28.861%0.60716%0.16SC*.Hα-helixtrans-61.1-44.6-179.3-74168.7000111.5N373 C374 L375 C380 S381N373-L377 WeakPolarHBondContact O-CB 3.47Å; N373-L377 VanDerWaalsContact O-CG 3.25Å; N373-L377 WeakPolarHBondContact O-CG 3.28Å; N373-L377 PolarHBondContact O-N 3.1Å; C374-L377 PolarHBondContact O-N 3.05Å; L375-L377 PolarHBondContact O-N 3.22Å; L377-C380 PolarHBondContact O-N 3.41Å; L377-S381 PolarHBondContact O-N 3Å; L377-S381 PolarHBondContact O-OG 3.24Å
378L96.8Very high95.3Very high10 Ų1031.3 Ų31.35%0.05217%0.173CC..Hα-helixtrans-68.3-43.5179.2-66.5176.2000112.4I331 I336 I344 I348 C374 L375 T376 C380 S381 F382 L406I331-L378 HydrophobicContact CD1-CD1 4.09Å; I331-L378 HydrophobicContact CG2-CD2 4.41Å; I336-L378 HydrophobicContact CD1-CD2 3.2Å; I344-L378 HydrophobicContact CG2-CD1 4.01Å; I348-L378 HydrophobicContact CD1-CD1 3.48Å; I348-L378 VanDerWaalsContact CD1-CD1 3.48Å; C374-L378 WeakPolarHBondContact O-CB 3.34Å; C374-L378 VanDerWaalsContact O-CG 3.27Å; C374-L378 WeakPolarHBondContact O-CG 3.49Å; C374-L378 PolarHBondContact O-N 3.48Å; L375-L378 PolarHBondContact O-N 3.38Å; T376-L378 VanDerWaalsContact C-N 3.34Å; T376-L378 PolarHBondContact O-N 3.45Å; L378-C380 VanDerWaalsContact C-N 3.31Å; L378-C380 PolarHBondContact O-N 3.43Å; L378-S381 WeakPolarHBondContact CA-OG 3.21Å; L378-S381 PolarHBondContact O-N 3.36Å; L378-S381 PolarHBondContact O-OG 2.85Å; L378-F382 HydrophobicContact CD2-CE1 4.37Å; L378-F382 HydrophobicContact CD2-CZ 4.24Å; L378-F382 VanDerWaalsContact O-CB 3.31Å; L378-F382 WeakPolarHBondContact O-CB 3.44Å; L378-F382 VanDerWaalsContact O-CG 3.31Å; L378-F382 WeakPolarHBondContact O-CG 3.34Å; L378-F382 PolarHBondContact O-N 3.4Å; L378-L406 HydrophobicContact CB-CD1 3.83Å
379T98.1Very high95.1Very high0 Ų030.4 Ų30.40%017%0.169CC..Hα-helixtrans-56.3-48.8175.2-58.20000110.2L375 T376 S381 G383 Y403 L407 W410 V432L375-T379 WeakPolarHBondContact O-CB 3.3Å; L375-T379 PolarHBondContact O-N 3.38Å; L375-T379 PolarHBondContact O-OG1 3.06Å; T376-T379 PolarHBondContact O-N 3.23Å; T379-S381 PolarHBondContact O-N 3.19Å; T379-G383 PolarHBondContact O-N 3.15Å; T379-Y403 HydrophobicContact CG2-CD2 4.2Å; T379-Y403 HydrophobicContact CG2-CE2 3.63Å; T379-Y403 WeakPolarHBondContact O-CD2 3.41Å; T379-Y403 WeakPolarHBondContact O-CE2 3.48Å; T379-L407 HydrophobicContact CG2-CD2 3.98Å; T379-W410 PolarHBondContact OG1-NE1 3.2Å; T379-V432 HydrophobicContact CG2-CB 4.46Å; T379-V432 HydrophobicContact CG2-CG1 3.66Å; T379-V432 HydrophobicContact CG2-CG2 3.98Å
380C97.5Very high94.7Very high12 Ų1229.9 Ų29.98%0.08116%0.162CC..Hα-helixtrans-67.8-36.9179.3-62.80000112.8T376 L377 L378 R384 S435T376-C380 PolarHBondContact O-N 3.29Å; T376-C380 PolarHBondContact O-SG 3.1Å; L377-C380 PolarHBondContact O-N 3.41Å; L378-C380 VanDerWaalsContact C-N 3.31Å; L378-C380 PolarHBondContact O-N 3.43Å; C380-R384 WeakPolarHBondContact O-CG 2.98Å; C380-R384 PolarHBondContact O-N 3.2Å; C380-R384 PolarHBondContact O-NH1 3.33Å; C380-R384 VanDerWaalsContact O-NH1 3.08Å; C380-S435 PolarHBondContact O-OG 3.31Å
381S95.1Very high94Very high36 Ų3628.6 Ų28.625%0.25215%0.151SC..Hα-helixtrans-69.4-46176.961.60000112.2L377 L378 T379 R384 S385L377-S381 PolarHBondContact O-N 3Å; L377-S381 PolarHBondContact O-OG 3.24Å; L378-S381 WeakPolarHBondContact CA-OG 3.21Å; L378-S381 PolarHBondContact O-N 3.36Å; L378-S381 PolarHBondContact O-OG 2.85Å; T379-S381 PolarHBondContact O-N 3.19Å; S381-R384 PolarHBondContact O-N 3.14Å; S381-S385 PolarHBondContact O-N 2.88Å; S381-S385 PolarHBondContact O-OG 3.1Å
382F96.8Very high93.4Very high2 Ų233.1 Ų33.11%0.00918%0.175CC..Hα-helixtrans-67.6-37.8-179.9-67.1-5.9000111.1I336 A341 L378 R384 S385 A386 Y399 A402 Y403 L406I336-F382 HydrophobicContact CD1-CE1 4.13Å; I336-F382 HydrophobicContact CD1-CZ 4.02Å; I336-F382 HydrophobicContact CG2-CE1 4.07Å; I336-F382 HydrophobicContact CG2-CZ 4.13Å; A341-F382 HydrophobicContact CB-CE1 4.15Å; A341-F382 HydrophobicContact CB-CE2 4.23Å; A341-F382 HydrophobicContact CB-CZ 3.9Å; L378-F382 HydrophobicContact CD2-CE1 4.37Å; L378-F382 HydrophobicContact CD2-CZ 4.24Å; L378-F382 VanDerWaalsContact O-CB 3.31Å; L378-F382 WeakPolarHBondContact O-CB 3.44Å; L378-F382 VanDerWaalsContact O-CG 3.31Å; L378-F382 WeakPolarHBondContact O-CG 3.34Å; L378-F382 PolarHBondContact O-N 3.4Å; F382-R384 VanDerWaalsContact C-N 3.33Å; F382-R384 PolarHBondContact O-N 3.18Å; F382-S385 CarbonylContact O-C 3.43Å; F382-S385 PolarHBondContact O-N 2.82Å; F382-A386 VanDerWaalsContact O-CB 3.29Å; F382-A386 WeakPolarHBondContact O-CB 3.12Å; F382-A386 PolarHBondContact O-N 3.31Å; F382-Y399 HydrophobicContact CB-CD1 4.28Å; F382-Y399 AromaticContact CD1-CD1 3.65Å; F382-Y399 HydrophobicContact CD1-CD1 3.65Å; F382-Y399 AromaticContact CD1-CE1 3.77Å; F382-Y399 HydrophobicContact CD1-CE1 3.77Å; F382-Y399 HydrophobicContact CE1-CD1 4.2Å; F382-Y399 AromaticContact CE1-CE1 3.95Å; F382-Y399 HydrophobicContact CE1-CE1 3.95Å; F382-Y399 HydrophobicContact CG-CD1 4.05Å; F382-A402 HydrophobicContact CD2-CB 3.73Å; F382-A402 HydrophobicContact CE2-CB 4.02Å; F382-A402 HydrophobicContact CG-CB 4.47Å; F382-Y403 HydrophobicContact CB-CD2 4.45Å; F382-L406 HydrophobicContact CD2-CD1 3.56Å; F382-L406 HydrophobicContact CD2-CG 4.44Å; F382-L406 HydrophobicContact CE2-CD1 4.02Å; F382-L406 HydrophobicContact CG-CD1 4.43Å
383G95.4Very high92.8Very high2 Ų237 Ų372%0.02120%0.196CC..Hα-helixtrans-62.3-37.5173.500000113.2T379 A387 Y403 C439T379-G383 PolarHBondContact O-N 3.15Å; G383-A387 PolarHBondContact O-N 3.44Å; G383-A387 VanDerWaalsContact O-N 3.12Å; G383-Y403 VanDerWaalsContact CA-CD2 3.43Å; G383-Y403 VanDerWaalsContact CA-CE2 3.48Å; G383-Y403 VanDerWaalsContact N-CD2 3.33Å; G383-C439 PolarHBondContact O-SG 3.33Å
384R94Very high92.2Very high108 Ų10836.6 Ų36.641%0.40819%0.19SC..Hα-helixtrans-69.3-39.6173.1-75-173.6-61.3-84.3-1.5112.2C380 S381 F382 L388 S435C380-R384 WeakPolarHBondContact O-CG 2.98Å; C380-R384 PolarHBondContact O-N 3.2Å; C380-R384 PolarHBondContact O-NH1 3.33Å; C380-R384 VanDerWaalsContact O-NH1 3.08Å; S381-R384 PolarHBondContact O-N 3.14Å; F382-R384 VanDerWaalsContact C-N 3.33Å; F382-R384 PolarHBondContact O-N 3.18Å; R384-L388 VanDerWaalsContact O-CG 3.28Å; R384-L388 WeakPolarHBondContact O-CG 3.18Å; R384-L388 PolarHBondContact O-N 2.99Å; R384-S435 PolarHBondContact NH1-OG 2.98Å
385S93.3Very high91.7Very high34 Ų3444.2 Ų44.224%0.23823%0.23CC..Hα-helixtrans-65.7-42.9175.7-63.70000111.5S381 F382 A387 L388 E389S381-S385 PolarHBondContact O-N 2.88Å; S381-S385 PolarHBondContact O-OG 3.1Å; F382-S385 CarbonylContact O-C 3.43Å; F382-S385 PolarHBondContact O-N 2.82Å; S385-A387 PolarHBondContact O-N 3.49Å; S385-L388 CarbonylContact O-C 3.55Å; S385-L388 WeakPolarHBondContact O-CA 3.01Å; S385-L388 WeakPolarHBondContact O-CB 3.25Å; S385-L388 PolarHBondContact O-N 3.41Å; S385-E389 WeakPolarHBondContact O-CG 3.03Å; S385-E389 PolarHBondContact O-N 3.4Å
386A93.8Very high91.2Very high1 Ų150.2 Ų50.21%0.00826%0.262CS..Hα-helixtrans-59.4-47.1177.500000111.7F382 L388 E389 E390 M400F382-A386 VanDerWaalsContact O-CB 3.29Å; F382-A386 WeakPolarHBondContact O-CB 3.12Å; F382-A386 PolarHBondContact O-N 3.31Å; A386-L388 PolarHBondContact O-N 3.11Å; A386-E389 WeakPolarHBondContact O-CA 3.22Å; A386-E389 WeakPolarHBondContact O-CB 3.39Å; A386-E389 PolarHBondContact O-N 2.71Å; A386-E390 PolarHBondContact O-N 3.21Å; A386-E390 VanDerWaalsContact O-N 3.09Å; A386-M400 HydrophobicContact CB-CB 4.35Å; A386-M400 HydrophobicContact CB-CE 4Å; A386-M400 HydrophobicContact CB-SD 4.11Å
387A90.4Very high90.8Very high10 Ų1053.2 Ų53.28%0.08328%0.277CS..Hα-helixtrans-60.8-30.4173.600000112.9G383 S385 V391 C439G383-A387 PolarHBondContact O-N 3.44Å; G383-A387 VanDerWaalsContact O-N 3.12Å; S385-A387 PolarHBondContact O-N 3.49Å; A387-V391 WeakPolarHBondContact O-CG2 3.4Å; A387-V391 PolarHBondContact O-N 3.41Å; A387-C439 HydrophobicContact CB-CB 3.89Å
388L88.7Confident90.7Very high73 Ų7349.6 Ų49.638%0.38226%0.26SS..Hα-helixtrans-74.9-29.7172.1-66.9168.1000112.4R384 S385 A386 L392 L451R384-L388 VanDerWaalsContact O-CG 3.28Å; R384-L388 WeakPolarHBondContact O-CG 3.18Å; R384-L388 PolarHBondContact O-N 2.99Å; S385-L388 CarbonylContact O-C 3.55Å; S385-L388 WeakPolarHBondContact O-CA 3.01Å; S385-L388 WeakPolarHBondContact O-CB 3.25Å; S385-L388 PolarHBondContact O-N 3.41Å; A386-L388 PolarHBondContact O-N 3.11Å; L388-L392 VanDerWaalsContact O-CB 3.25Å; L388-L392 WeakPolarHBondContact O-CB 3.21Å; L388-L392 WeakPolarHBondContact O-CD1 3.33Å; L388-L392 WeakPolarHBondContact O-CG 3.46Å; L388-L392 PolarHBondContact O-N 3.36Å; L388-L392 VanDerWaalsContact O-N 3.1Å; L388-L451 HydrophobicContact CD2-CD1 3.59Å; L388-L451 HydrophobicContact CD2-CG 4.17Å
389E90.1Very high90.7Very high2 Ų250 Ų501%0.00926%0.261CS..Hα-helixtrans-67.9-40.2175.9-62.4-163.4133.900111.7S385 A386 L392 D393 K394 M397 V398 Y399S385-E389 WeakPolarHBondContact O-CG 3.03Å; S385-E389 PolarHBondContact O-N 3.4Å; A386-E389 WeakPolarHBondContact O-CA 3.22Å; A386-E389 WeakPolarHBondContact O-CB 3.39Å; A386-E389 PolarHBondContact O-N 2.71Å; E389-L392 PolarHBondContact O-N 3.44Å; E389-D393 PolarHBondContact O-N 2.92Å; E389-D393 VanDerWaalsContact O-N 3.15Å; E389-K394 HydrophobicContact CB-CD 4.23Å; E389-K394 HydrophobicContact CB-CG 4.48Å; E389-K394 HydrophobicContact CG-CD 3.89Å; E389-K394 PolarHBondContact O-N 2.97Å; E389-K394 IonicContact OE1-NZ 3.87Å; E389-K394 PolarHBondContact OE1-NZ 3.31Å; E389-M397 HydrophobicContact CB-CE 3.77Å; E389-M397 HydrophobicContact CB-SD 3.68Å; E389-M397 VanDerWaalsContact OE2-C 3.26Å; E389-V398 PolarHBondContact OE2-N 2.66Å; E389-V398 VanDerWaalsContact OE2-N 3.09Å; E389-Y399 HydrophobicContact CG-CD2 4.28Å; E389-Y399 WeakPolarHBondContact OE1-CD2 3.47Å; E389-Y399 WeakPolarHBondContact OE2-CB 3.27Å; E389-Y399 PolarHBondContact OE2-N 3.09Å
390E85.7Confident90.5Very high65 Ų6551 Ų5130%0.30427%0.266SS..Hα-helixtrans-59.4-49.8174.2-70.5-177.5164.100110.7A386 L392 D393 M397 M400A386-E390 PolarHBondContact O-N 3.21Å; A386-E390 VanDerWaalsContact O-N 3.09Å; E390-L392 PolarHBondContact O-N 2.76Å; E390-D393 PolarHBondContact O-N 2.85Å; E390-D393 VanDerWaalsContact O-N 3.1Å; E390-D393 VanDerWaalsContact O-OD1 3.1Å; E390-M397 HydrophobicContact CB-CE 4.42Å; E390-M397 HydrophobicContact CG-CE 3.63Å; E390-M400 HydrophobicContact CG-CE 3.82Å; E390-M400 WeakPolarHBondContact OE1-CE 3.42Å
391V82.1Confident90.5Very high29 Ų2955.3 Ų55.318%0.17629%0.285CS..Hα-helixtrans-68.3-22.9-178.5179.20000113A387 R448 L451 E452A387-V391 WeakPolarHBondContact O-CG2 3.4Å; A387-V391 PolarHBondContact O-N 3.41Å; V391-R448 WeakPolarHBondContact CG2-O 3.29Å; V391-L451 HydrophobicContact CG1-CB 4.24Å; V391-E452 HydrophobicContact CG1-CG 4.39Å
392L83.9Confident90.5Very high98 Ų9853.6 Ų53.651%0.51327%0.273SS..THydrogen-bonded Turntrans-91.5-1.6178.2-71.8174.4000112.8L388 E389 E390 K394 L451L388-L392 VanDerWaalsContact O-CB 3.25Å; L388-L392 WeakPolarHBondContact O-CB 3.21Å; L388-L392 WeakPolarHBondContact O-CD1 3.33Å; L388-L392 WeakPolarHBondContact O-CG 3.46Å; L388-L392 PolarHBondContact O-N 3.36Å; L388-L392 VanDerWaalsContact O-N 3.1Å; E389-L392 PolarHBondContact O-N 3.44Å; E390-L392 PolarHBondContact O-N 2.76Å; L392-K394 VanDerWaalsContact C-N 3.26Å; L392-K394 HydrophobicContact CB-CG 4.17Å; L392-K394 PolarHBondContact O-N 3.36Å; L392-L451 HydrophobicContact CD2-CD1 4.09Å; L392-L451 HydrophobicContact CG-CD1 4.25Å
393D82.1Confident90.6Very high86 Ų8653.7 Ų53.746%0.4627%0.273SS..THydrogen-bonded Turntrans46.749.1-176.1-56.9-41000111.8E389 E390E389-D393 PolarHBondContact O-N 2.92Å; E389-D393 VanDerWaalsContact O-N 3.15Å; E390-D393 PolarHBondContact O-N 2.85Å; E390-D393 VanDerWaalsContact O-N 3.1Å; E390-D393 VanDerWaalsContact O-OD1 3.1Å
394K84.9Confident90.7Very high72 Ų7256.5 Ų56.531%0.31329%0.287SS..  trans-70.3135.2179.4-71.3-165.7-169.9173.70110.7D338 E389 L392 D396 M397D338-K394 IonicContact OD2-NZ 3.42Å; E389-K394 HydrophobicContact CB-CD 4.23Å; E389-K394 HydrophobicContact CB-CG 4.48Å; E389-K394 HydrophobicContact CG-CD 3.89Å; E389-K394 PolarHBondContact O-N 2.97Å; E389-K394 IonicContact OE1-NZ 3.87Å; E389-K394 PolarHBondContact OE1-NZ 3.31Å; L392-K394 VanDerWaalsContact C-N 3.26Å; L392-K394 HydrophobicContact CB-CG 4.17Å; L392-K394 PolarHBondContact O-N 3.36Å; K394-D396 VanDerWaalsContact C-N 3.29Å; K394-D396 PolarHBondContact O-N 2.83Å; K394-M397 HydrophobicContact CB-SD 4.26Å
395D84.3Confident90.7Very high169 Ų16954 Ų5490%0.90428%0.28SS*.SBendtrans-61.4-36.3172.5-75-36.4000112.6
396D87.1Confident91Very high127 Ų12752.4 Ų52.468%0.67927%0.268SS*.SBendtrans-109.5103.5-178.9-67.2-41.3000110.6K394 V398K394-D396 VanDerWaalsContact C-N 3.29Å; K394-D396 PolarHBondContact O-N 2.83Å; D396-V398 HydrophobicContact CB-CG2 4.31Å; D396-V398 PolarHBondContact O-N 3Å; D396-V398 VanDerWaalsContact O-N 3.15Å
397M90.2Very high91.2Very high65 Ų6552.4 Ų52.432%0.3227%0.268SS..  trans-87.965.3-175.9-61.4-65.9-75.100112.7E389 E390 K394 M400 E401E389-M397 HydrophobicContact CB-CE 3.77Å; E389-M397 HydrophobicContact CB-SD 3.68Å; E389-M397 VanDerWaalsContact OE2-C 3.26Å; E390-M397 HydrophobicContact CB-CE 4.42Å; E390-M397 HydrophobicContact CG-CE 3.63Å; K394-M397 HydrophobicContact CB-SD 4.26Å; M397-M400 HydrophobicContact CB-CB 4.04Å; M397-M400 HydrophobicContact CE-CB 4.38Å; M397-M400 HydrophobicContact CE-CE 4.38Å; M397-M400 PolarHBondContact O-N 2.95Å; M397-E401 PolarHBondContact O-N 3.38Å
398V94.5Very high91.4Very high41 Ų4155.8 Ų55.825%0.24828%0.282CS..Hα-helixtrans-69.3-40.5-170.6-176.80000113D338 A341 V342 E389 D396 A402D338-V398 VanDerWaalsContact O-CG1 3.24Å; D338-V398 WeakPolarHBondContact O-CG1 3.47Å; A341-V398 HydrophobicContact CB-CG1 4.46Å; V342-V398 HydrophobicContact CG2-CG1 3.71Å; V342-V398 VanDerWaalsContact CG2-O 3.29Å; V342-V398 WeakPolarHBondContact CG2-O 3.37Å; E389-V398 PolarHBondContact OE2-N 2.66Å; E389-V398 VanDerWaalsContact OE2-N 3.09Å; D396-V398 HydrophobicContact CB-CG2 4.31Å; D396-V398 PolarHBondContact O-N 3Å; D396-V398 VanDerWaalsContact O-N 3.15Å; V398-A402 PolarHBondContact O-N 3.19Å
399Y95.9Very high91.7Very high18 Ų1852.3 Ų52.37%0.07126%0.264CS..Hα-helixtrans-76.9-27179.4-71.7-79.7000112.3D338 A341 F382 E389 A402 Y403D338-Y399 HydrophobicContact CB-CE2 4.33Å; D338-Y399 WeakPolarHBondContact OD1-CE2 3.42Å; D338-Y399 VanDerWaalsContact OD1-CZ 3.31Å; D338-Y399 PolarHBondContact OD1-OH 3.46Å; A341-Y399 HydrophobicContact CB-CD1 3.83Å; A341-Y399 HydrophobicContact CB-CE1 3.66Å; F382-Y399 HydrophobicContact CB-CD1 4.28Å; F382-Y399 AromaticContact CD1-CD1 3.65Å; F382-Y399 HydrophobicContact CD1-CD1 3.65Å; F382-Y399 AromaticContact CD1-CE1 3.77Å; F382-Y399 HydrophobicContact CD1-CE1 3.77Å; F382-Y399 HydrophobicContact CE1-CD1 4.2Å; F382-Y399 AromaticContact CE1-CE1 3.95Å; F382-Y399 HydrophobicContact CE1-CE1 3.95Å; F382-Y399 HydrophobicContact CG-CD1 4.05Å; E389-Y399 HydrophobicContact CG-CD2 4.28Å; E389-Y399 WeakPolarHBondContact OE1-CD2 3.47Å; E389-Y399 WeakPolarHBondContact OE2-CB 3.27Å; E389-Y399 PolarHBondContact OE2-N 3.09Å; Y399-A402 PolarHBondContact O-N 3.44Å; Y399-Y403 WeakPolarHBondContact O-CB 3.19Å; Y399-Y403 PolarHBondContact O-N 2.8Å
400M95.6Very high92.1Very high21 Ų2152.2 Ų52.210%0.10326%0.264CS..Hα-helixtrans-61.4-51.8173.4-170.16076.700110.5A386 E390 M397 A402 Y403 D404 F477 Q480A386-M400 HydrophobicContact CB-CB 4.35Å; A386-M400 HydrophobicContact CB-CE 4Å; A386-M400 HydrophobicContact CB-SD 4.11Å; E390-M400 HydrophobicContact CG-CE 3.82Å; E390-M400 WeakPolarHBondContact OE1-CE 3.42Å; M397-M400 HydrophobicContact CB-CB 4.04Å; M397-M400 HydrophobicContact CE-CB 4.38Å; M397-M400 HydrophobicContact CE-CE 4.38Å; M397-M400 PolarHBondContact O-N 2.95Å; M400-A402 VanDerWaalsContact C-N 3.3Å; M400-A402 PolarHBondContact O-N 3.49Å; M400-Y403 WeakPolarHBondContact O-CB 3.27Å; M400-Y403 PolarHBondContact O-N 2.94Å; M400-Y403 VanDerWaalsContact O-N 3.1Å; M400-D404 PolarHBondContact O-N 3.31Å; M400-F477 HydrophobicContact CE-CE1 4.32Å; M400-F477 HydrophobicContact SD-CE1 4.1Å; M400-Q480 PolarHBondContact SD-NE2 2.86Å; M400-Q480 VanDerWaalsContact SD-NE2 3.43Å
401E95.6Very high92.4Very high102 Ų10250.2 Ų50.248%0.47726%0.255SS..Hα-helixtrans-58.2-43.1175.7-176.1-174.3173.800111.7V342 M397 Y403 K405V342-E401 HydrophobicContact CG2-CB 4.2Å; V342-E401 HydrophobicContact CG2-CG 4.28Å; M397-E401 PolarHBondContact O-N 3.38Å; E401-Y403 VanDerWaalsContact C-N 3.33Å; E401-Y403 PolarHBondContact O-N 3.15Å; E401-K405 WeakPolarHBondContact O-CG 3.34Å; E401-K405 PolarHBondContact O-N 2.85Å
402A96.9Very high92.9Very high0 Ų051.2 Ų51.20%026%0.261CS..Hα-helixtrans-65.6-37.7178.600000112.3A341 V342 S345 F382 V398 Y399 M400 L406A341-A402 HydrophobicContact CB-CB 4.02Å; V342-A402 HydrophobicContact CG2-CB 4.15Å; S345-A402 WeakPolarHBondContact CB-O 3.36Å; S345-A402 WeakPolarHBondContact OG-CA 3.13Å; F382-A402 HydrophobicContact CD2-CB 3.73Å; F382-A402 HydrophobicContact CE2-CB 4.02Å; F382-A402 HydrophobicContact CG-CB 4.47Å; V398-A402 PolarHBondContact O-N 3.19Å; Y399-A402 PolarHBondContact O-N 3.44Å; M400-A402 VanDerWaalsContact C-N 3.3Å; M400-A402 PolarHBondContact O-N 3.49Å; A402-L406 WeakPolarHBondContact O-CG 3.45Å; A402-L406 PolarHBondContact O-N 2.92Å
403Y97.8Very high93.3Very high5 Ų546.7 Ų46.72%0.0224%0.238CC..Hα-helixtrans-67.9-45.2178.8-175.7-124.8000111.7T379 F382 G383 Y399 M400 E401 K405 L406 L407 Y436T379-Y403 HydrophobicContact CG2-CD2 4.2Å; T379-Y403 HydrophobicContact CG2-CE2 3.63Å; T379-Y403 WeakPolarHBondContact O-CD2 3.41Å; T379-Y403 WeakPolarHBondContact O-CE2 3.48Å; F382-Y403 HydrophobicContact CB-CD2 4.45Å; G383-Y403 VanDerWaalsContact CA-CD2 3.43Å; G383-Y403 VanDerWaalsContact CA-CE2 3.48Å; G383-Y403 VanDerWaalsContact N-CD2 3.33Å; Y399-Y403 WeakPolarHBondContact O-CB 3.19Å; Y399-Y403 PolarHBondContact O-N 2.8Å; M400-Y403 WeakPolarHBondContact O-CB 3.27Å; M400-Y403 PolarHBondContact O-N 2.94Å; M400-Y403 VanDerWaalsContact O-N 3.1Å; E401-Y403 VanDerWaalsContact C-N 3.33Å; E401-Y403 PolarHBondContact O-N 3.15Å; Y403-K405 VanDerWaalsContact C-N 3.3Å; Y403-K405 PolarHBondContact O-N 3.08Å; Y403-L406 PolarHBondContact O-N 3.36Å; Y403-L406 VanDerWaalsContact O-N 3.08Å; Y403-L407 HydrophobicContact CD1-CD1 3.97Å; Y403-L407 HydrophobicContact CD2-CG 4.44Å; Y403-L407 HydrophobicContact CE1-CD1 3.46Å; Y403-L407 VanDerWaalsContact CE1-CD1 3.46Å; Y403-L407 HydrophobicContact CE1-CG 4.24Å; Y403-L407 HydrophobicContact CE2-CD1 4.16Å; Y403-L407 HydrophobicContact CE2-CD2 4.32Å; Y403-L407 HydrophobicContact CE2-CG 4.07Å; Y403-L407 PolarHBondContact O-N 2.62Å; Y403-Y436 HydrophobicContact CE1-CD2 4.1Å; Y403-Y436 HydrophobicContact CE1-CE2 4.32Å; Y403-Y436 VanDerWaalsContact OH-CD2 3.26Å; Y403-Y436 WeakPolarHBondContact OH-CD2 3.41Å
404D96.8Very high93.7Very high60 Ų6042.9 Ų42.932%0.32122%0.217SC..Hα-helixtrans-51.5-50.3173-78.1-35.6000111.4M400 L406 L407 E408 Q480M400-D404 PolarHBondContact O-N 3.31Å; D404-L406 VanDerWaalsContact C-N 3.29Å; D404-L406 PolarHBondContact O-N 2.72Å; D404-L407 PolarHBondContact O-N 3.11Å; D404-L407 VanDerWaalsContact O-N 3.15Å; D404-E408 WeakPolarHBondContact O-CB 3.16Å; D404-E408 PolarHBondContact O-N 3.18Å; D404-Q480 WeakPolarHBondContact OD1-CG 3.33Å; D404-Q480 PolarHBondContact OD1-NE2 3.49Å
405K95.9Very high93.7Very high56 Ų5645.4 Ų45.424%0.24323%0.23CC..Hα-helixtrans-60.7-37.1179.1-73.2-60.6179-148.80113.6E401 Y403 E408 S409E401-K405 WeakPolarHBondContact O-CG 3.34Å; E401-K405 PolarHBondContact O-N 2.85Å; Y403-K405 VanDerWaalsContact C-N 3.3Å; Y403-K405 PolarHBondContact O-N 3.08Å; K405-E408 IonicContact NZ-OE2 2.72Å; K405-E408 PolarHBondContact NZ-OE2 2.88Å; K405-S409 WeakPolarHBondContact O-CB 3.04Å; K405-S409 PolarHBondContact O-N 3.28Å; K405-S409 VanDerWaalsContact O-N 3.15Å; K405-S409 PolarHBondContact O-OG 3.19Å
406L98.1Very high93.3Very high0 Ų038.7 Ų38.70%019%0.194CC..Hα-helixtrans-72.9-37.4176.8-64.9-174.6000111.9I348 L375 L378 F382 A402 Y403 D404 S409 W410I348-L406 HydrophobicContact CB-CD2 4.09Å; I348-L406 HydrophobicContact CD1-CD2 4.18Å; I348-L406 HydrophobicContact CG2-CD2 3.93Å; L375-L406 HydrophobicContact CD1-CB 4.3Å; L375-L406 HydrophobicContact CD1-CD2 3.81Å; L375-L406 HydrophobicContact CD1-CG 4.47Å; L378-L406 HydrophobicContact CB-CD1 3.83Å; F382-L406 HydrophobicContact CD2-CD1 3.56Å; F382-L406 HydrophobicContact CD2-CG 4.44Å; F382-L406 HydrophobicContact CE2-CD1 4.02Å; F382-L406 HydrophobicContact CG-CD1 4.43Å; A402-L406 WeakPolarHBondContact O-CG 3.45Å; A402-L406 PolarHBondContact O-N 2.92Å; Y403-L406 PolarHBondContact O-N 3.36Å; Y403-L406 VanDerWaalsContact O-N 3.08Å; D404-L406 VanDerWaalsContact C-N 3.29Å; D404-L406 PolarHBondContact O-N 2.72Å; L406-S409 WeakPolarHBondContact O-CB 3.47Å; L406-S409 PolarHBondContact O-N 3.37Å; L406-W410 PolarHBondContact O-N 2.66Å
407L97.9Very high93Very high1 Ų134.7 Ų34.71%0.00517%0.172CC..Hα-helixtrans-67.7-40.6175-73.1-177.7000112.2T379 Y403 D404 S409 W410 L411 V432 Y436 Q480 S483 I484T379-L407 HydrophobicContact CG2-CD2 3.98Å; Y403-L407 HydrophobicContact CD1-CD1 3.97Å; Y403-L407 HydrophobicContact CD2-CG 4.44Å; Y403-L407 HydrophobicContact CE1-CD1 3.46Å; Y403-L407 VanDerWaalsContact CE1-CD1 3.46Å; Y403-L407 HydrophobicContact CE1-CG 4.24Å; Y403-L407 HydrophobicContact CE2-CD1 4.16Å; Y403-L407 HydrophobicContact CE2-CD2 4.32Å; Y403-L407 HydrophobicContact CE2-CG 4.07Å; Y403-L407 PolarHBondContact O-N 2.62Å; D404-L407 PolarHBondContact O-N 3.11Å; D404-L407 VanDerWaalsContact O-N 3.15Å; L407-S409 PolarHBondContact O-N 3.43Å; L407-W410 WeakPolarHBondContact O-CB 3.44Å; L407-W410 PolarHBondContact O-N 3.28Å; L407-W410 VanDerWaalsContact O-N 3.13Å; L407-L411 PolarHBondContact O-N 3.14Å; L407-V432 HydrophobicContact CD2-CG1 3.97Å; L407-Y436 HydrophobicContact CD1-CD2 4.45Å; L407-Y436 HydrophobicContact CD1-CE2 4.44Å; L407-Q480 HydrophobicContact CD1-CB 3.75Å; L407-Q480 HydrophobicContact CD1-CG 3.79Å; L407-S483 WeakPolarHBondContact O-CB 3.22Å; L407-S483 PolarHBondContact O-OG 3.48Å; L407-I484 HydrophobicContact CD1-CD1 4.47Å; L407-I484 HydrophobicContact CD1-CG1 4.32Å; L407-I484 HydrophobicContact CD2-CD1 3.73Å; L407-I484 HydrophobicContact CD2-CG1 4.27Å
408E95.6Very high92.5Very high81 Ų8140.5 Ų40.538%0.37920%0.198SC..Hα-helixtrans-56.2-41171.4-173.2-173.7171.800110.8D404 K405 L411 T412D404-E408 WeakPolarHBondContact O-CB 3.16Å; D404-E408 PolarHBondContact O-N 3.18Å; K405-E408 IonicContact NZ-OE2 2.72Å; K405-E408 PolarHBondContact NZ-OE2 2.88Å; E408-L411 PolarHBondContact O-N 3.38Å; E408-T412 PolarHBondContact O-N 3.11Å; E408-T412 VanDerWaalsContact O-N 3.11Å; E408-T412 PolarHBondContact O-OG1 3.35Å
409S95.4Very high92Very high0 Ų044.1 Ų44.10%021%0.212CC..Hα-helixtrans-67.1-39.1177.1-540000112.6S349 K405 L406 L407 T412 L413S349-S409 WeakPolarHBondContact CA-OG 2.76Å; S349-S409 VanDerWaalsContact CB-OG 3.27Å; S349-S409 WeakPolarHBondContact CB-OG 3.29Å; S349-S409 PolarHBondContact OG-OG 3.11Å; K405-S409 WeakPolarHBondContact O-CB 3.04Å; K405-S409 PolarHBondContact O-N 3.28Å; K405-S409 VanDerWaalsContact O-N 3.15Å; K405-S409 PolarHBondContact O-OG 3.19Å; L406-S409 WeakPolarHBondContact O-CB 3.47Å; L406-S409 PolarHBondContact O-N 3.37Å; L407-S409 PolarHBondContact O-N 3.43Å; S409-T412 PolarHBondContact O-N 3.16Å; S409-L413 PolarHBondContact O-N 2.95Å; S409-L413 VanDerWaalsContact O-N 3.1Å
410W96.8Very high91.6Very high0 Ų043.9 Ų43.90%021%0.211CC..Hα-helixtrans-62-45.3173.9-85.6111.2000112.2I372 L375 T376 T379 L406 L407 T412 L413 V414 F425 P428 V432 L487I372-W410 HydrophobicContact CG2-CH2 3.92Å; L375-W410 HydrophobicContact CB-CZ2 4.3Å; L375-W410 HydrophobicContact CD2-CD2 3.97Å; L375-W410 HydrophobicContact CD2-CE3 4.37Å; L375-W410 HydrophobicContact CD2-CH2 4.01Å; L375-W410 HydrophobicContact CD2-CZ2 3.58Å; L375-W410 HydrophobicContact CD2-CZ3 4.39Å; L375-W410 HydrophobicContact CG-CD2 4.42Å; L375-W410 HydrophobicContact CG-CH2 4.37Å; L375-W410 HydrophobicContact CG-CZ2 3.53Å; T376-W410 WeakPolarHBondContact OG1-CZ2 3.4Å; T379-W410 PolarHBondContact OG1-NE1 3.2Å; L406-W410 PolarHBondContact O-N 2.66Å; L407-W410 WeakPolarHBondContact O-CB 3.44Å; L407-W410 PolarHBondContact O-N 3.28Å; L407-W410 VanDerWaalsContact O-N 3.13Å; W410-T412 VanDerWaalsContact C-N 3.29Å; W410-T412 PolarHBondContact O-N 3.21Å; W410-L413 PolarHBondContact O-N 3.42Å; W410-V414 HydrophobicContact CE3-CG2 4.31Å; W410-V414 WeakPolarHBondContact O-CB 3.37Å; W410-V414 WeakPolarHBondContact O-CG2 3.2Å; W410-V414 PolarHBondContact O-N 2.91Å; W410-F425 HydrophobicContact CZ3-CD1 4.16Å; W410-P428 HydrophobicContact CH2-CB 3.52Å; W410-P428 HydrophobicContact CZ2-CB 4.34Å; W410-P428 HydrophobicContact CZ3-CB 4.1Å; W410-V432 HydrophobicContact CZ2-CG2 4.15Å; W410-L487 HydrophobicContact CB-CD1 4.07Å; W410-L487 HydrophobicContact CB-CD2 4.42Å; W410-L487 HydrophobicContact CD2-CD2 4.21Å; W410-L487 HydrophobicContact CE3-CD2 3.81Å; W410-L487 HydrophobicContact CG-CD1 4.18Å; W410-L487 HydrophobicContact CG-CD2 4.49Å; W410-L487 HydrophobicContact CZ3-CD2 4.49Å
411L93.8Very high91.1Very high24 Ų2447.1 Ų47.113%0.12623%0.234CC..Hα-helixtrans-57.9-45.7177.9-177.859.5000110.6L407 E408 L413 V414 Q415 T486L407-L411 PolarHBondContact O-N 3.14Å; E408-L411 PolarHBondContact O-N 3.38Å; L411-L413 VanDerWaalsContact C-N 3.35Å; L411-L413 PolarHBondContact O-N 3.44Å; L411-V414 PolarHBondContact O-N 3.34Å; L411-Q415 HydrophobicContact CD1-CG 4Å; L411-Q415 HydrophobicContact CG-CG 4.41Å; L411-Q415 WeakPolarHBondContact O-CB 3.39Å; L411-Q415 VanDerWaalsContact O-CG 3.3Å; L411-Q415 WeakPolarHBondContact O-CG 3.26Å; L411-Q415 PolarHBondContact O-N 3.27Å; L411-T486 HydrophobicContact CD1-CG2 4.1Å; L411-T486 VanDerWaalsContact CD1-OG1 3.3Å; L411-T486 WeakPolarHBondContact CD1-OG1 3.42Å
412T92.4Very high90.6Very high49 Ų4954.1 Ų54.130%0.30126%0.256SS..Hα-helixtrans-61.1-38.3177.5-56.10000113I352 T353 E408 S409 W410I352-T412 HydrophobicContact CG2-CG2 4.08Å; T353-T412 HydrophobicContact CG2-CG2 4.4Å; E408-T412 PolarHBondContact O-N 3.11Å; E408-T412 VanDerWaalsContact O-N 3.11Å; E408-T412 PolarHBondContact O-OG1 3.35Å; S409-T412 PolarHBondContact O-N 3.16Å; W410-T412 VanDerWaalsContact C-N 3.29Å; W410-T412 PolarHBondContact O-N 3.21Å
413L92.1Very high90.1Very high4 Ų456 Ų562%0.02128%0.275CS..Hα-helixtrans-71.1-40.6178.2-78.1174.6000112.5I352 L360 I372 L375 S409 W410 L411 F420I352-L413 HydrophobicContact CD1-CD1 3.75Å; I352-L413 HydrophobicContact CD1-CG 4.22Å; I352-L413 HydrophobicContact CG1-CD1 4.21Å; I352-L413 HydrophobicContact CG1-CD2 4.33Å; I352-L413 HydrophobicContact CG1-CG 4.3Å; I352-L413 HydrophobicContact CG2-CD1 4.42Å; I352-L413 HydrophobicContact CG2-CD2 3.9Å; I352-L413 HydrophobicContact CG2-CG 3.68Å; L360-L413 HydrophobicContact CD1-CD2 4.31Å; I372-L413 HydrophobicContact CD1-CD1 3.9Å; L375-L413 HydrophobicContact CD2-CD1 3.81Å; S409-L413 PolarHBondContact O-N 2.95Å; S409-L413 VanDerWaalsContact O-N 3.1Å; W410-L413 PolarHBondContact O-N 3.42Å; L411-L413 VanDerWaalsContact C-N 3.35Å; L411-L413 PolarHBondContact O-N 3.44Å; L413-F420 HydrophobicContact CD2-CZ 4.09Å
414V90.3Very high89.7Confident5 Ų557.7 Ų57.73%0.0329%0.287CS..Hα-helixtrans-83.5-32.4-168.3171.50000112.7W410 L411 D416 E417 T486 L487 V490W410-V414 HydrophobicContact CE3-CG2 4.31Å; W410-V414 WeakPolarHBondContact O-CB 3.37Å; W410-V414 WeakPolarHBondContact O-CG2 3.2Å; W410-V414 PolarHBondContact O-N 2.91Å; L411-V414 PolarHBondContact O-N 3.34Å; V414-D416 PolarHBondContact O-N 3.39Å; V414-E417 WeakPolarHBondContact O-CB 3.49Å; V414-E417 PolarHBondContact O-N 3.29Å; V414-T486 HydrophobicContact CB-CG2 4.26Å; V414-T486 HydrophobicContact CG1-CG2 3.58Å; V414-L487 HydrophobicContact CG2-CD2 3.82Å; V414-V490 HydrophobicContact CB-CG2 4.47Å; V414-V490 HydrophobicContact CG1-CG2 3.16Å
415Q84.4Confident89.7Confident126 Ų12654.9 Ų54.959%0.58927%0.272SS*.THydrogen-bonded Turntrans-54.4-17.1176.2-80.1178.3-12.600113.5L411L411-Q415 HydrophobicContact CD1-CG 4Å; L411-Q415 HydrophobicContact CG-CG 4.41Å; L411-Q415 WeakPolarHBondContact O-CB 3.39Å; L411-Q415 VanDerWaalsContact O-CG 3.3Å; L411-Q415 WeakPolarHBondContact O-CG 3.26Å; L411-Q415 PolarHBondContact O-N 3.27Å
416D76.4Confident89.6Confident28 Ų2854.3 Ų54.315%0.1527%0.273CS..THydrogen-bonded Turntrans-12530.2180-54-78.4000113.7R357 V414 E418 H419R357-D416 IonicContact CZ-OD1 3.02Å; R357-D416 IonicContact CZ-OD2 3.39Å; R357-D416 VanDerWaalsContact NE-CG 3.26Å; R357-D416 IonicContact NE-OD1 3.69Å; R357-D416 IonicContact NE-OD2 2.92Å; R357-D416 PolarHBondContact NE-OD2 3.26Å; R357-D416 IonicContact NH1-OD1 3.62Å; R357-D416 PolarHBondContact NH1-OD1 3Å; R357-D416 IonicContact NH1-OD2 2.91Å; R357-D416 PolarHBondContact NH1-OD2 2.92Å; R357-D416 IonicContact NH2-OD1 2.86Å; R357-D416 PolarHBondContact NH2-OD1 3.22Å; R357-D416 IonicContact NH2-OD2 3.45Å; R357-D416 PolarHBondContact NH2-OD2 3.18Å; V414-D416 PolarHBondContact O-N 3.39Å; D416-E418 PolarHBondContact O-N 3.12Å; D416-H419 PolarHBondContact O-N 2.92Å; D416-H419 VanDerWaalsContact O-N 3.1Å; D416-H419 PolarHBondContact O-ND1 3.1Å
417E80.5Confident89.6Confident43 Ų4360.3 Ų60.320%0.20130%0.301CS..G310 helixtrans-49.1-32.3-177.8178.5173.7-174.600113.2V414 H419 F420 F425 V490V414-E417 WeakPolarHBondContact O-CB 3.49Å; V414-E417 PolarHBondContact O-N 3.29Å; E417-H419 PolarHBondContact O-N 3.47Å; E417-F420 PolarHBondContact O-N 3.38Å; E417-F425 HydrophobicContact CB-CD2 4.43Å; E417-F425 HydrophobicContact CG-CD2 4.03Å; E417-F425 HydrophobicContact CG-CE2 4.48Å; E417-V490 WeakPolarHBondContact OE2-CG1 3.44Å; E417-V490 WeakPolarHBondContact OE2-CG2 3.49Å
418E80.3Confident89.6Confident187 Ų18760.7 Ų60.787%0.87430%0.304SS*.G310 helixtrans-52.9-27.2-179.7-61.2-168.8160.900114.4D416D416-E418 PolarHBondContact O-N 3.12Å
419H83.1Confident89.7Confident116 Ų11656.8 Ų56.854%0.53729%0.286SS..G310 helixtrans-86.2-13.6-178.9-61.184.6000113.3D416 E417D416-H419 PolarHBondContact O-N 2.92Å; D416-H419 VanDerWaalsContact O-N 3.1Å; D416-H419 PolarHBondContact O-ND1 3.1Å; E417-H419 PolarHBondContact O-N 3.47Å
420F87.8Confident89.8Confident13 Ų1358 Ų586%0.05729%0.292CS..SBendtrans-96.6164179.9-67.5-86.2000111.3L360 T361 F368 L413 E417 R422 F425L360-F420 HydrophobicContact CB-CE1 4.43Å; T361-F420 HydrophobicContact CG2-CD1 3.6Å; T361-F420 HydrophobicContact CG2-CE1 3.61Å; T361-F420 HydrophobicContact CG2-CG 4.21Å; T361-F420 HydrophobicContact CG2-CZ 4.25Å; F368-F420 HydrophobicContact CE1-CD1 4.22Å; F368-F420 HydrophobicContact CE2-CD1 4.29Å; F368-F420 AromaticContact CE2-CE1 3.83Å; F368-F420 HydrophobicContact CE2-CE1 3.83Å; F368-F420 AromaticContact CZ-CD1 3.61Å; F368-F420 HydrophobicContact CZ-CD1 3.61Å; F368-F420 AromaticContact CZ-CE1 3.57Å; F368-F420 HydrophobicContact CZ-CE1 3.57Å; L413-F420 HydrophobicContact CD2-CZ 4.09Å; E417-F420 PolarHBondContact O-N 3.38Å; F420-R422 PolarHBondContact O-N 3.45Å; F420-R422 VanDerWaalsContact O-N 3.16Å; F420-F425 HydrophobicContact CB-CE2 3.75Å; F420-F425 HydrophobicContact CB-CZ 4.1Å; F420-F425 HydrophobicContact CD1-CE2 4.27Å; F420-F425 AromaticContact CD1-CZ 3.82Å; F420-F425 HydrophobicContact CD1-CZ 3.82Å; F420-F425 AromaticContact CD2-CE2 3.66Å; F420-F425 HydrophobicContact CD2-CE2 3.66Å; F420-F425 AromaticContact CD2-CZ 3.9Å; F420-F425 HydrophobicContact CD2-CZ 3.9Å; F420-F425 HydrophobicContact CE1-CZ 4.18Å; F420-F425 HydrophobicContact CE2-CE2 4.29Å; F420-F425 HydrophobicContact CE2-CZ 4.23Å; F420-F425 AromaticContact CG-CE2 3.63Å; F420-F425 HydrophobicContact CG-CE2 3.63Å; F420-F425 AromaticContact CG-CZ 3.67Å; F420-F425 HydrophobicContact CG-CZ 3.67Å; F420-F425 HydrophobicContact CZ-CZ 4.37Å
421P85.6Confident89.9Confident89 Ų8962.2 Ų62.258%0.57831%0.312SS*.SBendtrans-56.6122.7174.1-23.934.5000111.1G423 C424P421-G423 PolarHBondContact O-N 3.35Å; P421-C424 HydrophobicContact CB-CB 4.4Å; P421-C424 WeakPolarHBondContact O-CB 3.29Å; P421-C424 PolarHBondContact O-N 3.04Å; P421-C424 PolarHBondContact O-SG 3.4Å
422R84.7Confident90.1Very high249 Ų24961.1 Ų61.194%0.9431%0.306SS*.THydrogen-bonded Turntrans-45.6125.5-175.3-71.8-174.2176.9-166.5-5112.6F420 C424F420-R422 PolarHBondContact O-N 3.45Å; F420-R422 VanDerWaalsContact O-N 3.16Å; R422-C424 VanDerWaalsContact C-N 3.3Å; R422-C424 PolarHBondContact O-N 3.07Å
423G86Confident90.4Very high39 Ų3958.8 Ų58.840%0.40229%0.292SS..THydrogen-bonded Turntrans75.410.4175.800000115.1P421 F425 V426P421-G423 PolarHBondContact O-N 3.35Å; G423-F425 PolarHBondContact O-N 3.2Å; G423-V426 PolarHBondContact O-N 2.89Å
424C90.6Very high90.7Very high41 Ų4160.6 Ų60.628%0.27730%0.301SS..THydrogen-bonded Turntrans-63.6-25.2178.964.40000113.3P421 R422P421-C424 HydrophobicContact CB-CB 4.4Å; P421-C424 WeakPolarHBondContact O-CB 3.29Å; P421-C424 PolarHBondContact O-N 3.04Å; P421-C424 PolarHBondContact O-SG 3.4Å; R422-C424 VanDerWaalsContact C-N 3.3Å; R422-C424 PolarHBondContact O-N 3.07Å
425F95.2Very high91.1Very high1 Ų160.5 Ų60.50%0.00430%0.301CS..THydrogen-bonded Turntrans-95.2-8.9-179.2-56.9-55.8000114.2F368 I372 W410 E417 F420 G423 Q427 P428 A429 V490F368-F425 HydrophobicContact CE1-CE1 4.47Å; F368-F425 HydrophobicContact CZ-CE1 4.12Å; F368-F425 HydrophobicContact CZ-CZ 4.11Å; I372-F425 HydrophobicContact CD1-CE1 3.97Å; I372-F425 HydrophobicContact CG1-CE1 4.28Å; I372-F425 HydrophobicContact CG2-CD1 4.46Å; W410-F425 HydrophobicContact CZ3-CD1 4.16Å; E417-F425 HydrophobicContact CB-CD2 4.43Å; E417-F425 HydrophobicContact CG-CD2 4.03Å; E417-F425 HydrophobicContact CG-CE2 4.48Å; F420-F425 HydrophobicContact CB-CE2 3.75Å; F420-F425 HydrophobicContact CB-CZ 4.1Å; F420-F425 HydrophobicContact CD1-CE2 4.27Å; F420-F425 AromaticContact CD1-CZ 3.82Å; F420-F425 HydrophobicContact CD1-CZ 3.82Å; F420-F425 AromaticContact CD2-CE2 3.66Å; F420-F425 HydrophobicContact CD2-CE2 3.66Å; F420-F425 AromaticContact CD2-CZ 3.9Å; F420-F425 HydrophobicContact CD2-CZ 3.9Å; F420-F425 HydrophobicContact CE1-CZ 4.18Å; F420-F425 HydrophobicContact CE2-CE2 4.29Å; F420-F425 HydrophobicContact CE2-CZ 4.23Å; F420-F425 AromaticContact CG-CE2 3.63Å; F420-F425 HydrophobicContact CG-CE2 3.63Å; F420-F425 AromaticContact CG-CZ 3.67Å; F420-F425 HydrophobicContact CG-CZ 3.67Å; F420-F425 HydrophobicContact CZ-CZ 4.37Å; G423-F425 PolarHBondContact O-N 3.2Å; F425-Q427 PolarHBondContact O-N 3.29Å; F425-P428 WeakPolarHBondContact O-CD 3.33Å; F425-A429 WeakPolarHBondContact O-CB 3.46Å; F425-A429 PolarHBondContact O-N 3.47Å; F425-V490 HydrophobicContact CB-CG1 4.3Å
426V95.5Very high91.8Very high45 Ų4554.6 Ų54.627%0.27327%0.273SS..Hα-helixtrans-59.2-50.3-174.2174.60000112.5G423 A429 I430 V490G423-V426 PolarHBondContact O-N 2.89Å; V426-A429 PolarHBondContact O-N 3.15Å; V426-I430 HydrophobicContact CG1-CD1 4.07Å; V426-I430 VanDerWaalsContact O-CG1 3.26Å; V426-I430 WeakPolarHBondContact O-CG1 3.3Å; V426-I430 PolarHBondContact O-N 2.98Å; V426-V490 HydrophobicContact CG2-CG1 4.08Å
427Q97.2Very high92.8Very high126 Ų12653.8 Ų53.859%0.58927%0.269SS*.Hα-helixtrans-68.2-44.2179.4-70.9-63.5-46.500113.1F425 I430 Q431F425-Q427 PolarHBondContact O-N 3.29Å; Q427-I430 PolarHBondContact O-N 3.47Å; Q427-Q431 WeakPolarHBondContact O-CG 3.16Å; Q427-Q431 PolarHBondContact O-N 3.16Å
428P97.6Very high93.5Very high8 Ų856 Ų565%0.05228%0.279CS..Hα-helixtrans-53.4-47.8168.3-32.337.6000114.4I372 T376 W410 F425 I430 Q431 V432I372-P428 HydrophobicContact CG2-CB 4.25Å; I372-P428 HydrophobicContact CG2-CG 3.79Å; T376-P428 WeakPolarHBondContact OG1-CB 3.13Å; W410-P428 HydrophobicContact CH2-CB 3.52Å; W410-P428 HydrophobicContact CZ2-CB 4.34Å; W410-P428 HydrophobicContact CZ3-CB 4.1Å; F425-P428 WeakPolarHBondContact O-CD 3.33Å; P428-I430 PolarHBondContact O-N 2.75Å; P428-Q431 PolarHBondContact O-N 3.39Å; P428-Q431 VanDerWaalsContact O-N 3.11Å; P428-V432 PolarHBondContact O-N 3.4Å
429A97.8Very high94.2Very high0 Ų047.2 Ų47.20%024%0.238CC..Hα-helixtrans-61.1-43.3-179.800000111.6F425 V426 Q431 V432 F433 L487 V490 A491F425-A429 WeakPolarHBondContact O-CB 3.46Å; F425-A429 PolarHBondContact O-N 3.47Å; V426-A429 PolarHBondContact O-N 3.15Å; A429-Q431 VanDerWaalsContact C-N 3.3Å; A429-Q431 PolarHBondContact O-N 3.34Å; A429-V432 PolarHBondContact O-N 3.23Å; A429-F433 WeakPolarHBondContact O-CB 3.36Å; A429-F433 PolarHBondContact O-N 3.07Å; A429-L487 HydrophobicContact CB-CB 4.12Å; A429-L487 HydrophobicContact CB-CD2 3.74Å; A429-V490 HydrophobicContact CB-CB 4.46Å; A429-V490 HydrophobicContact CB-CG1 4.38Å; A429-A491 HydrophobicContact CB-CB 4.13Å
430I98.5Very high94.7Very high26 Ų2642.3 Ų42.313%0.13322%0.216CC..Hα-helixtrans-57.3-43.2174-70.7168.4000111.3V426 Q427 P428 N434 A491 H494V426-I430 HydrophobicContact CG1-CD1 4.07Å; V426-I430 VanDerWaalsContact O-CG1 3.26Å; V426-I430 WeakPolarHBondContact O-CG1 3.3Å; V426-I430 PolarHBondContact O-N 2.98Å; Q427-I430 PolarHBondContact O-N 3.47Å; P428-I430 PolarHBondContact O-N 2.75Å; I430-N434 WeakPolarHBondContact CG2-ND2 3.34Å; I430-N434 VanDerWaalsContact O-CB 3.29Å; I430-N434 WeakPolarHBondContact O-CB 2.93Å; I430-N434 PolarHBondContact O-N 3.5Å; I430-N434 PolarHBondContact O-ND2 3.05Å; I430-A491 HydrophobicContact CD1-CB 4.44Å; I430-A491 HydrophobicContact CG1-CB 3.62Å; I430-H494 HydrophobicContact CD1-CB 4Å; I430-H494 HydrophobicContact CG1-CB 4.01Å
431Q98.5Very high94.9Very high88 Ų8841.9 Ų41.941%0.41121%0.214SC..Hα-helixtrans-67.5-47.8-178.9-71.8176.45600112.1T376 Q427 P428 A429 N434 S435T376-Q431 HydrophobicContact CG2-CB 3.76Å; Q427-Q431 WeakPolarHBondContact O-CG 3.16Å; Q427-Q431 PolarHBondContact O-N 3.16Å; P428-Q431 PolarHBondContact O-N 3.39Å; P428-Q431 VanDerWaalsContact O-N 3.11Å; A429-Q431 VanDerWaalsContact C-N 3.3Å; A429-Q431 PolarHBondContact O-N 3.34Å; Q431-N434 PolarHBondContact O-N 3.32Å; Q431-S435 WeakPolarHBondContact O-CB 3.42Å; Q431-S435 PolarHBondContact O-N 3.2Å
432V98.6Very high95Very high1 Ų137.8 Ų37.81%0.00619%0.188CC..Hα-helixtrans-62.7-46.8178.5175.50000110.4T376 T379 L407 W410 P428 A429 N434 S435 Y436 I484 L487T376-V432 HydrophobicContact CG2-CG2 4.12Å; T379-V432 HydrophobicContact CG2-CB 4.46Å; T379-V432 HydrophobicContact CG2-CG1 3.66Å; T379-V432 HydrophobicContact CG2-CG2 3.98Å; L407-V432 HydrophobicContact CD2-CG1 3.97Å; W410-V432 HydrophobicContact CZ2-CG2 4.15Å; P428-V432 PolarHBondContact O-N 3.4Å; A429-V432 PolarHBondContact O-N 3.23Å; V432-N434 PolarHBondContact O-N 3.38Å; V432-S435 PolarHBondContact O-N 3.4Å; V432-Y436 PolarHBondContact O-N 2.82Å; V432-I484 HydrophobicContact CG1-CD1 3.91Å; V432-L487 HydrophobicContact CB-CD1 4.13Å; V432-L487 HydrophobicContact CG1-CD1 3.66Å
433F98.6Very high94.7Very high0 Ų027.1 Ų27.10%015%0.153CC..Hα-helixtrans-59.6-49.2178.5-170.5-84.4000111.8A429 S435 Y436 I437 I484 C495 L498 L499 V548 L552A429-F433 WeakPolarHBondContact O-CB 3.36Å; A429-F433 PolarHBondContact O-N 3.07Å; F433-S435 VanDerWaalsContact C-N 3.29Å; F433-S435 PolarHBondContact O-N 2.67Å; F433-Y436 PolarHBondContact O-N 3.18Å; F433-I437 HydrophobicContact CD1-CG1 3.96Å; F433-I437 HydrophobicContact CE1-CD1 4.14Å; F433-I437 HydrophobicContact CE1-CG1 3.65Å; F433-I437 HydrophobicContact CZ-CD1 4.28Å; F433-I437 HydrophobicContact CZ-CG1 4.25Å; F433-I437 WeakPolarHBondContact O-CG1 3.35Å; F433-I437 PolarHBondContact O-N 3.13Å; F433-I484 HydrophobicContact CD2-CG2 3.72Å; F433-I484 HydrophobicContact CE2-CG2 3.81Å; F433-C495 HydrophobicContact CD1-CB 4.09Å; F433-C495 VanDerWaalsContact CD1-SG 3.54Å; F433-C495 HydrophobicContact CD2-CB 4.39Å; F433-C495 HydrophobicContact CE1-CB 3.84Å; F433-C495 HydrophobicContact CE2-CB 4.16Å; F433-C495 HydrophobicContact CG-CB 4.36Å; F433-C495 VanDerWaalsContact CG-SG 3.53Å; F433-C495 HydrophobicContact CZ-CB 3.89Å; F433-L498 HydrophobicContact CD1-CD2 4.31Å; F433-L498 HydrophobicContact CE1-CD2 4.17Å; F433-L499 HydrophobicContact CE1-CD2 4.3Å; F433-L499 HydrophobicContact CE1-CG 4.28Å; F433-L499 HydrophobicContact CZ-CD1 3.93Å; F433-L499 HydrophobicContact CZ-CD2 3.96Å; F433-L499 HydrophobicContact CZ-CG 3.89Å; F433-V548 HydrophobicContact CE2-CG1 3.71Å; F433-V548 HydrophobicContact CZ-CG1 3.7Å; F433-L552 HydrophobicContact CE2-CD1 4.19Å; F433-L552 HydrophobicContact CZ-CD1 4.35Å
434N98.3Very high94.2Very high41 Ų4130.6 Ų30.622%0.21917%0.168CC..Hα-helixtrans-61.6-38.7176.9-73-32.2000111.9I430 Q431 V432 I437 Q438 H494 L498I430-N434 WeakPolarHBondContact CG2-ND2 3.34Å; I430-N434 VanDerWaalsContact O-CB 3.29Å; I430-N434 WeakPolarHBondContact O-CB 2.93Å; I430-N434 PolarHBondContact O-N 3.5Å; I430-N434 PolarHBondContact O-ND2 3.05Å; Q431-N434 PolarHBondContact O-N 3.32Å; V432-N434 PolarHBondContact O-N 3.38Å; N434-I437 PolarHBondContact O-N 3.32Å; N434-Q438 WeakPolarHBondContact O-CB 3.27Å; N434-Q438 WeakPolarHBondContact O-CG 3.21Å; N434-Q438 PolarHBondContact O-N 3.22Å; N434-H494 PolarHBondContact ND2-NE2 2.83Å; N434-H494 PolarHBondContact OD1-NE2 3.03Å; N434-L498 WeakPolarHBondContact OD1-CD2 3.47Å
435S98Very high93.9Very high4 Ų432.2 Ų32.23%0.02817%0.174CC..Hα-helixtrans-64.7-43.1177-165.40000111.2C380 R384 Q431 V432 F433 Q438 C439C380-S435 PolarHBondContact O-OG 3.31Å; R384-S435 PolarHBondContact NH1-OG 2.98Å; Q431-S435 WeakPolarHBondContact O-CB 3.42Å; Q431-S435 PolarHBondContact O-N 3.2Å; V432-S435 PolarHBondContact O-N 3.4Å; F433-S435 VanDerWaalsContact C-N 3.29Å; F433-S435 PolarHBondContact O-N 2.67Å; S435-Q438 PolarHBondContact O-N 2.55Å; S435-C439 PolarHBondContact O-N 2.82Å; S435-C439 PolarHBondContact O-SG 3.27Å
436Y98.2Very high93.5Very high1 Ų132.5 Ų32.50%0.00418%0.177CC..Hα-helixtrans-60.1-49.1176.4-171.9-81.1000111.1Y403 L407 V432 F433 Q438 C439 H440 Q480 I484 V548Y403-Y436 HydrophobicContact CE1-CD2 4.1Å; Y403-Y436 HydrophobicContact CE1-CE2 4.32Å; Y403-Y436 VanDerWaalsContact OH-CD2 3.26Å; Y403-Y436 WeakPolarHBondContact OH-CD2 3.41Å; L407-Y436 HydrophobicContact CD1-CD2 4.45Å; L407-Y436 HydrophobicContact CD1-CE2 4.44Å; V432-Y436 PolarHBondContact O-N 2.82Å; F433-Y436 PolarHBondContact O-N 3.18Å; Y436-Q438 VanDerWaalsContact C-N 3.3Å; Y436-Q438 PolarHBondContact O-N 3Å; Y436-C439 PolarHBondContact O-N 3.16Å; Y436-H440 AromaticContact CD1-CE1 3.91Å; Y436-H440 AromaticContact CD1-ND1 3.54Å; Y436-H440 AromaticContact CD2-CE1 3.78Å; Y436-H440 AromaticContact CE1-CE1 3.52Å; Y436-H440 AromaticContact CE1-CG 4Å; Y436-H440 AromaticContact CE1-ND1 3.42Å; Y436-H440 WeakPolarHBondContact CE1-ND1 3.38Å; Y436-H440 AromaticContact CE2-CE1 3.42Å; Y436-H440 VanDerWaalsContact CE2-CE1 3.42Å; Y436-H440 WeakPolarHBondContact CE2-CE1 2.9Å; Y436-H440 AromaticContact CG-ND1 3.89Å; Y436-H440 AromaticContact CZ-CE1 3.26Å; Y436-H440 AromaticContact CZ-ND1 3.7Å; Y436-H440 AromaticContact CZ-NE2 3.73Å; Y436-H440 PolarHBondContact O-N 3.45Å; Y436-H440 PolarHBondContact O-ND1 3.16Å; Y436-Q480 HydrophobicContact CE2-CB 4.33Å; Y436-I484 HydrophobicContact CD1-CG1 4.33Å; Y436-I484 HydrophobicContact CD1-CG2 4.14Å; Y436-I484 HydrophobicContact CD2-CD1 3.63Å; Y436-I484 HydrophobicContact CD2-CG1 3.42Å; Y436-I484 VanDerWaalsContact CD2-CG1 3.42Å; Y436-I484 HydrophobicContact CE2-CD1 4.46Å; Y436-I484 HydrophobicContact CE2-CG1 3.78Å; Y436-I484 HydrophobicContact CG-CD1 3.77Å; Y436-I484 HydrophobicContact CG-CG1 3.73Å; Y436-I484 HydrophobicContact CG-CG2 4.19Å; Y436-V548 HydrophobicContact CD1-CG2 4.11Å; Y436-V548 HydrophobicContact CE1-CG2 3.7Å
437I97.9Very high93Very high11 Ų1132.5 Ų32.56%0.05618%0.177CC..Hα-helixtrans-59.9-41.3177.3-64.5-61.7000111.3F433 N434 H440 L441 L499 L502 L545 V548F433-I437 HydrophobicContact CD1-CG1 3.96Å; F433-I437 HydrophobicContact CE1-CD1 4.14Å; F433-I437 HydrophobicContact CE1-CG1 3.65Å; F433-I437 HydrophobicContact CZ-CD1 4.28Å; F433-I437 HydrophobicContact CZ-CG1 4.25Å; F433-I437 WeakPolarHBondContact O-CG1 3.35Å; F433-I437 PolarHBondContact O-N 3.13Å; N434-I437 PolarHBondContact O-N 3.32Å; I437-H440 PolarHBondContact O-N 3.18Å; I437-L441 HydrophobicContact CG2-CD1 3.54Å; I437-L441 HydrophobicContact CG2-CG 4.13Å; I437-L441 WeakPolarHBondContact O-CB 3.16Å; I437-L441 VanDerWaalsContact O-CG 3.25Å; I437-L441 WeakPolarHBondContact O-CG 3.49Å; I437-L441 PolarHBondContact O-N 3.23Å; I437-L441 VanDerWaalsContact O-N 3.16Å; I437-L499 HydrophobicContact CD1-CD2 3.87Å; I437-L502 HydrophobicContact CG2-CD1 3.7Å; I437-L545 HydrophobicContact CD1-CD2 4.37Å; I437-V548 HydrophobicContact CD1-CB 4.49Å; I437-V548 HydrophobicContact CD1-CG1 4.19Å; I437-V548 HydrophobicContact CD1-CG2 4.32Å
438Q95.8Very high92.4Very high89 Ų8927.4 Ų27.442%0.41615%0.153SC..Hα-helixtrans-64.5-41.7176.6-75.3168.82.600112.1N434 S435 Y436 H440 G446 T447N434-Q438 WeakPolarHBondContact O-CB 3.27Å; N434-Q438 WeakPolarHBondContact O-CG 3.21Å; N434-Q438 PolarHBondContact O-N 3.22Å; S435-Q438 PolarHBondContact O-N 2.55Å; Y436-Q438 VanDerWaalsContact C-N 3.3Å; Y436-Q438 PolarHBondContact O-N 3Å; Q438-H440 VanDerWaalsContact C-N 3.26Å; Q438-H440 PolarHBondContact O-N 2.89Å; Q438-G446 CarbonylContact O-C 3.39Å; Q438-G446 WeakPolarHBondContact O-CA 3.33Å; Q438-T447 PolarHBondContact O-N 3.33Å; Q438-T447 PolarHBondContact O-OG1 3.1Å
439C94.4Very high91.2Very high3 Ų328 Ų282%0.0216%0.155CC..Hα-helixtrans-60.8-35.1178.4-71.60000112.8G383 A387 S435 Y436 R448G383-C439 PolarHBondContact O-SG 3.33Å; A387-C439 HydrophobicContact CB-CB 3.89Å; S435-C439 PolarHBondContact O-N 2.82Å; S435-C439 PolarHBondContact O-SG 3.27Å; Y436-C439 PolarHBondContact O-N 3.16Å; C439-R448 WeakPolarHBondContact O-CA 3.38Å; C439-R448 WeakPolarHBondContact O-CB 3.5Å; C439-R448 PolarHBondContact O-N 3.4Å
440H94.3Very high89.9Confident14 Ų1431.7 Ų31.77%0.06518%0.175CC..Hα-helixtrans-99.81.1-173.4-64.185.1000114.8Y436 I437 Q438 R448 W544Y436-H440 AromaticContact CD1-CE1 3.91Å; Y436-H440 AromaticContact CD1-ND1 3.54Å; Y436-H440 AromaticContact CD2-CE1 3.78Å; Y436-H440 AromaticContact CE1-CE1 3.52Å; Y436-H440 AromaticContact CE1-CG 4Å; Y436-H440 AromaticContact CE1-ND1 3.42Å; Y436-H440 WeakPolarHBondContact CE1-ND1 3.38Å; Y436-H440 AromaticContact CE2-CE1 3.42Å; Y436-H440 VanDerWaalsContact CE2-CE1 3.42Å; Y436-H440 WeakPolarHBondContact CE2-CE1 2.9Å; Y436-H440 AromaticContact CG-ND1 3.89Å; Y436-H440 AromaticContact CZ-CE1 3.26Å; Y436-H440 AromaticContact CZ-ND1 3.7Å; Y436-H440 AromaticContact CZ-NE2 3.73Å; Y436-H440 PolarHBondContact O-N 3.45Å; Y436-H440 PolarHBondContact O-ND1 3.16Å; I437-H440 PolarHBondContact O-N 3.18Å; Q438-H440 VanDerWaalsContact C-N 3.26Å; Q438-H440 PolarHBondContact O-N 2.89Å; H440-R448 PolarHBondContact O-NH1 3.36Å; H440-W544 HydrophobicContact CB-CB 4Å; H440-W544 HydrophobicContact CB-CD2 4.13Å; H440-W544 HydrophobicContact CB-CG 3.74Å; H440-W544 AromaticContact CD2-CD2 3.48Å; H440-W544 VanDerWaalsContact CD2-CD2 3.48Å; H440-W544 AromaticContact CD2-CE2 3.49Å; H440-W544 VanDerWaalsContact CD2-CE2 3.49Å; H440-W544 AromaticContact CD2-CE3 3.75Å; H440-W544 AromaticContact CD2-CH2 3.97Å; H440-W544 AromaticContact CD2-CZ2 3.75Å; H440-W544 AromaticContact CD2-CZ3 3.99Å; H440-W544 AromaticContact CD2-NE1 4Å
441L92.6Very high88Confident4 Ų433.3 Ų33.32%0.02118%0.183CC..SBendtrans-104.4146.1176.3-72.4-177.8000112.4I437 D445 G446 T447 R448 L502 D541 L545I437-L441 HydrophobicContact CG2-CD1 3.54Å; I437-L441 HydrophobicContact CG2-CG 4.13Å; I437-L441 WeakPolarHBondContact O-CB 3.16Å; I437-L441 VanDerWaalsContact O-CG 3.25Å; I437-L441 WeakPolarHBondContact O-CG 3.49Å; I437-L441 PolarHBondContact O-N 3.23Å; I437-L441 VanDerWaalsContact O-N 3.16Å; L441-D445 HydrophobicContact CD1-CB 4.37Å; L441-G446 CarbonylContact O-C 3.09Å; L441-G446 WeakPolarHBondContact O-CA 3.36Å; L441-T447 PolarHBondContact O-N 3.02Å; L441-T447 VanDerWaalsContact O-N 3.16Å; L441-R448 VanDerWaalsContact O-CB 3.31Å; L441-R448 WeakPolarHBondContact O-CB 3.18Å; L441-R448 PolarHBondContact O-N 3.19Å; L441-L502 HydrophobicContact CD1-CD1 4.07Å; L441-L502 HydrophobicContact CD1-CD2 4.05Å; L441-D541 WeakPolarHBondContact CA-OD1 3.26Å; L441-D541 HydrophobicContact CD2-CB 3.77Å; L441-L545 HydrophobicContact CD2-CD1 4.2Å; L441-L545 HydrophobicContact CD2-CD2 4.49Å; L441-L545 HydrophobicContact CD2-CG 4.15Å
442A86.6Confident86Confident3 Ų330.7 Ų30.73%0.02517%0.171CC..  trans-67.4160.617000000112.4D445 G446 D537 D541A442-D445 PolarHBondContact O-N 3.41Å; A442-G446 PolarHBondContact O-N 2.8Å; A442-G446 VanDerWaalsContact O-N 3.07Å; A442-D537 HydrophobicContact CB-CB 4.17Å; A442-D541 WeakPolarHBondContact CB-OD1 3.44Å; A442-D541 PolarHBondContact N-OD1 3.28Å
443A77.9Confident83.7Confident25 Ų2536.4 Ų36.421%0.20720%0.198CC..THydrogen-bonded Turntrans-58.2140.9168.900000110.3L450A443-L450 HydrophobicContact CB-CD2 4.38Å
444P76.3Confident81.4Confident111 Ų11140.2 Ų40.272%0.72123%0.225SC*.THydrogen-bonded Turncis-92.9-7.214.636.4-36.8000115.7
445D84.3Confident79Confident76 Ų7642.1 Ų42.141%0.40624%0.237SC..THydrogen-bonded Turntrans-91.8-15.8-170.3-58.4-45.3000113.3L441 A442 R506L441-D445 HydrophobicContact CD1-CB 4.37Å; A442-D445 PolarHBondContact O-N 3.41Å; D445-R506 IonicContact OD2-CZ 3.52Å; D445-R506 VanDerWaalsContact OD2-CZ 3.23Å; D445-R506 IonicContact OD2-NH1 3.27Å; D445-R506 PolarHBondContact OD2-NH1 3.03Å; D445-R506 IonicContact OD2-NH2 3.04Å; D445-R506 PolarHBondContact OD2-NH2 3.44Å
446G86.5Confident76.2Confident7 Ų749.8 Ų49.87%0.07228%0.278CS..  trans-140-173.6178.600000114.4Q438 L441 A442Q438-G446 CarbonylContact O-C 3.39Å; Q438-G446 WeakPolarHBondContact O-CA 3.33Å; L441-G446 CarbonylContact O-C 3.09Å; L441-G446 WeakPolarHBondContact O-CA 3.36Å; A442-G446 PolarHBondContact O-N 2.8Å; A442-G446 VanDerWaalsContact O-N 3.07Å
447T85.8Confident73.6Confident44 Ų4453.3 Ų53.327%0.2732%0.315SS..SBendtrans-113.9-2.6-170.962.50000114.3Q438 L441 N449 L450Q438-T447 PolarHBondContact O-N 3.33Å; Q438-T447 PolarHBondContact O-OG1 3.1Å; L441-T447 PolarHBondContact O-N 3.02Å; L441-T447 VanDerWaalsContact O-N 3.16Å; T447-N449 VanDerWaalsContact C-N 3.31Å; T447-N449 PolarHBondContact O-N 2.91Å; T447-L450 HydrophobicContact CG2-CD1 3.51Å; T447-L450 PolarHBondContact O-N 3.37Å
448R83.9Confident71Confident20 Ų2057.5 Ų57.58%0.07534%0.337CS..THydrogen-bonded Turntrans-48.7-50.1-172.1-164-178.963.2-136.30.2111.8V391 C439 H440 L441 D537 E540 D541V391-R448 WeakPolarHBondContact CG2-O 3.29Å; C439-R448 WeakPolarHBondContact O-CA 3.38Å; C439-R448 WeakPolarHBondContact O-CB 3.5Å; C439-R448 PolarHBondContact O-N 3.4Å; H440-R448 PolarHBondContact O-NH1 3.36Å; L441-R448 VanDerWaalsContact O-CB 3.31Å; L441-R448 WeakPolarHBondContact O-CB 3.18Å; L441-R448 PolarHBondContact O-N 3.19Å; R448-D537 PolarHBondContact NH2-O 3.43Å; R448-D537 IonicContact NH2-OD1 3.51Å; R448-E540 VanDerWaalsContact NH1-CG 3.28Å; R448-D541 IonicContact CZ-OD1 3.04Å; R448-D541 IonicContact NH1-OD1 3.35Å; R448-D541 PolarHBondContact NH1-OD1 3.37Å; R448-D541 IonicContact NH2-OD1 3.3Å; R448-D541 PolarHBondContact NH2-OD1 3.44Å
449N73.4Confident68.5Low19 Ų1957 Ų5710%0.10234%0.342CS..THydrogen-bonded Turntrans-110.825.1-173.8-59.6-9.1000113.8T447 L451 D537T447-N449 VanDerWaalsContact C-N 3.31Å; T447-N449 PolarHBondContact O-N 2.91Å; N449-L451 PolarHBondContact O-N 2.96Å; N449-D537 PolarHBondContact ND2-OD1 3.05Å
450L68.4Low66.2Low78 Ų7859.2 Ų59.241%0.40836%0.358SS..Hα-helixtrans-66.5-34.3-170.7-85.2177.8000114.8A443 T447A443-L450 HydrophobicContact CB-CD2 4.38Å; T447-L450 HydrophobicContact CG2-CD1 3.51Å; T447-L450 PolarHBondContact O-N 3.37Å
451L59.7Low64Low60 Ų6065.3 Ų65.331%0.31439%0.386SS..Hα-helixtrans-73.7-36.6-178.4-79.6170.7000112.3L388 V391 L392 N449 Q453 S454 V455L388-L451 HydrophobicContact CD2-CD1 3.59Å; L388-L451 HydrophobicContact CD2-CG 4.17Å; V391-L451 HydrophobicContact CG1-CB 4.24Å; L392-L451 HydrophobicContact CD2-CD1 4.09Å; L392-L451 HydrophobicContact CG-CD1 4.25Å; N449-L451 PolarHBondContact O-N 2.96Å; L451-Q453 PolarHBondContact O-N 3Å; L451-S454 PolarHBondContact O-N 3.41Å; L451-S454 PolarHBondContact O-OG 3.4Å; L451-S454 VanDerWaalsContact O-OG 3.1Å; L451-V455 PolarHBondContact O-N 3.13Å; L451-V455 VanDerWaalsContact O-N 3.14Å
452E55.9Low62.1Low34 Ų3473.8 Ų73.816%0.15943%0.426CS..Hα-helixtrans-57.1-31.9174.7-64.7-177.9-176.300113.1V391 S460 K533V391-E452 HydrophobicContact CG1-CG 4.39Å; E452-S460 VanDerWaalsContact CD-OG 3.25Å; E452-S460 VanDerWaalsContact OE1-CB 3.27Å; E452-S460 WeakPolarHBondContact OE1-CB 3.13Å; E452-S460 PolarHBondContact OE1-OG 3Å; E452-K533 WeakPolarHBondContact OE2-CE 3.41Å; E452-K533 IonicContact OE2-NZ 3.96Å; E452-K533 PolarHBondContact OE2-NZ 2.86Å
453Q51Low60.7Low120 Ų12081.7 Ų81.756%0.56146%0.462SS*.Hα-helixtrans-83.1-21.2-179.7-63.8-176.82.200113L451L451-Q453 PolarHBondContact O-N 3Å
454S50.3Low59.9Low81 Ų8187.4 Ų87.457%0.56649%0.485SS*.Hα-helixtrans-99.3-27.9-17272.90000114.1L451L451-S454 PolarHBondContact O-N 3.41Å; L451-S454 PolarHBondContact O-OG 3.4Å; L451-S454 VanDerWaalsContact O-OG 3.1Å
455V47.8Very low59.3Low80 Ų8091.6 Ų91.649%0.48550%0.495SS..SBendtrans-99.696.3177.5-1740000108.3L451 G457 I458L451-V455 PolarHBondContact O-N 3.13Å; L451-V455 VanDerWaalsContact O-N 3.14Å; V455-G457 PolarHBondContact O-N 2.99Å; V455-I458 HydrophobicContact CG1-CD1 4.49Å
456N39.6Very low58.7Low165 Ų16594.3 Ų94.388%0.88251%0.508SS*.THydrogen-bonded Turntrans-17.491.5175.7-83.5-23.4000115.3I458N456-I458 PolarHBondContact O-N 3.42Å
457G42.7Very low57.8Low76 Ų7698.4 Ų98.478%0.78453%0.528SS*.THydrogen-bonded Turntrans64.226.615800000117.1V455 S459V455-G457 PolarHBondContact O-N 2.99Å; G457-S459 PolarHBondContact O-N 3.15Å
458I44.2Very low56.9Low99 Ų99104.9 Ų104.951%0.50856%0.555SS.*  trans-89.692153.3-53.7174.9000104.1V455 N456 S460V455-I458 HydrophobicContact CG1-CD1 4.49Å; N456-I458 PolarHBondContact O-N 3.42Å; I458-S460 PolarHBondContact O-N 3.11Å
459S43.6Very low56.3Low77 Ų77111 Ų11154%0.53859%0.589SS.*  trans-52.1133.6156.650.30000105.8G457 H461G457-S459 PolarHBondContact O-N 3.15Å; S459-H461 PolarHBondContact O-N 3.32Å
460S45.7Very low56.6Low50 Ų50115.3 Ų115.335%0.3561%0.608SS.*SBendtrans-38.2132.1152.542.40000107.4E452 I458E452-S460 VanDerWaalsContact CD-OG 3.25Å; E452-S460 VanDerWaalsContact OE1-CB 3.27Å; E452-S460 WeakPolarHBondContact OE1-CB 3.13Å; E452-S460 PolarHBondContact OE1-OG 3Å; I458-S460 PolarHBondContact O-N 3.11Å
461H48.2Very low57.4Low142 Ų142117.3 Ų117.366%0.65762%0.615SS**SBendtrans-58.5163.5-162-78.5-94.8000111S459 E463S459-H461 PolarHBondContact O-N 3.32Å; H461-E463 PolarHBondContact O-N 2.92Å
462E51.3Low58.8Low182 Ų182115 Ų11585%0.8560%0.604SS**SBendtrans-23.4123.9175.9-63.9170.1162.200112E464E462-E464 PolarHBondContact O-N 3.29Å
463E57.4Low60.6Low169 Ų169115.3 Ų115.379%0.7961%0.606SS**  trans-31.8105174.2-76.6171.5-17600108.3H461 E465H461-E463 PolarHBondContact O-N 2.92Å; E463-E465 PolarHBondContact O-N 3.15Å
464E62Low62.6Low145 Ų145110.8 Ų110.868%0.67858%0.584SS**  trans-56.7131.9-176.4-68.4-164.8150.900106.6E462 I466E462-E464 PolarHBondContact O-N 3.29Å; E464-I466 VanDerWaalsContact C-N 3.25Å; E464-I466 PolarHBondContact O-N 3.3Å
465E63.7Low64.6Low199 Ų199111.8 Ų111.893%0.9358%0.58SS**  trans-63.595.3177-74.6-172.3169.700107.7E463 N467E463-E465 PolarHBondContact O-N 3.15Å; E465-N467 PolarHBondContact O-N 3.12Å; E465-N467 VanDerWaalsContact O-N 3.14Å
466I70.8Confident66.6Low134 Ų134112.3 Ų112.369%0.68758%0.579SS**  trans-59.9117.7176.5-62.7178000106.8E464 Q470E464-I466 VanDerWaalsContact C-N 3.25Å; E464-I466 PolarHBondContact O-N 3.3Å; I466-Q470 HydrophobicContact CG2-CB 4.22Å
467N67.7Low69.2Low93 Ų93105.5 Ų105.550%0.49754%0.542SS..  trans-71.4139.1178.8-172.8-16.7000109E465 L469 Q470E465-N467 PolarHBondContact O-N 3.12Å; E465-N467 VanDerWaalsContact O-N 3.14Å; N467-L469 PolarHBondContact O-N 3.15Å; N467-L469 PolarHBondContact OD1-N 3.44Å; N467-L469 VanDerWaalsContact OD1-N 3.08Å; N467-Q470 VanDerWaalsContact O-CB 3.25Å; N467-Q470 WeakPolarHBondContact O-CB 3.44Å; N467-Q470 PolarHBondContact O-N 3.39Å
468E66.5Low71.7Confident180 Ų180103.7 Ų103.784%0.84152%0.517SS*.THydrogen-bonded Turntrans-57.6-14.6172-63.2178.5178.400113.1
469L71.9Confident74Confident149 Ų149104.5 Ų104.578%0.7852%0.523SS*.THydrogen-bonded Turntrans-90.7-5.6174.2-59.1177.9000114.2N467N467-L469 PolarHBondContact O-N 3.15Å; N467-L469 PolarHBondContact OD1-N 3.44Å; N467-L469 VanDerWaalsContact OD1-N 3.08Å
470Q81Confident76.5Confident109 Ų109101 Ų10151%0.50950%0.498SS..SBendtrans-71.5128.9176.3-175.3166-7.100109.1I466 N467I466-Q470 HydrophobicContact CG2-CB 4.22Å; N467-Q470 VanDerWaalsContact O-CB 3.25Å; N467-Q470 WeakPolarHBondContact O-CB 3.44Å; N467-Q470 PolarHBondContact O-N 3.39Å
471E84.2Confident78.9Confident119 Ų11998.7 Ų98.756%0.55648%0.481SS*.PPolyproline II helixtrans-65.8142.5176.8-67.3-178.3178.200110.2E475E471-E475 HydrophobicContact CB-CB 4.49Å
472D90Very high81.2Confident13 Ų1393.6 Ų93.67%0.0746%0.462CS..PPolyproline II helixtrans-63.5146.7174.6-169.4-0.5000109.9R474 E475 L476 Q636 K639D472-R474 HydrophobicContact CB-CG 4.11Å; D472-R474 PolarHBondContact O-N 3.29Å; D472-R474 WeakPolarHBondContact OD2-CD 3.49Å; D472-R474 IonicContact OD2-CZ 2.79Å; D472-R474 VanDerWaalsContact OD2-CZ 3.29Å; D472-R474 IonicContact OD2-NE 2.75Å; D472-R474 PolarHBondContact OD2-NE 3.49Å; D472-R474 IonicContact OD2-NH1 3.86Å; D472-R474 IonicContact OD2-NH2 2.82Å; D472-E475 WeakPolarHBondContact O-CA 3.36Å; D472-E475 WeakPolarHBondContact O-CB 3.37Å; D472-E475 PolarHBondContact O-N 3.25Å; D472-L476 PolarHBondContact O-N 2.9Å; D472-Q636 PolarHBondContact OD1-NE2 2.95Å; D472-K639 WeakPolarHBondContact OD2-CE 3.24Å; D472-K639 IonicContact OD2-NZ 2.75Å; D472-K639 PolarHBondContact OD2-NZ 3.5Å
473D93.1Very high83.4Confident39 Ų3984.9 Ų84.921%0.20942%0.421CS..Hα-helixtrans-57-31.5-176.7-71-48.2000112.5E475 F477 H543 W544 L547D473-E475 PolarHBondContact O-N 2.89Å; D473-F477 HydrophobicContact CB-CD2 4.09Å; D473-F477 WeakPolarHBondContact O-CB 3.34Å; D473-F477 PolarHBondContact O-N 3.04Å; D473-F477 WeakPolarHBondContact OD1-CE2 3.16Å; D473-H543 IonicContact OD2-CE1 3.08Å; D473-H543 IonicContact OD2-NE2 3.9Å; D473-H543 PolarHBondContact OD2-NE2 2.93Å; D473-W544 HydrophobicContact CB-CH2 3.99Å; D473-W544 HydrophobicContact CB-CZ2 4.28Å; D473-L547 HydrophobicContact CB-CD1 4.29Å
474R93.2Very high85.3Confident25 Ų2576.9 Ų76.99%0.09438%0.384CS..Hα-helixtrans-64.6-24.2175.176-169.5-174.6-166.2-3113.6D472 S478 L547 Y551 D705D472-R474 HydrophobicContact CB-CG 4.11Å; D472-R474 PolarHBondContact O-N 3.29Å; D472-R474 WeakPolarHBondContact OD2-CD 3.49Å; D472-R474 IonicContact OD2-CZ 2.79Å; D472-R474 VanDerWaalsContact OD2-CZ 3.29Å; D472-R474 IonicContact OD2-NE 2.75Å; D472-R474 PolarHBondContact OD2-NE 3.49Å; D472-R474 IonicContact OD2-NH1 3.86Å; D472-R474 IonicContact OD2-NH2 2.82Å; R474-S478 WeakPolarHBondContact O-CB 3.35Å; R474-L547 HydrophobicContact CB-CD1 4.2Å; R474-L547 HydrophobicContact CB-CD2 3.81Å; R474-Y551 PolarHBondContact O-OH 2.77Å; R474-D705 IonicContact CZ-OD2 2.94Å; R474-D705 IonicContact NH1-OD2 3.84Å; R474-D705 PolarHBondContact NH1-OD2 2.97Å; R474-D705 IonicContact NH2-OD1 3.43Å; R474-D705 PolarHBondContact NH2-OD1 3.01Å; R474-D705 IonicContact NH2-OD2 2.76Å; R474-D705 PolarHBondContact NH2-OD2 2.87Å
475E91.4Very high86.9Confident103 Ų10370 Ų7048%0.48135%0.351SS..Hα-helixtrans-93.6-49.7177.5-63179.9-177.100109.8E471 D472 D473 F477 S478E471-E475 HydrophobicContact CB-CB 4.49Å; D472-E475 WeakPolarHBondContact O-CA 3.36Å; D472-E475 WeakPolarHBondContact O-CB 3.37Å; D472-E475 PolarHBondContact O-N 3.25Å; D473-E475 PolarHBondContact O-N 2.89Å; E475-F477 PolarHBondContact O-N 2.63Å; E475-S478 WeakPolarHBondContact O-CB 3.34Å; E475-S478 PolarHBondContact O-N 3.31Å; E475-S478 PolarHBondContact O-OG 3.4Å
476L90.9Very high88.5Confident91 Ų9161 Ų6148%0.47631%0.311SS..Hα-helixtrans-58.2-45.2179.4-178.362.4000112.5D472D472-L476 PolarHBondContact O-N 2.9Å
477F94.3Very high89.8Confident21 Ų2154.7 Ų54.79%0.09228%0.278CS..THydrogen-bonded Turntrans-104.521-178.4-58.2-71.1000113.2M400 D473 E475 D479 Q480 L481 W544M400-F477 HydrophobicContact CE-CE1 4.32Å; M400-F477 HydrophobicContact SD-CE1 4.1Å; D473-F477 HydrophobicContact CB-CD2 4.09Å; D473-F477 WeakPolarHBondContact O-CB 3.34Å; D473-F477 PolarHBondContact O-N 3.04Å; D473-F477 WeakPolarHBondContact OD1-CE2 3.16Å; E475-F477 PolarHBondContact O-N 2.63Å; F477-D479 VanDerWaalsContact C-N 3.28Å; F477-D479 PolarHBondContact O-N 3.38Å; F477-Q480 HydrophobicContact CB-CB 4.39Å; F477-Q480 HydrophobicContact CD1-CG 4.4Å; F477-Q480 PolarHBondContact O-N 2.6Å; F477-Q480 VanDerWaalsContact O-N 3.1Å; F477-L481 HydrophobicContact CB-CD1 4.46Å; F477-L481 WeakPolarHBondContact O-CB 3.45Å; F477-L481 WeakPolarHBondContact O-CG 3.42Å; F477-L481 PolarHBondContact O-N 3.17Å; F477-W544 AromaticContact CD2-CH2 3.6Å; F477-W544 HydrophobicContact CD2-CH2 3.6Å; F477-W544 HydrophobicContact CD2-CZ3 4.42Å; F477-W544 AromaticContact CE2-CH2 3.97Å; F477-W544 HydrophobicContact CE2-CH2 3.97Å; F477-W544 HydrophobicContact CE2-CZ2 4.49Å; F477-W544 HydrophobicContact CG-CH2 4.28Å
478S94.6Very high91.2Very high38 Ų3850.2 Ų50.227%0.26625%0.254SS..Hα-helixtrans-54.1-41-177.457.40000113.3R474 E475 S482R474-S478 WeakPolarHBondContact O-CB 3.35Å; E475-S478 WeakPolarHBondContact O-CB 3.34Å; E475-S478 PolarHBondContact O-N 3.31Å; E475-S478 PolarHBondContact O-OG 3.4Å; S478-S482 VanDerWaalsContact O-CB 3.23Å; S478-S482 WeakPolarHBondContact O-CB 3.36Å; S478-S482 PolarHBondContact O-N 2.86Å
479D92.8Very high92.6Very high117 Ų11742.5 Ų42.563%0.62622%0.217SC*.Hα-helixtrans-68.3-41.4177.6-74.8-24.3000112.4F477 S482 S483F477-D479 VanDerWaalsContact C-N 3.28Å; F477-D479 PolarHBondContact O-N 3.38Å; D479-S482 PolarHBondContact O-N 2.97Å; D479-S483 PolarHBondContact O-N 3.47Å
480Q96Very high93.7Very high4 Ų436.3 Ų36.32%0.01919%0.186CC..Hα-helixtrans-62.2-48.9174.5-63.7-166.52200110.8M400 D404 L407 Y436 F477 S482 S483 I484M400-Q480 PolarHBondContact SD-NE2 2.86Å; M400-Q480 VanDerWaalsContact SD-NE2 3.43Å; D404-Q480 WeakPolarHBondContact OD1-CG 3.33Å; D404-Q480 PolarHBondContact OD1-NE2 3.49Å; L407-Q480 HydrophobicContact CD1-CB 3.75Å; L407-Q480 HydrophobicContact CD1-CG 3.79Å; Y436-Q480 HydrophobicContact CE2-CB 4.33Å; F477-Q480 HydrophobicContact CB-CB 4.39Å; F477-Q480 HydrophobicContact CD1-CG 4.4Å; F477-Q480 PolarHBondContact O-N 2.6Å; F477-Q480 VanDerWaalsContact O-N 3.1Å; Q480-S482 VanDerWaalsContact C-N 3.31Å; Q480-S482 PolarHBondContact O-N 2.92Å; Q480-S483 WeakPolarHBondContact O-CB 3.5Å; Q480-S483 PolarHBondContact O-N 3.23Å; Q480-I484 WeakPolarHBondContact O-CG1 3.18Å; Q480-I484 PolarHBondContact O-N 3.1Å
481L97Very high94.4Very high0 Ų031.3 Ų31.30%016%0.163CC..Hα-helixtrans-63.4-37.5-179.6-69.8167.6000111.8F477 G485 W544 L547 V548 Y551F477-L481 HydrophobicContact CB-CD1 4.46Å; F477-L481 WeakPolarHBondContact O-CB 3.45Å; F477-L481 WeakPolarHBondContact O-CG 3.42Å; F477-L481 PolarHBondContact O-N 3.17Å; L481-G485 WeakPolarHBondContact O-CA 3.42Å; L481-G485 PolarHBondContact O-N 2.93Å; L481-W544 HydrophobicContact CD2-CE3 4.45Å; L481-W544 HydrophobicContact CD2-CZ3 4.3Å; L481-L547 HydrophobicContact CD1-CB 4.11Å; L481-L547 HydrophobicContact CD1-CD1 3.97Å; L481-L547 HydrophobicContact CD2-CB 3.96Å; L481-V548 HydrophobicContact CD2-CG2 3.95Å; L481-Y551 HydrophobicContact CB-CD1 4.2Å; L481-Y551 HydrophobicContact CB-CD2 3.47Å; L481-Y551 VanDerWaalsContact CB-CD2 3.47Å; L481-Y551 HydrophobicContact CB-CE1 4.37Å; L481-Y551 HydrophobicContact CB-CE2 3.66Å; L481-Y551 HydrophobicContact CB-CG 3.75Å; L481-Y551 HydrophobicContact CD1-CD2 4.06Å; L481-Y551 HydrophobicContact CD1-CE2 3.71Å; L481-Y551 HydrophobicContact CG-CD2 4.26Å; L481-Y551 HydrophobicContact CG-CE2 4.31Å; L481-Y551 VanDerWaalsContact O-CB 3.32Å; L481-Y551 WeakPolarHBondContact O-CB 3.38Å
482S95.6Very high95.1Very high35 Ų3525.9 Ų25.925%0.24514%0.138CC..Hα-helixtrans-62.1-45.4172.9-177.50000112.1S478 D479 Q480 G485 T486S478-S482 VanDerWaalsContact O-CB 3.23Å; S478-S482 WeakPolarHBondContact O-CB 3.36Å; S478-S482 PolarHBondContact O-N 2.86Å; D479-S482 PolarHBondContact O-N 2.97Å; Q480-S482 VanDerWaalsContact C-N 3.31Å; Q480-S482 PolarHBondContact O-N 2.92Å; S482-G485 PolarHBondContact O-N 3.49Å; S482-T486 WeakPolarHBondContact O-CB 3.25Å; S482-T486 PolarHBondContact O-N 3.37Å; S482-T486 PolarHBondContact O-OG1 3.17Å
483S96.6Very high95.4Very high0 Ų029.5 Ų29.50%016%0.158CC..Hα-helixtrans-61.9-49.7175.5-174.20000112.4L407 D479 Q480 G485 T486 L487L407-S483 WeakPolarHBondContact O-CB 3.22Å; L407-S483 PolarHBondContact O-OG 3.48Å; D479-S483 PolarHBondContact O-N 3.47Å; Q480-S483 WeakPolarHBondContact O-CB 3.5Å; Q480-S483 PolarHBondContact O-N 3.23Å; S483-G485 PolarHBondContact O-N 3.42Å; S483-T486 PolarHBondContact O-N 3.16Å; S483-L487 WeakPolarHBondContact O-CG 3.42Å; S483-L487 PolarHBondContact O-N 2.82Å
484I97.9Very high95.6Very high0 Ų030.8 Ų30.80%016%0.162CC..Hα-helixtrans-66.6-37.8179.6-65.9-65.8000111.8L407 V432 F433 Y436 Q480 T486 L487 G488 V548L407-I484 HydrophobicContact CD1-CD1 4.47Å; L407-I484 HydrophobicContact CD1-CG1 4.32Å; L407-I484 HydrophobicContact CD2-CD1 3.73Å; L407-I484 HydrophobicContact CD2-CG1 4.27Å; V432-I484 HydrophobicContact CG1-CD1 3.91Å; F433-I484 HydrophobicContact CD2-CG2 3.72Å; F433-I484 HydrophobicContact CE2-CG2 3.81Å; Y436-I484 HydrophobicContact CD1-CG1 4.33Å; Y436-I484 HydrophobicContact CD1-CG2 4.14Å; Y436-I484 HydrophobicContact CD2-CD1 3.63Å; Y436-I484 HydrophobicContact CD2-CG1 3.42Å; Y436-I484 VanDerWaalsContact CD2-CG1 3.42Å; Y436-I484 HydrophobicContact CE2-CD1 4.46Å; Y436-I484 HydrophobicContact CE2-CG1 3.78Å; Y436-I484 HydrophobicContact CG-CD1 3.77Å; Y436-I484 HydrophobicContact CG-CG1 3.73Å; Y436-I484 HydrophobicContact CG-CG2 4.19Å; Q480-I484 WeakPolarHBondContact O-CG1 3.18Å; Q480-I484 PolarHBondContact O-N 3.1Å; I484-T486 VanDerWaalsContact C-N 3.34Å; I484-L487 HydrophobicContact CD1-CD1 4.28Å; I484-L487 PolarHBondContact O-N 3.43Å; I484-G488 PolarHBondContact O-N 3.43Å; I484-V548 HydrophobicContact CG2-CG1 4Å; I484-V548 HydrophobicContact CG2-CG2 4.44Å
485G96.9Very high95.8Very high0 Ų029.6 Ų29.60%016%0.158CC..Hα-helixtrans-57.8-47.4172.200000111.2L481 S482 S483 G488 R489L481-G485 WeakPolarHBondContact O-CA 3.42Å; L481-G485 PolarHBondContact O-N 2.93Å; S482-G485 PolarHBondContact O-N 3.49Å; S483-G485 PolarHBondContact O-N 3.42Å; G485-G488 CarbonylContact O-C 3.52Å; G485-G488 WeakPolarHBondContact O-CA 3.01Å; G485-G488 PolarHBondContact O-N 3.28Å; G485-R489 WeakPolarHBondContact O-CG 3.28Å; G485-R489 PolarHBondContact O-N 2.77Å
486T96.1Very high96.2Very high12 Ų1224.7 Ų24.77%0.07414%0.135CC..Hα-helixtrans-65.8-44.7178.5-53.40000112.3L411 V414 S482 S483 I484 G488 R489 V490L411-T486 HydrophobicContact CD1-CG2 4.1Å; L411-T486 VanDerWaalsContact CD1-OG1 3.3Å; L411-T486 WeakPolarHBondContact CD1-OG1 3.42Å; V414-T486 HydrophobicContact CB-CG2 4.26Å; V414-T486 HydrophobicContact CG1-CG2 3.58Å; S482-T486 WeakPolarHBondContact O-CB 3.25Å; S482-T486 PolarHBondContact O-N 3.37Å; S482-T486 PolarHBondContact O-OG1 3.17Å; S483-T486 PolarHBondContact O-N 3.16Å; I484-T486 VanDerWaalsContact C-N 3.34Å; T486-G488 PolarHBondContact O-N 2.78Å; T486-R489 WeakPolarHBondContact O-CB 3.43Å; T486-R489 PolarHBondContact O-N 3.39Å; T486-V490 PolarHBondContact O-N 3.08Å; T486-V490 VanDerWaalsContact O-N 3.12Å
487L97.5Very high96.5Very high0 Ų023 Ų230%013%0.129CC..Hα-helixtrans-60.3-37.4172.5-71.1168000111.7W410 V414 A429 V432 S483 I484 R489 V490 A491W410-L487 HydrophobicContact CB-CD1 4.07Å; W410-L487 HydrophobicContact CB-CD2 4.42Å; W410-L487 HydrophobicContact CD2-CD2 4.21Å; W410-L487 HydrophobicContact CE3-CD2 3.81Å; W410-L487 HydrophobicContact CG-CD1 4.18Å; W410-L487 HydrophobicContact CG-CD2 4.49Å; W410-L487 HydrophobicContact CZ3-CD2 4.49Å; V414-L487 HydrophobicContact CG2-CD2 3.82Å; A429-L487 HydrophobicContact CB-CB 4.12Å; A429-L487 HydrophobicContact CB-CD2 3.74Å; V432-L487 HydrophobicContact CB-CD1 4.13Å; V432-L487 HydrophobicContact CG1-CD1 3.66Å; S483-L487 WeakPolarHBondContact O-CG 3.42Å; S483-L487 PolarHBondContact O-N 2.82Å; I484-L487 HydrophobicContact CD1-CD1 4.28Å; I484-L487 PolarHBondContact O-N 3.43Å; L487-R489 VanDerWaalsContact C-N 3.3Å; L487-R489 PolarHBondContact O-N 2.63Å; L487-V490 PolarHBondContact O-N 2.86Å; L487-A491 PolarHBondContact O-N 3.43Å; L487-A491 VanDerWaalsContact O-N 3.12Å
488G97.5Very high96.7Very high0 Ų024.1 Ų24.10%014%0.136CC..Hα-helixtrans-62-34.1173.400000113.4I484 G485 T486 A491 A492I484-G488 PolarHBondContact O-N 3.43Å; G485-G488 CarbonylContact O-C 3.52Å; G485-G488 WeakPolarHBondContact O-CA 3.01Å; G485-G488 PolarHBondContact O-N 3.28Å; T486-G488 PolarHBondContact O-N 2.78Å; G488-A491 CarbonylContact O-C 3.57Å; G488-A491 VanDerWaalsContact O-C 3.28Å; G488-A492 VanDerWaalsContact O-CA 3.26Å; G488-A492 WeakPolarHBondContact O-CA 3.38Å; G488-A492 PolarHBondContact O-N 3.27Å
489R96.3Very high96.8Very high17 Ų1722.3 Ų22.36%0.06412%0.123CC..Hα-helixtrans-70-46175-68.3169.7-166.1176.45.4112G485 T486 L487 A491 A492 Y551 L552 A554 D555 P565 E567 V568G485-R489 WeakPolarHBondContact O-CG 3.28Å; G485-R489 PolarHBondContact O-N 2.77Å; T486-R489 WeakPolarHBondContact O-CB 3.43Å; T486-R489 PolarHBondContact O-N 3.39Å; L487-R489 VanDerWaalsContact C-N 3.3Å; L487-R489 PolarHBondContact O-N 2.63Å; R489-A491 PolarHBondContact O-N 2.89Å; R489-A492 VanDerWaalsContact O-CB 3.31Å; R489-A492 WeakPolarHBondContact O-CB 3.44Å; R489-A492 PolarHBondContact O-N 2.95Å; R489-A492 VanDerWaalsContact O-N 3.16Å; R489-Y551 PolarHBondContact NH2-O 3.3Å; R489-L552 WeakPolarHBondContact CG-O 3.24Å; R489-L552 PolarHBondContact NE-O 2.83Å; R489-A554 VanDerWaalsContact NH2-C 3.35Å; R489-A554 PolarHBondContact NH2-O 2.95Å; R489-D555 IonicContact CZ-OD1 2.63Å; R489-D555 IonicContact NH1-OD1 3.4Å; R489-D555 PolarHBondContact NH1-OD1 3.27Å; R489-D555 IonicContact NH1-OD2 2.92Å; R489-D555 PolarHBondContact NH1-OD2 2.73Å; R489-D555 IonicContact NH2-OD1 3.66Å; R489-D555 PolarHBondContact NH2-OD1 3.32Å; R489-P565 VanDerWaalsContact CZ-CG 3.42Å; R489-E567 HydrophobicContact CB-CB 3.94Å; R489-E567 HydrophobicContact CB-CG 4.19Å; R489-V568 HydrophobicContact CG-CG2 4.18Å
490V95.3Very high97.1Very high20 Ų2017.1 Ų17.112%0.12110%0.096CC..Hα-helixtrans-56-39.9174.1175.40000111.6V414 E417 F425 V426 A429 T486 L487V414-V490 HydrophobicContact CB-CG2 4.47Å; V414-V490 HydrophobicContact CG1-CG2 3.16Å; E417-V490 WeakPolarHBondContact OE2-CG1 3.44Å; E417-V490 WeakPolarHBondContact OE2-CG2 3.49Å; F425-V490 HydrophobicContact CB-CG1 4.3Å; V426-V490 HydrophobicContact CG2-CG1 4.08Å; A429-V490 HydrophobicContact CB-CB 4.46Å; A429-V490 HydrophobicContact CB-CG1 4.38Å; T486-V490 PolarHBondContact O-N 3.08Å; T486-V490 VanDerWaalsContact O-N 3.12Å; L487-V490 PolarHBondContact O-N 2.86Å
491A96.4Very high97.2Very high3 Ų320.5 Ų20.53%0.02512%0.12CC..THydrogen-bonded Turntrans-104.232.7-179.600000113.3A429 I430 L487 G488 R489 D493 H494 C495A429-A491 HydrophobicContact CB-CB 4.13Å; I430-A491 HydrophobicContact CD1-CB 4.44Å; I430-A491 HydrophobicContact CG1-CB 3.62Å; L487-A491 PolarHBondContact O-N 3.43Å; L487-A491 VanDerWaalsContact O-N 3.12Å; G488-A491 CarbonylContact O-C 3.57Å; G488-A491 VanDerWaalsContact O-C 3.28Å; R489-A491 PolarHBondContact O-N 2.89Å; A491-D493 PolarHBondContact O-N 3.01Å; A491-D493 VanDerWaalsContact O-N 3.1Å; A491-H494 PolarHBondContact O-N 2.85Å; A491-C495 PolarHBondContact O-N 2.88Å; A491-C495 PolarHBondContact O-SG 2.69Å
492A97Very high97.2Very high5 Ų521.4 Ų21.44%0.04113%0.125CC..Hα-helixtrans-53.5-36.4-173.500000113.9G488 R489 H494 I496 F571G488-A492 VanDerWaalsContact O-CA 3.26Å; G488-A492 WeakPolarHBondContact O-CA 3.38Å; G488-A492 PolarHBondContact O-N 3.27Å; R489-A492 VanDerWaalsContact O-CB 3.31Å; R489-A492 WeakPolarHBondContact O-CB 3.44Å; R489-A492 PolarHBondContact O-N 2.95Å; R489-A492 VanDerWaalsContact O-N 3.16Å; A492-H494 PolarHBondContact O-N 2.81Å; A492-H494 VanDerWaalsContact O-N 3.16Å; A492-I496 HydrophobicContact CB-CD1 3.93Å; A492-I496 HydrophobicContact CB-CG1 4.4Å; A492-I496 PolarHBondContact O-N 2.72Å; A492-F571 HydrophobicContact CB-CB 4.19Å; A492-F571 HydrophobicContact CB-CD2 4.06Å; A492-F571 HydrophobicContact CB-CG 4.06Å
493D96.1Very high97.3Very high90 Ų9019.8 Ų19.848%0.48111%0.113SC..Hα-helixtrans-55.2-29.5176.1-75.4-65.7000113.2A491 F571 K574 H575A491-D493 PolarHBondContact O-N 3.01Å; A491-D493 VanDerWaalsContact O-N 3.1Å; D493-F571 HydrophobicContact CB-CE2 4.46Å; D493-K574 IonicContact OD1-NZ 2.73Å; D493-K574 PolarHBondContact OD1-NZ 2.75Å; D493-K574 IonicContact OD2-NZ 3.63Å; D493-K574 PolarHBondContact OD2-NZ 3.38Å; D493-H575 IonicContact OD1-CE1 3.56Å; D493-H575 PolarHBondContact OD1-CE1 3.39Å; D493-H575 IonicContact OD1-NE2 2.9Å; D493-H575 PolarHBondContact OD1-NE2 3.31Å
494H97.9Very high97.3Very high66 Ų6620.9 Ų20.931%0.30612%0.119SC..Hα-helixtrans-101.5-46.6177.1173.679000112.3I430 N434 A491 A492 P497 L498I430-H494 HydrophobicContact CD1-CB 4Å; I430-H494 HydrophobicContact CG1-CB 4.01Å; N434-H494 PolarHBondContact ND2-NE2 2.83Å; N434-H494 PolarHBondContact OD1-NE2 3.03Å; A491-H494 PolarHBondContact O-N 2.85Å; A492-H494 PolarHBondContact O-N 2.81Å; A492-H494 VanDerWaalsContact O-N 3.16Å; H494-P497 WeakPolarHBondContact O-CD 3.31Å; H494-L498 WeakPolarHBondContact O-CB 3.49Å; H494-L498 PolarHBondContact O-N 3.28Å
495C98.4Very high97.2Very high0 Ų024.1 Ų24.10%014%0.136CC..Hα-helixtrans-72.7-40-167.4-61.40000113.2F433 A491 L498 L499 L552F433-C495 HydrophobicContact CD1-CB 4.09Å; F433-C495 VanDerWaalsContact CD1-SG 3.54Å; F433-C495 HydrophobicContact CD2-CB 4.39Å; F433-C495 HydrophobicContact CE1-CB 3.84Å; F433-C495 HydrophobicContact CE2-CB 4.16Å; F433-C495 HydrophobicContact CG-CB 4.36Å; F433-C495 VanDerWaalsContact CG-SG 3.53Å; F433-C495 HydrophobicContact CZ-CB 3.89Å; A491-C495 PolarHBondContact O-N 2.88Å; A491-C495 PolarHBondContact O-SG 2.69Å; C495-L498 PolarHBondContact O-N 3.37Å; C495-L499 WeakPolarHBondContact O-CG 3.49Å; C495-L499 PolarHBondContact O-N 2.81Å; C495-L552 HydrophobicContact CB-CD1 4.08Å
496I98.3Very high97.2Very high0 Ų024.2 Ų24.20%014%0.136CC..Hα-helixtrans-64.6-48.6179.8-65.5176.1000111.3A492 L498 T500 L552 F571 S606 V607 L610A492-I496 HydrophobicContact CB-CD1 3.93Å; A492-I496 HydrophobicContact CB-CG1 4.4Å; A492-I496 PolarHBondContact O-N 2.72Å; I496-L498 VanDerWaalsContact C-N 3.33Å; I496-L498 PolarHBondContact O-N 3.17Å; I496-T500 WeakPolarHBondContact O-CB 3.36Å; I496-T500 PolarHBondContact O-N 2.73Å; I496-T500 PolarHBondContact O-OG1 2.98Å; I496-L552 HydrophobicContact CD1-CD2 4.06Å; I496-L552 HydrophobicContact CG1-CD1 4.42Å; I496-L552 HydrophobicContact CG1-CD2 3.7Å; I496-F571 HydrophobicContact CD1-CD1 3.9Å; I496-F571 HydrophobicContact CD1-CE1 4.03Å; I496-S606 WeakPolarHBondContact CG2-O 3.41Å; I496-V607 HydrophobicContact CD1-CG2 4.2Å; I496-L610 HydrophobicContact CG2-CB 4.25Å; I496-L610 HydrophobicContact CG2-CD2 4.14Å
497P97.4Very high97.1Very high54 Ų5424 Ų2435%0.35114%0.135SC..Hα-helixtrans-60.7-38.1173.9-26.436000113.8H494 T500 S501H494-P497 WeakPolarHBondContact O-CD 3.31Å; P497-T500 PolarHBondContact O-N 2.87Å; P497-S501 WeakPolarHBondContact O-CB 3.4Å; P497-S501 PolarHBondContact O-N 3.34Å
498L98.3Very high97Very high46 Ų4626.4 Ų26.424%0.24115%0.148CC..Hα-helixtrans-61.4-53.7177.9175.562.3000111.5F433 N434 H494 C495 I496 T500 S501 L502F433-L498 HydrophobicContact CD1-CD2 4.31Å; F433-L498 HydrophobicContact CE1-CD2 4.17Å; N434-L498 WeakPolarHBondContact OD1-CD2 3.47Å; H494-L498 WeakPolarHBondContact O-CB 3.49Å; H494-L498 PolarHBondContact O-N 3.28Å; C495-L498 PolarHBondContact O-N 3.37Å; I496-L498 VanDerWaalsContact C-N 3.33Å; I496-L498 PolarHBondContact O-N 3.17Å; L498-T500 VanDerWaalsContact C-N 3.29Å; L498-T500 PolarHBondContact O-N 3.14Å; L498-S501 PolarHBondContact O-N 3.48Å; L498-L502 HydrophobicContact CD1-CD1 3.78Å; L498-L502 HydrophobicContact CD1-CG 4.18Å; L498-L502 HydrophobicContact CG-CD1 3.89Å; L498-L502 WeakPolarHBondContact O-CG 3.14Å; L498-L502 PolarHBondContact O-N 3.48Å
499L98.5Very high96.9Very high0 Ų030.2 Ų30.20%016%0.162CC..Hα-helixtrans-59.1-42177.8-70.7177.2000111.6F433 I437 C495 S501 L502 L503 L545 V548 L552 L610F433-L499 HydrophobicContact CE1-CD2 4.3Å; F433-L499 HydrophobicContact CE1-CG 4.28Å; F433-L499 HydrophobicContact CZ-CD1 3.93Å; F433-L499 HydrophobicContact CZ-CD2 3.96Å; F433-L499 HydrophobicContact CZ-CG 3.89Å; I437-L499 HydrophobicContact CD1-CD2 3.87Å; C495-L499 WeakPolarHBondContact O-CG 3.49Å; C495-L499 PolarHBondContact O-N 2.81Å; L499-S501 VanDerWaalsContact C-N 3.34Å; L499-S501 PolarHBondContact O-N 3.1Å; L499-L502 PolarHBondContact O-N 2.99Å; L499-L503 WeakPolarHBondContact O-CB 3.5Å; L499-L503 PolarHBondContact O-N 3.02Å; L499-L545 HydrophobicContact CD2-CD2 3.85Å; L499-V548 HydrophobicContact CD1-CG1 4.21Å; L499-V548 HydrophobicContact CD2-CG1 4.1Å; L499-L552 HydrophobicContact CD1-CD1 3.82Å; L499-L610 HydrophobicContact CB-CD1 3.8Å; L499-L610 HydrophobicContact CB-CD2 4.34Å; L499-L610 HydrophobicContact CD1-CD2 4.2Å
500T98.1Very high96.8Very high7 Ų729.4 Ų29.44%0.04316%0.159CC..Hα-helixtrans-59.3-46.8177.7-57.70000110.9I496 P497 L498 E504 R609 L610I496-T500 WeakPolarHBondContact O-CB 3.36Å; I496-T500 PolarHBondContact O-N 2.73Å; I496-T500 PolarHBondContact O-OG1 2.98Å; P497-T500 PolarHBondContact O-N 2.87Å; L498-T500 VanDerWaalsContact C-N 3.29Å; L498-T500 PolarHBondContact O-N 3.14Å; T500-E504 HydrophobicContact CG2-CG 4.47Å; T500-E504 WeakPolarHBondContact O-CB 3.37Å; T500-E504 VanDerWaalsContact O-CG 3.31Å; T500-E504 WeakPolarHBondContact O-CG 3.41Å; T500-E504 PolarHBondContact O-N 3.2Å; T500-R609 HydrophobicContact CG2-CB 4.33Å; T500-R609 HydrophobicContact CG2-CG 3.67Å; T500-L610 WeakPolarHBondContact OG1-CB 3.29Å
501S97.2Very high96.7Very high76 Ų7630.9 Ų30.953%0.53117%0.165SC..Hα-helixtrans-64.8-43.2179.9-174.30000112.1P497 L498 L499 D505P497-S501 WeakPolarHBondContact O-CB 3.4Å; P497-S501 PolarHBondContact O-N 3.34Å; L498-S501 PolarHBondContact O-N 3.48Å; L499-S501 VanDerWaalsContact C-N 3.34Å; L499-S501 PolarHBondContact O-N 3.1Å; S501-D505 WeakPolarHBondContact O-CB 3.47Å; S501-D505 PolarHBondContact O-N 3.38Å
502L98Very high96.5Very high19 Ų1931.6 Ų31.610%0.09917%0.172CC..Hα-helixtrans-65.6-48.8179.6-70.5167.6000110.8I437 L441 L498 L499 E504 D505 R506 L545I437-L502 HydrophobicContact CG2-CD1 3.7Å; L441-L502 HydrophobicContact CD1-CD1 4.07Å; L441-L502 HydrophobicContact CD1-CD2 4.05Å; L498-L502 HydrophobicContact CD1-CD1 3.78Å; L498-L502 HydrophobicContact CD1-CG 4.18Å; L498-L502 HydrophobicContact CG-CD1 3.89Å; L498-L502 WeakPolarHBondContact O-CG 3.14Å; L498-L502 PolarHBondContact O-N 3.48Å; L499-L502 PolarHBondContact O-N 2.99Å; L502-E504 PolarHBondContact O-N 3.43Å; L502-D505 PolarHBondContact O-N 2.64Å; L502-R506 VanDerWaalsContact O-CG 3.32Å; L502-R506 WeakPolarHBondContact O-CG 3.4Å; L502-R506 PolarHBondContact O-N 3.12Å; L502-L545 HydrophobicContact CB-CD1 3.84Å; L502-L545 HydrophobicContact CB-CD2 3.91Å; L502-L545 HydrophobicContact CD1-CD2 3.98Å
503L97.3Very high96.2Very high0 Ų033.4 Ų33.40%018%0.18CC..Hα-helixtrans-61.1-46.5176.8-79.7170.4000111.9L499 D505 R506 V507 L545 I546 L610 A613 V614L499-L503 WeakPolarHBondContact O-CB 3.5Å; L499-L503 PolarHBondContact O-N 3.02Å; L503-D505 VanDerWaalsContact C-N 3.29Å; L503-D505 PolarHBondContact O-N 2.97Å; L503-R506 PolarHBondContact O-N 3.42Å; L503-V507 VanDerWaalsContact O-CB 3.31Å; L503-V507 WeakPolarHBondContact O-CB 3.44Å; L503-V507 WeakPolarHBondContact O-CG2 3.23Å; L503-V507 PolarHBondContact O-N 2.96Å; L503-L545 HydrophobicContact CD2-CB 3.48Å; L503-L545 VanDerWaalsContact CD2-CB 3.48Å; L503-L545 HydrophobicContact CD2-CD1 4.06Å; L503-L545 HydrophobicContact CD2-CG 4.41Å; L503-L545 HydrophobicContact CG-CB 3.85Å; L503-L545 HydrophobicContact CG-CD1 4.21Å; L503-I546 HydrophobicContact CD2-CG1 4.33Å; L503-L610 HydrophobicContact CD1-CD1 3.77Å; L503-A613 HydrophobicContact CB-CB 3.95Å; L503-A613 HydrophobicContact CD1-CB 4.35Å; L503-V614 HydrophobicContact CD1-CG2 3.96Å
504E96.8Very high95.9Very high24 Ų2429.4 Ų29.411%0.11216%0.158CC..Hα-helixtrans-58.8-40.8177-77.2-178.9-178.200111.7T500 L502 N508 A595 R609 A613T500-E504 HydrophobicContact CG2-CG 4.47Å; T500-E504 WeakPolarHBondContact O-CB 3.37Å; T500-E504 VanDerWaalsContact O-CG 3.31Å; T500-E504 WeakPolarHBondContact O-CG 3.41Å; T500-E504 PolarHBondContact O-N 3.2Å; L502-E504 PolarHBondContact O-N 3.43Å; E504-N508 VanDerWaalsContact O-CB 3.31Å; E504-N508 WeakPolarHBondContact O-CB 3.49Å; E504-N508 PolarHBondContact O-N 2.9Å; E504-N508 VanDerWaalsContact O-N 3.14Å; E504-N508 PolarHBondContact O-ND2 2.61Å; E504-A595 WeakPolarHBondContact OE1-CB 3.47Å; E504-R609 IonicContact OE1-CZ 3.51Å; E504-R609 IonicContact OE1-NE 2.88Å; E504-R609 PolarHBondContact OE1-NE 3.5Å; E504-R609 IonicContact OE1-NH2 2.96Å; E504-R609 PolarHBondContact OE1-NH2 2.89Å; E504-R609 IonicContact OE2-CZ 2.74Å; E504-R609 IonicContact OE2-NE 2.67Å; E504-R609 IonicContact OE2-NH2 3.64Å; E504-R609 PolarHBondContact OE2-NH2 2.97Å; E504-A613 HydrophobicContact CG-CB 4.37Å
505D96.3Very high95.4Very high68 Ų6830.3 Ų30.336%0.36416%0.163SC..Hα-helixtrans-63.7-51.9174.6178.369.9000112S501 L502 L503 V507 N508 R509S501-D505 WeakPolarHBondContact O-CB 3.47Å; S501-D505 PolarHBondContact O-N 3.38Å; L502-D505 PolarHBondContact O-N 2.64Å; L503-D505 VanDerWaalsContact C-N 3.29Å; L503-D505 PolarHBondContact O-N 2.97Å; D505-V507 PolarHBondContact O-N 3.19Å; D505-N508 WeakPolarHBondContact O-CB 3.48Å; D505-N508 PolarHBondContact O-N 3.27Å; D505-R509 WeakPolarHBondContact O-CG 3.35Å; D505-R509 PolarHBondContact O-N 3.12Å; D505-R509 WeakPolarHBondContact OD2-CD 3.24Å; D505-R509 IonicContact OD2-NH1 2.64Å
506R96.3Very high94.9Very high1 Ų136.4 Ų36.40%0.00419%0.186CC..Hα-helixtrans-62.5-42.8-177.8-65.4-47.8-173-97.7-1.2112.5D445 L502 L503 N508 R509 L510 L538 D541 I542 L545D445-R506 IonicContact OD2-CZ 3.52Å; D445-R506 VanDerWaalsContact OD2-CZ 3.23Å; D445-R506 IonicContact OD2-NH1 3.27Å; D445-R506 PolarHBondContact OD2-NH1 3.03Å; D445-R506 IonicContact OD2-NH2 3.04Å; D445-R506 PolarHBondContact OD2-NH2 3.44Å; L502-R506 VanDerWaalsContact O-CG 3.32Å; L502-R506 WeakPolarHBondContact O-CG 3.4Å; L502-R506 PolarHBondContact O-N 3.12Å; L503-R506 PolarHBondContact O-N 3.42Å; R506-N508 VanDerWaalsContact C-N 3.34Å; R506-N508 PolarHBondContact O-N 3.16Å; R506-R509 WeakPolarHBondContact O-CB 3.3Å; R506-R509 PolarHBondContact O-N 3.45Å; R506-L510 WeakPolarHBondContact O-CB 3.5Å; R506-L510 PolarHBondContact O-N 3.21Å; R506-L538 HydrophobicContact CB-CD1 3.81Å; R506-L538 HydrophobicContact CG-CD1 4.14Å; R506-D541 HydrophobicContact CG-CB 4.21Å; R506-D541 IonicContact CZ-OD2 3.52Å; R506-D541 IonicContact NE-OD2 3.3Å; R506-D541 PolarHBondContact NE-OD2 2.88Å; R506-D541 IonicContact NH2-OD2 3.07Å; R506-D541 PolarHBondContact NH2-OD2 3.06Å; R506-I542 HydrophobicContact CB-CD1 4.22Å; R506-I542 HydrophobicContact CB-CG1 3.71Å; R506-L545 HydrophobicContact CG-CD1 3.95Å
507V94.8Very high94.1Very high9 Ų937.1 Ų37.16%0.05519%0.19CC..Hα-helixtrans-62.6-41.8175.8174.30000111.4L503 D505 L510 H511 R616 T617 V620L503-V507 VanDerWaalsContact O-CB 3.31Å; L503-V507 WeakPolarHBondContact O-CB 3.44Å; L503-V507 WeakPolarHBondContact O-CG2 3.23Å; L503-V507 PolarHBondContact O-N 2.96Å; D505-V507 PolarHBondContact O-N 3.19Å; V507-L510 PolarHBondContact O-N 2.82Å; V507-H511 WeakPolarHBondContact O-CB 3.41Å; V507-H511 PolarHBondContact O-N 2.9Å; V507-R616 HydrophobicContact CG1-CB 4.06Å; V507-T617 HydrophobicContact CG2-CG2 4.24Å; V507-T617 WeakPolarHBondContact CG2-OG1 3.32Å; V507-V620 HydrophobicContact CG1-CG2 3.74Å
508N95.1Very high93.3Very high49 Ų4937.8 Ų37.826%0.26219%0.188SC..Hα-helixtrans-64.4-40.2175.8-80.2-49.7000112.3E504 D505 R506 G512 K594E504-N508 VanDerWaalsContact O-CB 3.31Å; E504-N508 WeakPolarHBondContact O-CB 3.49Å; E504-N508 PolarHBondContact O-N 2.9Å; E504-N508 VanDerWaalsContact O-N 3.14Å; E504-N508 PolarHBondContact O-ND2 2.61Å; D505-N508 WeakPolarHBondContact O-CB 3.48Å; D505-N508 PolarHBondContact O-N 3.27Å; R506-N508 VanDerWaalsContact C-N 3.34Å; R506-N508 PolarHBondContact O-N 3.16Å; N508-G512 PolarHBondContact O-N 3.46Å; N508-G512 VanDerWaalsContact O-N 3.08Å; N508-K594 VanDerWaalsContact OD1-CD 3.27Å; N508-K594 WeakPolarHBondContact OD1-CD 3.18Å; N508-K594 WeakPolarHBondContact OD1-CE 3.45Å; N508-K594 WeakPolarHBondContact OD1-CG 3.27Å
509R94.4Very high92.6Very high80 Ų8041.9 Ų41.930%0.30221%0.206SC..Hα-helixtrans-63.8-43.9174.4-73.5171.860.4-174.2-5.2111D505 R506 G512 Q513 L538D505-R509 WeakPolarHBondContact O-CG 3.35Å; D505-R509 PolarHBondContact O-N 3.12Å; D505-R509 WeakPolarHBondContact OD2-CD 3.24Å; D505-R509 IonicContact OD2-NH1 2.64Å; R506-R509 WeakPolarHBondContact O-CB 3.3Å; R506-R509 PolarHBondContact O-N 3.45Å; R509-G512 CarbonylContact O-C 3.52Å; R509-G512 PolarHBondContact O-N 3.35Å; R509-Q513 WeakPolarHBondContact O-CG 3.35Å; R509-Q513 PolarHBondContact O-N 2.99Å; R509-L538 HydrophobicContact CB-CD1 4.33Å; R509-L538 HydrophobicContact CB-CD2 4.1Å
510L94.5Very high91.6Very high1 Ų145.8 Ų45.81%0.00523%0.225CC..Hα-helixtrans-63.9-50.1-178.4177.461.9000110.3R506 V507 G512 Q513 L514 L535 L538 Y539 I542 V620 M637R506-L510 WeakPolarHBondContact O-CB 3.5Å; R506-L510 PolarHBondContact O-N 3.21Å; V507-L510 PolarHBondContact O-N 2.82Å; L510-G512 VanDerWaalsContact C-N 3.27Å; L510-G512 PolarHBondContact O-N 2.89Å; L510-Q513 PolarHBondContact O-N 3.48Å; L510-Q513 VanDerWaalsContact O-N 3.09Å; L510-L514 HydrophobicContact CD1-CD1 4.06Å; L510-L514 HydrophobicContact CD1-CG 4.1Å; L510-L514 HydrophobicContact CG-CD1 4.02Å; L510-L514 HydrophobicContact CG-CG 4.45Å; L510-L514 WeakPolarHBondContact O-CG 3.45Å; L510-L514 PolarHBondContact O-N 3.45Å; L510-L535 HydrophobicContact CD1-CD1 3.61Å; L510-L538 HydrophobicContact CB-CD2 3.64Å; L510-L538 HydrophobicContact CB-CG 4.22Å; L510-L538 HydrophobicContact CD1-CD2 4.03Å; L510-L538 HydrophobicContact CG-CD2 4.45Å; L510-Y539 HydrophobicContact CD1-CD1 4.4Å; L510-Y539 HydrophobicContact CD1-CE1 3.66Å; L510-Y539 HydrophobicContact CD2-CE1 4.12Å; L510-I542 HydrophobicContact CB-CD1 4.08Å; L510-I542 HydrophobicContact CD2-CD1 3.66Å; L510-I542 HydrophobicContact CG-CD1 4.41Å; L510-V620 HydrophobicContact CD2-CG1 4.09Å; L510-V620 HydrophobicContact CG-CG1 4.15Å; L510-M637 HydrophobicContact CD2-CE 4.27Å; L510-M637 HydrophobicContact CD2-SD 3.92Å
511H93.3Very high90.5Very high51 Ų5148.2 Ų48.224%0.23624%0.237CC..Hα-helixtrans-54.6-45.3175-176.364.6000112V507 Q515 V620V507-H511 WeakPolarHBondContact O-CB 3.41Å; V507-H511 PolarHBondContact O-N 2.9Å; H511-Q515 PolarHBondContact CE1-NE2 3.34Å; H511-Q515 VanDerWaalsContact CE1-NE2 3.3Å; H511-Q515 PolarHBondContact NE2-NE2 3.42Å; H511-Q515 WeakPolarHBondContact O-CB 3.26Å; H511-Q515 WeakPolarHBondContact O-CG 3.46Å; H511-Q515 PolarHBondContact O-N 3.06Å; H511-Q515 VanDerWaalsContact O-N 3.07Å; H511-V620 HydrophobicContact CB-CG1 4.29Å; H511-V620 HydrophobicContact CB-CG2 4.02Å
512G91.8Very high89.5Confident18 Ų1852.3 Ų52.319%0.18625%0.249CC..Hα-helixtrans-68.8-30.7178.100000114.2N508 R509 L510 R516N508-G512 PolarHBondContact O-N 3.46Å; N508-G512 VanDerWaalsContact O-N 3.08Å; R509-G512 CarbonylContact O-C 3.52Å; R509-G512 PolarHBondContact O-N 3.35Å; L510-G512 VanDerWaalsContact C-N 3.27Å; L510-G512 PolarHBondContact O-N 2.89Å; G512-R516 WeakPolarHBondContact O-CG 3.46Å; G512-R516 PolarHBondContact O-N 3.22Å; G512-R516 PolarHBondContact O-NE 2.77Å
513Q90.5Very high88.4Confident43 Ų4355.6 Ų55.620%0.20128%0.279CS..Hα-helixtrans-72.4-48.8174.3-73.6-65.4900111R509 L510 Q515 R516 T517 L535R509-Q513 WeakPolarHBondContact O-CG 3.35Å; R509-Q513 PolarHBondContact O-N 2.99Å; L510-Q513 PolarHBondContact O-N 3.48Å; L510-Q513 VanDerWaalsContact O-N 3.09Å; Q513-Q515 VanDerWaalsContact C-N 3.28Å; Q513-Q515 PolarHBondContact O-N 2.82Å; Q513-R516 VanDerWaalsContact CD-NH1 3.27Å; Q513-R516 VanDerWaalsContact NE2-NH2 3.19Å; Q513-R516 WeakPolarHBondContact O-CB 3.45Å; Q513-R516 PolarHBondContact O-N 3.37Å; Q513-T517 PolarHBondContact O-N 3.14Å; Q513-T517 PolarHBondContact O-OG1 3.1Å; Q513-T517 VanDerWaalsContact O-OG1 3.08Å; Q513-L535 HydrophobicContact CB-CD1 4.28Å
514L90.5Very high86.7Confident6 Ų657.5 Ų57.53%0.03129%0.293CS..Hα-helixtrans-57.5-40.9177.1-68173.4000111.8L510 T517 Q518 L535 V620 A624 L632 L633L510-L514 HydrophobicContact CD1-CD1 4.06Å; L510-L514 HydrophobicContact CD1-CG 4.1Å; L510-L514 HydrophobicContact CG-CD1 4.02Å; L510-L514 HydrophobicContact CG-CG 4.45Å; L510-L514 WeakPolarHBondContact O-CG 3.45Å; L510-L514 PolarHBondContact O-N 3.45Å; L514-T517 PolarHBondContact O-N 3.26Å; L514-Q518 WeakPolarHBondContact O-CB 3.3Å; L514-Q518 PolarHBondContact O-N 3.03Å; L514-L535 HydrophobicContact CD2-CD1 4.46Å; L514-V620 HydrophobicContact CD1-CG1 4.01Å; L514-A624 HydrophobicContact CD1-CB 4.09Å; L514-L632 HydrophobicContact CD2-CB 4.22Å; L514-L633 HydrophobicContact CD1-CD2 4.23Å
515Q88.3Confident84.8Confident84 Ų8463 Ų6339%0.39333%0.328SS..Hα-helixtrans-63.5-41.1173.8-78.1-176.4-13.200113.3H511 Q513 Q518 Q519H511-Q515 PolarHBondContact CE1-NE2 3.34Å; H511-Q515 VanDerWaalsContact CE1-NE2 3.3Å; H511-Q515 PolarHBondContact NE2-NE2 3.42Å; H511-Q515 WeakPolarHBondContact O-CB 3.26Å; H511-Q515 WeakPolarHBondContact O-CG 3.46Å; H511-Q515 PolarHBondContact O-N 3.06Å; H511-Q515 VanDerWaalsContact O-N 3.07Å; Q513-Q515 VanDerWaalsContact C-N 3.28Å; Q513-Q515 PolarHBondContact O-N 2.82Å; Q515-Q518 PolarHBondContact O-N 3.37Å; Q515-Q519 WeakPolarHBondContact O-CG 3.32Å; Q515-Q519 PolarHBondContact O-N 3.44Å
516R86.5Confident82.8Confident129 Ų12965.6 Ų65.649%0.48734%0.342SS..Hα-helixtrans-65.1-45177.2-82.4178.4-84.6156.6-8.1111.1G512 Q513 Q518 Q519 H520G512-R516 WeakPolarHBondContact O-CG 3.46Å; G512-R516 PolarHBondContact O-N 3.22Å; G512-R516 PolarHBondContact O-NE 2.77Å; Q513-R516 VanDerWaalsContact CD-NH1 3.27Å; Q513-R516 VanDerWaalsContact NE2-NH2 3.19Å; Q513-R516 WeakPolarHBondContact O-CB 3.45Å; Q513-R516 PolarHBondContact O-N 3.37Å; R516-Q518 VanDerWaalsContact C-N 3.34Å; R516-Q518 PolarHBondContact O-N 3.18Å; R516-Q519 PolarHBondContact O-N 3.12Å; R516-H520 WeakPolarHBondContact O-CB 3.39Å; R516-H520 PolarHBondContact O-N 3.26Å
517T81.8Confident80.9Confident14 Ų1470.3 Ų70.39%0.08637%0.367CS..Hα-helixtrans-61.9-42.8176.7-53.30000111Q513 L514 Q519 H520 L521 V530 L632Q513-T517 PolarHBondContact O-N 3.14Å; Q513-T517 PolarHBondContact O-OG1 3.1Å; Q513-T517 VanDerWaalsContact O-OG1 3.08Å; L514-T517 PolarHBondContact O-N 3.26Å; T517-Q519 PolarHBondContact O-N 3.37Å; T517-H520 PolarHBondContact O-N 3.32Å; T517-L521 HydrophobicContact CG2-CD1 4.07Å; T517-L521 HydrophobicContact CG2-CG 4.45Å; T517-L521 WeakPolarHBondContact O-CB 3.39Å; T517-L521 VanDerWaalsContact O-CG 3.31Å; T517-L521 WeakPolarHBondContact O-CG 3.3Å; T517-L521 PolarHBondContact O-N 3.24Å; T517-V530 HydrophobicContact CG2-CG1 3.85Å; T517-V530 HydrophobicContact CG2-CG2 3.82Å; T517-L632 HydrophobicContact CG2-CD1 3.61Å; T517-L632 HydrophobicContact CG2-CD2 4.43Å
518Q82Confident78.8Confident68 Ų6873.9 Ų73.932%0.31841%0.405SS..Hα-helixtrans-60-46.7174.6-172.1-18025.200112.3L514 Q515 R516 H520 L521 M522 L629L514-Q518 WeakPolarHBondContact O-CB 3.3Å; L514-Q518 PolarHBondContact O-N 3.03Å; Q515-Q518 PolarHBondContact O-N 3.37Å; R516-Q518 VanDerWaalsContact C-N 3.34Å; R516-Q518 PolarHBondContact O-N 3.18Å; Q518-H520 VanDerWaalsContact C-N 3.28Å; Q518-H520 PolarHBondContact O-N 3.49Å; Q518-L521 PolarHBondContact O-N 3.1Å; Q518-M522 VanDerWaalsContact O-CG 3.31Å; Q518-M522 WeakPolarHBondContact O-CG 3.49Å; Q518-M522 PolarHBondContact O-N 3.39Å; Q518-L629 HydrophobicContact CB-CD1 4.09Å; Q518-L629 HydrophobicContact CB-CD2 4.34Å; Q518-L629 HydrophobicContact CG-CD1 4.34Å; Q518-L629 HydrophobicContact CG-CD2 4.29Å
519Q82.6Confident76.7Confident133 Ų13374.9 Ų74.962%0.62142%0.416SS*.Hα-helixtrans-61.4-37.3176.5-72.8175.17.400112.1Q515 R516 T517 M522 A523Q515-Q519 WeakPolarHBondContact O-CG 3.32Å; Q515-Q519 PolarHBondContact O-N 3.44Å; R516-Q519 PolarHBondContact O-N 3.12Å; T517-Q519 PolarHBondContact O-N 3.37Å; Q519-M522 PolarHBondContact O-N 2.96Å; Q519-A523 WeakPolarHBondContact O-CB 3.23Å; Q519-A523 PolarHBondContact O-N 3.43Å; Q519-A523 VanDerWaalsContact O-N 3.16Å
520H78.2Confident75.1Confident82 Ų8272.7 Ų72.738%0.3841%0.411SS..Hα-helixtrans-68.7-42.9177.6-165.2-83.6000112.5R516 T517 Q518 M522 A523 S524 S529R516-H520 WeakPolarHBondContact O-CB 3.39Å; R516-H520 PolarHBondContact O-N 3.26Å; T517-H520 PolarHBondContact O-N 3.32Å; Q518-H520 VanDerWaalsContact C-N 3.28Å; Q518-H520 PolarHBondContact O-N 3.49Å; H520-M522 VanDerWaalsContact C-N 3.27Å; H520-M522 PolarHBondContact O-N 2.79Å; H520-A523 CarbonylContact O-C 3.56Å; H520-A523 PolarHBondContact O-N 2.89Å; H520-S524 PolarHBondContact CE1-OG 3.46Å; H520-S524 PolarHBondContact ND1-OG 3.42Å; H520-S524 PolarHBondContact O-N 3.18Å; H520-S524 PolarHBondContact O-OG 3.02Å; H520-S529 PolarHBondContact CE1-OG 2.99Å
521L75Confident73.7Confident57 Ų5777.7 Ų77.730%0.29844%0.438SS..Hα-helixtrans-63.7-32.2175.1-72.1167.9000112.1T517 Q518 A523 L527 L632T517-L521 HydrophobicContact CG2-CD1 4.07Å; T517-L521 HydrophobicContact CG2-CG 4.45Å; T517-L521 WeakPolarHBondContact O-CB 3.39Å; T517-L521 VanDerWaalsContact O-CG 3.31Å; T517-L521 WeakPolarHBondContact O-CG 3.3Å; T517-L521 PolarHBondContact O-N 3.24Å; Q518-L521 PolarHBondContact O-N 3.1Å; L521-A523 VanDerWaalsContact C-N 3.34Å; L521-L527 HydrophobicContact CD2-CD2 3.92Å; L521-L527 HydrophobicContact CD2-CG 4.02Å; L521-L632 HydrophobicContact CD1-CD1 4.25Å
522M75.4Confident72.9Confident162 Ų16282.7 Ų82.780%0.79846%0.455SS*.Hα-helixtrans-72.9-25.7172.4-68.1-177.883.700113Q518 Q519 H520Q518-M522 VanDerWaalsContact O-CG 3.31Å; Q518-M522 WeakPolarHBondContact O-CG 3.49Å; Q518-M522 PolarHBondContact O-N 3.39Å; Q519-M522 PolarHBondContact O-N 2.96Å; H520-M522 VanDerWaalsContact C-N 3.27Å; H520-M522 PolarHBondContact O-N 2.79Å
523A74.3Confident72.3Confident88 Ų8886 Ų8673%0.72746%0.464SS*.Hα-helixtrans-95-23.4-177.500000114Q519 H520 L521Q519-A523 WeakPolarHBondContact O-CB 3.23Å; Q519-A523 PolarHBondContact O-N 3.43Å; Q519-A523 VanDerWaalsContact O-N 3.16Å; H520-A523 CarbonylContact O-C 3.56Å; H520-A523 PolarHBondContact O-N 2.89Å; L521-A523 VanDerWaalsContact C-N 3.34Å
524S62.4Low72Confident41 Ų4185.8 Ų85.829%0.28747%0.466SS..  trans-151.9143.2-178.768.40000111.8H520 D526H520-S524 PolarHBondContact CE1-OG 3.46Å; H520-S524 PolarHBondContact ND1-OG 3.42Å; H520-S524 PolarHBondContact O-N 3.18Å; H520-S524 PolarHBondContact O-OG 3.02Å; S524-D526 VanDerWaalsContact C-N 3.33Å
525T57.8Low71.9Confident139 Ų13986.2 Ų86.285%0.85347%0.468SS*.SBendtrans-840.9179.936.50000114.5L527T525-L527 PolarHBondContact O-N 2.89Å
526D54.6Low71.9Confident122 Ų12285.5 Ų85.565%0.65247%0.467SS*.  trans-87.596.7-178.3-105-20.4000111.3S524 G528 S529S524-D526 VanDerWaalsContact C-N 3.33Å; D526-G528 PolarHBondContact O-N 2.84Å; D526-S529 PolarHBondContact O-OG 3.21Å
527L54.3Low72Confident101 Ų10180.7 Ų80.753%0.52945%0.451SS..G310 helixtrans-64.4-19.9174.9-77.6128.5000113.5L521 T525 S529L521-L527 HydrophobicContact CD2-CD2 3.92Å; L521-L527 HydrophobicContact CD2-CG 4.02Å; T525-L527 PolarHBondContact O-N 2.89Å; L527-S529 PolarHBondContact O-N 3.13Å
528G52.1Low72.5Confident83 Ų8380.1 Ų80.186%0.85645%0.447SS*.G310 helixtrans-785.6-175.200000116.1D526D526-G528 PolarHBondContact O-N 2.84Å
529S51Low73.1Confident71 Ų7177.5 Ų77.550%0.49744%0.435SS..G310 helixtrans-109.62.1-17963.30000114.4H520 D526 L527H520-S529 PolarHBondContact CE1-OG 2.99Å; D526-S529 PolarHBondContact O-OG 3.21Å; L527-S529 PolarHBondContact O-N 3.13Å
530V60.2Low73.6Confident33 Ų3374.2 Ų74.220%0.242%0.42CS..SBendtrans-76.9126176.3-176.40000108.8T517 R532T517-V530 HydrophobicContact CG2-CG1 3.85Å; T517-V530 HydrophobicContact CG2-CG2 3.82Å; V530-R532 PolarHBondContact O-N 2.89Å
531D65Low74.5Confident107 Ų10770.4 Ų70.457%0.57240%0.402SS*.  trans-70.680.2174.1-168.4-2.9000109.7K533 V534D531-K533 VanDerWaalsContact C-N 3.31Å; D531-K533 PolarHBondContact O-N 3.1Å; D531-V534 PolarHBondContact O-N 3.21Å; D531-V534 VanDerWaalsContact OD2-CG2 3.24Å; D531-V534 WeakPolarHBondContact OD2-CG2 3.3Å
532R76Confident75.6Confident156 Ų15667.7 Ų67.759%0.58939%0.387SS*.Hα-helixtrans-60.9-39.8-177-74.3-173.5173-158.9-6111.8V530 V534 L535 D536V530-R532 PolarHBondContact O-N 2.89Å; R532-V534 VanDerWaalsContact C-N 3.29Å; R532-V534 PolarHBondContact O-N 3.16Å; R532-V534 VanDerWaalsContact O-N 3.17Å; R532-L535 CarbonylContact O-C 3.48Å; R532-L535 WeakPolarHBondContact O-CA 3.36Å; R532-L535 VanDerWaalsContact O-CB 3.24Å; R532-L535 WeakPolarHBondContact O-CB 3.48Å; R532-L535 PolarHBondContact O-N 3.27Å; R532-D536 PolarHBondContact O-N 2.98Å
533K80.3Confident76.6Confident86 Ų8660.1 Ų60.137%0.37435%0.35SS..Hα-helixtrans-53.9-41.9-179.9-174.5167.2-175.5160.20113.5E452 D531 L535 D536 D537E452-K533 WeakPolarHBondContact OE2-CE 3.41Å; E452-K533 IonicContact OE2-NZ 3.96Å; E452-K533 PolarHBondContact OE2-NZ 2.86Å; D531-K533 VanDerWaalsContact C-N 3.31Å; D531-K533 PolarHBondContact O-N 3.1Å; K533-L535 PolarHBondContact O-N 3.23Å; K533-D536 PolarHBondContact O-N 2.93Å; K533-D537 WeakPolarHBondContact O-CB 3.38Å; K533-D537 VanDerWaalsContact O-CG 3.26Å; K533-D537 PolarHBondContact O-N 3.28Å
534V84.5Confident77.8Confident40 Ų4056.5 Ų56.524%0.24232%0.318CS..Hα-helixtrans-66.5-29.5177.21730000112.4D531 R532 L538D531-V534 PolarHBondContact O-N 3.21Å; D531-V534 VanDerWaalsContact OD2-CG2 3.24Å; D531-V534 WeakPolarHBondContact OD2-CG2 3.3Å; R532-V534 VanDerWaalsContact C-N 3.29Å; R532-V534 PolarHBondContact O-N 3.16Å; R532-V534 VanDerWaalsContact O-N 3.17Å; V534-L538 VanDerWaalsContact O-CB 3.28Å; V534-L538 WeakPolarHBondContact O-CB 3.47Å; V534-L538 PolarHBondContact O-N 3.45Å
535L87.9Confident79.5Confident15 Ų1554.6 Ų54.68%0.07930%0.304CS..Hα-helixtrans-77.6-41.3176.3-164.168.3000110.6L510 Q513 L514 R532 K533 L538 Y539 L632L510-L535 HydrophobicContact CD1-CD1 3.61Å; Q513-L535 HydrophobicContact CB-CD1 4.28Å; L514-L535 HydrophobicContact CD2-CD1 4.46Å; R532-L535 CarbonylContact O-C 3.48Å; R532-L535 WeakPolarHBondContact O-CA 3.36Å; R532-L535 VanDerWaalsContact O-CB 3.24Å; R532-L535 WeakPolarHBondContact O-CB 3.48Å; R532-L535 PolarHBondContact O-N 3.27Å; K533-L535 PolarHBondContact O-N 3.23Å; L535-L538 CarbonylContact O-C 3.58Å; L535-L538 WeakPolarHBondContact O-CB 3.35Å; L535-L538 PolarHBondContact O-N 3.18Å; L535-L538 VanDerWaalsContact O-N 3.17Å; L535-Y539 HydrophobicContact CB-CE2 4.47Å; L535-Y539 HydrophobicContact CD1-CE2 4.22Å; L535-Y539 HydrophobicContact CD2-CE2 3.67Å; L535-Y539 HydrophobicContact CG-CD2 4.06Å; L535-Y539 HydrophobicContact CG-CE2 3.42Å; L535-Y539 VanDerWaalsContact CG-CE2 3.42Å; L535-Y539 VanDerWaalsContact O-CD2 3.27Å; L535-Y539 WeakPolarHBondContact O-CD2 3.33Å; L535-Y539 PolarHBondContact O-N 2.87Å; L535-L632 WeakPolarHBondContact CD2-O 3.31Å
536D87.7Confident81.5Confident68 Ų6848 Ų4836%0.36426%0.264SS..Hα-helixtrans-64.7-47.4177.4-52.6-33.1000110.6R532 K533 L538 Y539 E540R532-D536 PolarHBondContact O-N 2.98Å; K533-D536 PolarHBondContact O-N 2.93Å; D536-L538 PolarHBondContact O-N 2.85Å; D536-L538 VanDerWaalsContact O-N 3.13Å; D536-Y539 PolarHBondContact O-N 3.34Å; D536-Y539 VanDerWaalsContact O-N 3.11Å; D536-E540 WeakPolarHBondContact O-CB 3.32Å; D536-E540 PolarHBondContact O-N 2.73Å
537D88.4Confident83.5Confident28 Ų2842.2 Ų42.215%0.1523%0.233CC..Hα-helixtrans-53.6-37.2172.6-78-28.2000112A442 R448 N449 K533 D541A442-D537 HydrophobicContact CB-CB 4.17Å; R448-D537 PolarHBondContact NH2-O 3.43Å; R448-D537 IonicContact NH2-OD1 3.51Å; N449-D537 PolarHBondContact ND2-OD1 3.05Å; K533-D537 WeakPolarHBondContact O-CB 3.38Å; K533-D537 VanDerWaalsContact O-CG 3.26Å; K533-D537 PolarHBondContact O-N 3.28Å; D537-D541 WeakPolarHBondContact O-CB 3.39Å; D537-D541 VanDerWaalsContact O-CG 3.24Å; D537-D541 PolarHBondContact O-N 2.92Å
538L92.2Very high85.6Confident2 Ų237.4 Ų37.41%0.0121%0.208CC..Hα-helixtrans-79.7-35-178.3-177.459.5000112.7R506 R509 L510 V534 L535 D536 E540 I542R506-L538 HydrophobicContact CB-CD1 3.81Å; R506-L538 HydrophobicContact CG-CD1 4.14Å; R509-L538 HydrophobicContact CB-CD1 4.33Å; R509-L538 HydrophobicContact CB-CD2 4.1Å; L510-L538 HydrophobicContact CB-CD2 3.64Å; L510-L538 HydrophobicContact CB-CG 4.22Å; L510-L538 HydrophobicContact CD1-CD2 4.03Å; L510-L538 HydrophobicContact CG-CD2 4.45Å; V534-L538 VanDerWaalsContact O-CB 3.28Å; V534-L538 WeakPolarHBondContact O-CB 3.47Å; V534-L538 PolarHBondContact O-N 3.45Å; L535-L538 CarbonylContact O-C 3.58Å; L535-L538 WeakPolarHBondContact O-CB 3.35Å; L535-L538 PolarHBondContact O-N 3.18Å; L535-L538 VanDerWaalsContact O-N 3.17Å; D536-L538 PolarHBondContact O-N 2.85Å; D536-L538 VanDerWaalsContact O-N 3.13Å; L538-E540 VanDerWaalsContact C-N 3.32Å; L538-I542 HydrophobicContact CD1-CD1 4.24Å; L538-I542 HydrophobicContact CD1-CG1 4.5Å; L538-I542 HydrophobicContact CG-CD1 4.16Å; L538-I542 WeakPolarHBondContact O-CB 3.41Å; L538-I542 WeakPolarHBondContact O-CD1 3.21Å; L538-I542 VanDerWaalsContact O-CG1 3.24Å; L538-I542 WeakPolarHBondContact O-CG1 3.34Å; L538-I542 PolarHBondContact O-N 3.18Å
539Y94.9Very high87.8Confident14 Ų1433.5 Ų33.56%0.05517%0.167CC..Hα-helixtrans-62.9-44.6171-73.1-44.3000110.4L510 L535 D536 I542 H543 L632 L633 S634 M637L510-Y539 HydrophobicContact CD1-CD1 4.4Å; L510-Y539 HydrophobicContact CD1-CE1 3.66Å; L510-Y539 HydrophobicContact CD2-CE1 4.12Å; L535-Y539 HydrophobicContact CB-CE2 4.47Å; L535-Y539 HydrophobicContact CD1-CE2 4.22Å; L535-Y539 HydrophobicContact CD2-CE2 3.67Å; L535-Y539 HydrophobicContact CG-CD2 4.06Å; L535-Y539 HydrophobicContact CG-CE2 3.42Å; L535-Y539 VanDerWaalsContact CG-CE2 3.42Å; L535-Y539 VanDerWaalsContact O-CD2 3.27Å; L535-Y539 WeakPolarHBondContact O-CD2 3.33Å; L535-Y539 PolarHBondContact O-N 2.87Å; D536-Y539 PolarHBondContact O-N 3.34Å; D536-Y539 VanDerWaalsContact O-N 3.11Å; Y539-I542 PolarHBondContact O-N 3.31Å; Y539-I542 VanDerWaalsContact O-N 3.16Å; Y539-H543 WeakPolarHBondContact O-CB 3.21Å; Y539-H543 PolarHBondContact O-N 3.41Å; Y539-L632 WeakPolarHBondContact CE2-O 3.29Å; Y539-L632 PolarHBondContact OH-O 3.2Å; Y539-L633 WeakPolarHBondContact OH-CA 3.09Å; Y539-S634 VanDerWaalsContact CG-CB 3.45Å; Y539-M637 HydrophobicContact CD1-CB 4.3Å; Y539-M637 HydrophobicContact CD1-CE 4.22Å; Y539-M637 HydrophobicContact CD1-SD 3.66Å; Y539-M637 HydrophobicContact CE1-CE 3.91Å; Y539-M637 HydrophobicContact CE1-SD 3.89Å
540E93.8Very high90.1Very high64 Ų6430.2 Ų30.230%0.29914%0.144SC..Hα-helixtrans-65.7-40.3178.1-16563-159.700112.2R448 D536 L538 I542 H543 W544R448-E540 VanDerWaalsContact NH1-CG 3.28Å; D536-E540 WeakPolarHBondContact O-CB 3.32Å; D536-E540 PolarHBondContact O-N 2.73Å; L538-E540 VanDerWaalsContact C-N 3.32Å; E540-I542 VanDerWaalsContact C-N 3.32Å; E540-I542 PolarHBondContact O-N 2.9Å; E540-H543 WeakPolarHBondContact O-CB 3.37Å; E540-H543 PolarHBondContact O-N 3.27Å; E540-H543 IonicContact OE1-CD2 3.56Å; E540-W544 VanDerWaalsContact O-CD1 3.27Å; E540-W544 PolarHBondContact O-N 3.39Å; E540-W544 PolarHBondContact OE1-NE1 2.83Å
541D96.3Very high91.8Very high1 Ų129.2 Ų29.21%0.00514%0.137CC..Hα-helixtrans-59.7-42.4171.9-80.36.8000112L441 A442 R448 R506 D537 L545L441-D541 WeakPolarHBondContact CA-OD1 3.26Å; L441-D541 HydrophobicContact CD2-CB 3.77Å; A442-D541 WeakPolarHBondContact CB-OD1 3.44Å; A442-D541 PolarHBondContact N-OD1 3.28Å; R448-D541 IonicContact CZ-OD1 3.04Å; R448-D541 IonicContact NH1-OD1 3.35Å; R448-D541 PolarHBondContact NH1-OD1 3.37Å; R448-D541 IonicContact NH2-OD1 3.3Å; R448-D541 PolarHBondContact NH2-OD1 3.44Å; R506-D541 HydrophobicContact CG-CB 4.21Å; R506-D541 IonicContact CZ-OD2 3.52Å; R506-D541 IonicContact NE-OD2 3.3Å; R506-D541 PolarHBondContact NE-OD2 2.88Å; R506-D541 IonicContact NH2-OD2 3.07Å; R506-D541 PolarHBondContact NH2-OD2 3.06Å; D537-D541 WeakPolarHBondContact O-CB 3.39Å; D537-D541 VanDerWaalsContact O-CG 3.24Å; D537-D541 PolarHBondContact O-N 2.92Å; D541-L545 WeakPolarHBondContact O-CB 2.91Å; D541-L545 VanDerWaalsContact O-CD1 3.29Å; D541-L545 WeakPolarHBondContact O-CD1 3.48Å; D541-L545 WeakPolarHBondContact O-CG 3.24Å; D541-L545 PolarHBondContact O-N 2.97Å
542I98.1Very high93.4Very high0 Ų024.1 Ų24.10%011%0.11CC..Hα-helixtrans-71.4-39.3179.9-69.9168.1000110.8R506 L510 L538 Y539 E540 L545 I546 T617 M637R506-I542 HydrophobicContact CB-CD1 4.22Å; R506-I542 HydrophobicContact CB-CG1 3.71Å; L510-I542 HydrophobicContact CB-CD1 4.08Å; L510-I542 HydrophobicContact CD2-CD1 3.66Å; L510-I542 HydrophobicContact CG-CD1 4.41Å; L538-I542 HydrophobicContact CD1-CD1 4.24Å; L538-I542 HydrophobicContact CD1-CG1 4.5Å; L538-I542 HydrophobicContact CG-CD1 4.16Å; L538-I542 WeakPolarHBondContact O-CB 3.41Å; L538-I542 WeakPolarHBondContact O-CD1 3.21Å; L538-I542 VanDerWaalsContact O-CG1 3.24Å; L538-I542 WeakPolarHBondContact O-CG1 3.34Å; L538-I542 PolarHBondContact O-N 3.18Å; Y539-I542 PolarHBondContact O-N 3.31Å; Y539-I542 VanDerWaalsContact O-N 3.16Å; E540-I542 VanDerWaalsContact C-N 3.32Å; E540-I542 PolarHBondContact O-N 2.9Å; I542-L545 PolarHBondContact O-N 3.38Å; I542-I546 HydrophobicContact CG2-CD1 3.62Å; I542-I546 HydrophobicContact CG2-CG1 4.16Å; I542-I546 WeakPolarHBondContact O-CB 3.45Å; I542-I546 VanDerWaalsContact O-CG1 3.29Å; I542-I546 WeakPolarHBondContact O-CG1 3.32Å; I542-I546 PolarHBondContact O-N 2.82Å; I542-T617 HydrophobicContact CG2-CG2 3.7Å; I542-M637 HydrophobicContact CD1-SD 4.37Å; I542-M637 HydrophobicContact CG2-CG 3.98Å; I542-M637 HydrophobicContact CG2-SD 3.93Å
543H97.9Very high94.4Very high3 Ų316.9 Ų16.91%0.0148%0.083CC..Hα-helixtrans-52.4-62.5176.7168.871.4000110.6D473 Y539 E540 L545 I546 L547 D640D473-H543 IonicContact OD2-CE1 3.08Å; D473-H543 IonicContact OD2-NE2 3.9Å; D473-H543 PolarHBondContact OD2-NE2 2.93Å; Y539-H543 WeakPolarHBondContact O-CB 3.21Å; Y539-H543 PolarHBondContact O-N 3.41Å; E540-H543 WeakPolarHBondContact O-CB 3.37Å; E540-H543 PolarHBondContact O-N 3.27Å; E540-H543 IonicContact OE1-CD2 3.56Å; H543-L545 VanDerWaalsContact C-N 3.31Å; H543-L545 PolarHBondContact O-N 3.43Å; H543-I546 PolarHBondContact O-N 3.25Å; H543-I546 VanDerWaalsContact O-N 3.08Å; H543-L547 VanDerWaalsContact CE1-CD1 3.44Å; H543-L547 WeakPolarHBondContact CE1-CD1 3.33Å; H543-L547 WeakPolarHBondContact NE2-CD1 3.39Å; H543-L547 WeakPolarHBondContact O-CG 3.48Å; H543-L547 PolarHBondContact O-N 2.96Å; H543-D640 WeakPolarHBondContact CA-OD2 3.13Å; H543-D640 WeakPolarHBondContact CB-OD2 3.46Å; H543-D640 IonicContact CE1-OD1 3.56Å; H543-D640 PolarHBondContact CE1-OD1 2.85Å; H543-D640 IonicContact CE1-OD2 3.7Å; H543-D640 IonicContact CG-OD2 2.74Å; H543-D640 IonicContact ND1-OD1 3.57Å; H543-D640 PolarHBondContact ND1-OD1 3.28Å; H543-D640 IonicContact ND1-OD2 3.96Å; H543-D640 PolarHBondContact ND1-OD2 3.45Å
544W98.1Very high95.1Very high13 Ų1312.9 Ų12.95%0.0497%0.066CC..Hα-helixtrans-61.6-37.1-179.4-72.7109.3000113.3H440 D473 F477 L481 E540 L547 V548H440-W544 HydrophobicContact CB-CB 4Å; H440-W544 HydrophobicContact CB-CD2 4.13Å; H440-W544 HydrophobicContact CB-CG 3.74Å; H440-W544 AromaticContact CD2-CD2 3.48Å; H440-W544 VanDerWaalsContact CD2-CD2 3.48Å; H440-W544 AromaticContact CD2-CE2 3.49Å; H440-W544 VanDerWaalsContact CD2-CE2 3.49Å; H440-W544 AromaticContact CD2-CE3 3.75Å; H440-W544 AromaticContact CD2-CH2 3.97Å; H440-W544 AromaticContact CD2-CZ2 3.75Å; H440-W544 AromaticContact CD2-CZ3 3.99Å; H440-W544 AromaticContact CD2-NE1 4Å; D473-W544 HydrophobicContact CB-CH2 3.99Å; D473-W544 HydrophobicContact CB-CZ2 4.28Å; F477-W544 AromaticContact CD2-CH2 3.6Å; F477-W544 HydrophobicContact CD2-CH2 3.6Å; F477-W544 HydrophobicContact CD2-CZ3 4.42Å; F477-W544 AromaticContact CE2-CH2 3.97Å; F477-W544 HydrophobicContact CE2-CH2 3.97Å; F477-W544 HydrophobicContact CE2-CZ2 4.49Å; F477-W544 HydrophobicContact CG-CH2 4.28Å; L481-W544 HydrophobicContact CD2-CE3 4.45Å; L481-W544 HydrophobicContact CD2-CZ3 4.3Å; E540-W544 VanDerWaalsContact O-CD1 3.27Å; E540-W544 PolarHBondContact O-N 3.39Å; E540-W544 PolarHBondContact OE1-NE1 2.83Å; W544-L547 HydrophobicContact CE3-CD1 4.22Å; W544-L547 HydrophobicContact CZ3-CD1 4.21Å; W544-L547 PolarHBondContact O-N 3.12Å; W544-V548 WeakPolarHBondContact O-CB 3.28Å; W544-V548 VanDerWaalsContact O-CG2 3.3Å; W544-V548 WeakPolarHBondContact O-CG2 3.42Å; W544-V548 PolarHBondContact O-N 3.48Å
545L98.6Very high95.2Very high1 Ų114.2 Ų14.21%0.0057%0.072CC..Hα-helixtrans-66.6-36.6176.7-71.6171.8000112.5I437 L441 L499 L502 L503 R506 D541 I542 H543 S549I437-L545 HydrophobicContact CD1-CD2 4.37Å; L441-L545 HydrophobicContact CD2-CD1 4.2Å; L441-L545 HydrophobicContact CD2-CD2 4.49Å; L441-L545 HydrophobicContact CD2-CG 4.15Å; L499-L545 HydrophobicContact CD2-CD2 3.85Å; L502-L545 HydrophobicContact CB-CD1 3.84Å; L502-L545 HydrophobicContact CB-CD2 3.91Å; L502-L545 HydrophobicContact CD1-CD2 3.98Å; L503-L545 HydrophobicContact CD2-CB 3.48Å; L503-L545 VanDerWaalsContact CD2-CB 3.48Å; L503-L545 HydrophobicContact CD2-CD1 4.06Å; L503-L545 HydrophobicContact CD2-CG 4.41Å; L503-L545 HydrophobicContact CG-CB 3.85Å; L503-L545 HydrophobicContact CG-CD1 4.21Å; R506-L545 HydrophobicContact CG-CD1 3.95Å; D541-L545 WeakPolarHBondContact O-CB 2.91Å; D541-L545 VanDerWaalsContact O-CD1 3.29Å; D541-L545 WeakPolarHBondContact O-CD1 3.48Å; D541-L545 WeakPolarHBondContact O-CG 3.24Å; D541-L545 PolarHBondContact O-N 2.97Å; I542-L545 PolarHBondContact O-N 3.38Å; H543-L545 VanDerWaalsContact C-N 3.31Å; H543-L545 PolarHBondContact O-N 3.43Å; L545-S549 WeakPolarHBondContact O-CB 3.27Å; L545-S549 PolarHBondContact O-N 2.87Å; L545-S549 PolarHBondContact O-OG 3.41Å
546I98.6Very high94.7Very high0 Ų016.7 Ų16.70%09%0.085CC..Hα-helixtrans-69-45.6175.1-71.2174.6000110.2L503 I542 H543 S549 G550 V614 T617 D640 I641 W643 F644L503-I546 HydrophobicContact CD2-CG1 4.33Å; I542-I546 HydrophobicContact CG2-CD1 3.62Å; I542-I546 HydrophobicContact CG2-CG1 4.16Å; I542-I546 WeakPolarHBondContact O-CB 3.45Å; I542-I546 VanDerWaalsContact O-CG1 3.29Å; I542-I546 WeakPolarHBondContact O-CG1 3.32Å; I542-I546 PolarHBondContact O-N 2.82Å; H543-I546 PolarHBondContact O-N 3.25Å; H543-I546 VanDerWaalsContact O-N 3.08Å; I546-S549 PolarHBondContact O-N 2.7Å; I546-G550 PolarHBondContact O-N 3.44Å; I546-V614 HydrophobicContact CD1-CG1 4.33Å; I546-V614 HydrophobicContact CG1-CG1 4.25Å; I546-V614 HydrophobicContact CG1-CG2 4.41Å; I546-T617 HydrophobicContact CD1-CG2 4.3Å; I546-D640 HydrophobicContact CB-CB 4.23Å; I546-D640 HydrophobicContact CD1-CB 4.35Å; I546-D640 HydrophobicContact CG2-CB 3.81Å; I546-I641 HydrophobicContact CD1-CG1 3.74Å; I546-W643 HydrophobicContact CG2-CZ3 4.45Å; I546-F644 HydrophobicContact CG2-CB 3.83Å; I546-F644 HydrophobicContact CG2-CD2 4.09Å; I546-F644 HydrophobicContact CG2-CG 4.23Å
547L98.4Very high93.9Very high0 Ų016.2 Ų16.20%09%0.086CC..Hα-helixtrans-58.1-53.3178.3-65.8-166.9000111.5D473 R474 L481 H543 W544 S549 G550 Y551 W643D473-L547 HydrophobicContact CB-CD1 4.29Å; R474-L547 HydrophobicContact CB-CD1 4.2Å; R474-L547 HydrophobicContact CB-CD2 3.81Å; L481-L547 HydrophobicContact CD1-CB 4.11Å; L481-L547 HydrophobicContact CD1-CD1 3.97Å; L481-L547 HydrophobicContact CD2-CB 3.96Å; H543-L547 VanDerWaalsContact CE1-CD1 3.44Å; H543-L547 WeakPolarHBondContact CE1-CD1 3.33Å; H543-L547 WeakPolarHBondContact NE2-CD1 3.39Å; H543-L547 WeakPolarHBondContact O-CG 3.48Å; H543-L547 PolarHBondContact O-N 2.96Å; W544-L547 HydrophobicContact CE3-CD1 4.22Å; W544-L547 HydrophobicContact CZ3-CD1 4.21Å; W544-L547 PolarHBondContact O-N 3.12Å; L547-S549 VanDerWaalsContact C-N 3.31Å; L547-S549 PolarHBondContact O-N 3.05Å; L547-G550 PolarHBondContact O-N 2.99Å; L547-G550 VanDerWaalsContact O-N 3.09Å; L547-Y551 WeakPolarHBondContact O-CD2 3.43Å; L547-Y551 PolarHBondContact O-N 2.93Å; L547-Y551 VanDerWaalsContact O-N 3.07Å; L547-W643 HydrophobicContact CD2-CE3 3.97Å; L547-W643 HydrophobicContact CD2-CH2 4.1Å; L547-W643 HydrophobicContact CD2-CZ3 3.71Å
548V98.5Very high92.9Very high1 Ų123.8 Ų23.81%0.00612%0.12CC..Hα-helixtrans-60.8-40.5178.4174.90000111.4F433 Y436 I437 L481 I484 L499 W544 G550 L552F433-V548 HydrophobicContact CE2-CG1 3.71Å; F433-V548 HydrophobicContact CZ-CG1 3.7Å; Y436-V548 HydrophobicContact CD1-CG2 4.11Å; Y436-V548 HydrophobicContact CE1-CG2 3.7Å; I437-V548 HydrophobicContact CD1-CB 4.49Å; I437-V548 HydrophobicContact CD1-CG1 4.19Å; I437-V548 HydrophobicContact CD1-CG2 4.32Å; L481-V548 HydrophobicContact CD2-CG2 3.95Å; I484-V548 HydrophobicContact CG2-CG1 4Å; I484-V548 HydrophobicContact CG2-CG2 4.44Å; L499-V548 HydrophobicContact CD1-CG1 4.21Å; L499-V548 HydrophobicContact CD2-CG1 4.1Å; W544-V548 WeakPolarHBondContact O-CB 3.28Å; W544-V548 VanDerWaalsContact O-CG2 3.3Å; W544-V548 WeakPolarHBondContact O-CG2 3.42Å; W544-V548 PolarHBondContact O-N 3.48Å; V548-G550 VanDerWaalsContact C-N 3.32Å; V548-G550 PolarHBondContact O-N 3.47Å; V548-L552 VanDerWaalsContact O-CB 3.26Å; V548-L552 WeakPolarHBondContact O-CB 3.25Å; V548-L552 PolarHBondContact O-N 2.89Å
549S98.5Very high91.8Very high0 Ų027.7 Ų27.70%016%0.161CC..Hα-helixtrans-63.5-38.9176.1-61.10000112L545 I546 L547 L552 L553L545-S549 WeakPolarHBondContact O-CB 3.27Å; L545-S549 PolarHBondContact O-N 2.87Å; L545-S549 PolarHBondContact O-OG 3.41Å; I546-S549 PolarHBondContact O-N 2.7Å; L547-S549 VanDerWaalsContact C-N 3.31Å; L547-S549 PolarHBondContact O-N 3.05Å; S549-L552 PolarHBondContact O-N 3.41Å; S549-L553 WeakPolarHBondContact O-CB 3.3Å; S549-L553 VanDerWaalsContact O-CG 3.27Å; S549-L553 WeakPolarHBondContact O-CG 3.42Å; S549-L553 PolarHBondContact O-N 3.16Å
550G97.4Very high91.2Very high2 Ų234.8 Ų34.82%0.02120%0.195CC..Hα-helixtrans-63.6-48.8179.400000112I546 L547 V548 L553 A554 R647I546-G550 PolarHBondContact O-N 3.44Å; L547-G550 PolarHBondContact O-N 2.99Å; L547-G550 VanDerWaalsContact O-N 3.09Å; V548-G550 VanDerWaalsContact C-N 3.32Å; V548-G550 PolarHBondContact O-N 3.47Å; G550-L553 PolarHBondContact O-N 3.11Å; G550-A554 PolarHBondContact O-N 3.17Å; G550-A554 VanDerWaalsContact O-N 3.09Å; G550-R647 VanDerWaalsContact C-NH1 3.34Å; G550-R647 PolarHBondContact O-NH1 3.36Å
551Y96.9Very high90.7Very high12 Ų1235 Ų355%0.04720%0.2CC..Hα-helixtrans-70.8-29.9177.6-81.3-88.4000113.3R474 L481 R489 L547 D556 W643 R647R474-Y551 PolarHBondContact O-OH 2.77Å; L481-Y551 HydrophobicContact CB-CD1 4.2Å; L481-Y551 HydrophobicContact CB-CD2 3.47Å; L481-Y551 VanDerWaalsContact CB-CD2 3.47Å; L481-Y551 HydrophobicContact CB-CE1 4.37Å; L481-Y551 HydrophobicContact CB-CE2 3.66Å; L481-Y551 HydrophobicContact CB-CG 3.75Å; L481-Y551 HydrophobicContact CD1-CD2 4.06Å; L481-Y551 HydrophobicContact CD1-CE2 3.71Å; L481-Y551 HydrophobicContact CG-CD2 4.26Å; L481-Y551 HydrophobicContact CG-CE2 4.31Å; L481-Y551 VanDerWaalsContact O-CB 3.32Å; L481-Y551 WeakPolarHBondContact O-CB 3.38Å; R489-Y551 PolarHBondContact NH2-O 3.3Å; L547-Y551 WeakPolarHBondContact O-CD2 3.43Å; L547-Y551 PolarHBondContact O-N 2.93Å; L547-Y551 VanDerWaalsContact O-N 3.07Å; Y551-D556 WeakPolarHBondContact CE1-OD2 3.33Å; Y551-D556 PolarHBondContact OH-OD2 3.38Å; Y551-W643 AromaticContact CD2-CH2 3.72Å; Y551-W643 HydrophobicContact CD2-CH2 3.72Å; Y551-W643 AromaticContact CD2-CZ2 3.92Å; Y551-W643 HydrophobicContact CD2-CZ2 3.92Å; Y551-W643 AromaticContact CE2-CH2 3.78Å; Y551-W643 HydrophobicContact CE2-CH2 3.78Å; Y551-W643 AromaticContact CE2-CZ2 3.54Å; Y551-W643 HydrophobicContact CE2-CZ2 3.54Å; Y551-R647 VanDerWaalsContact CA-NH1 3.34Å; Y551-R647 VanDerWaalsContact CD2-NH1 3.31Å
552L97.9Very high90.4Very high0 Ų035.8 Ų35.80%021%0.205CC..Hα-helixtrans-66.7-44.5173-173.6154.9000111.3F433 R489 C495 I496 L499 V548 S549 V568F433-L552 HydrophobicContact CE2-CD1 4.19Å; F433-L552 HydrophobicContact CZ-CD1 4.35Å; R489-L552 WeakPolarHBondContact CG-O 3.24Å; R489-L552 PolarHBondContact NE-O 2.83Å; C495-L552 HydrophobicContact CB-CD1 4.08Å; I496-L552 HydrophobicContact CD1-CD2 4.06Å; I496-L552 HydrophobicContact CG1-CD1 4.42Å; I496-L552 HydrophobicContact CG1-CD2 3.7Å; L499-L552 HydrophobicContact CD1-CD1 3.82Å; V548-L552 VanDerWaalsContact O-CB 3.26Å; V548-L552 WeakPolarHBondContact O-CB 3.25Å; V548-L552 PolarHBondContact O-N 2.89Å; S549-L552 PolarHBondContact O-N 3.41Å; L552-V568 HydrophobicContact CD2-CG2 4.45Å
553L97.6Very high90.1Very high4 Ų440.3 Ų40.32%0.02123%0.228CC..Hα-helixtrans-84.1-24.7-170.7-70.6173.2000114.2S549 G550 P565 V568 V607 L610 L611 F644 Y652S549-L553 WeakPolarHBondContact O-CB 3.3Å; S549-L553 VanDerWaalsContact O-CG 3.27Å; S549-L553 WeakPolarHBondContact O-CG 3.42Å; S549-L553 PolarHBondContact O-N 3.16Å; G550-L553 PolarHBondContact O-N 3.11Å; L553-P565 WeakPolarHBondContact O-CD 3.36Å; L553-V568 HydrophobicContact CD2-CG1 4.2Å; L553-V607 HydrophobicContact CD2-CG1 3.82Å; L553-L610 HydrophobicContact CD1-CD2 3.87Å; L553-L610 HydrophobicContact CD1-CG 4.03Å; L553-L610 HydrophobicContact CD2-CD2 4.21Å; L553-L610 HydrophobicContact CG-CD2 4.12Å; L553-L611 HydrophobicContact CD1-CD2 3.76Å; L553-L611 HydrophobicContact CD1-CG 4.08Å; L553-F644 HydrophobicContact CD1-CE2 4.21Å; L553-F644 HydrophobicContact CD1-CZ 3.84Å; L553-Y652 HydrophobicContact CB-CE2 4.18Å; L553-Y652 WeakPolarHBondContact O-CE2 3.5Å; L553-Y652 VanDerWaalsContact O-CZ 3.29Å; L553-Y652 PolarHBondContact O-OH 2.82Å
554A94.1Very high89.9Confident2 Ų240.5 Ų40.52%0.01723%0.229CC..  trans-152.4157.2-177.900000111.9R489 G550 R647 Y652R489-A554 VanDerWaalsContact NH2-C 3.35Å; R489-A554 PolarHBondContact NH2-O 2.95Å; G550-A554 PolarHBondContact O-N 3.17Å; G550-A554 VanDerWaalsContact O-N 3.09Å; A554-R647 HydrophobicContact CB-CG 3.82Å; A554-R647 PolarHBondContact O-NE 3.13Å; A554-R647 PolarHBondContact O-NH2 2.85Å; A554-Y652 HydrophobicContact CB-CE2 4.38Å
555D88.1Confident89.8Confident68 Ų6840.2 Ų40.236%0.36423%0.229SC..  trans-90167.2172.7-65.4-43.8000111.8R489 R647R489-D555 IonicContact CZ-OD1 2.63Å; R489-D555 IonicContact NH1-OD1 3.4Å; R489-D555 PolarHBondContact NH1-OD1 3.27Å; R489-D555 IonicContact NH1-OD2 2.92Å; R489-D555 PolarHBondContact NH1-OD2 2.73Å; R489-D555 IonicContact NH2-OD1 3.66Å; R489-D555 PolarHBondContact NH2-OD1 3.32Å; D555-R647 PolarHBondContact O-NE 2.88Å
556D77.1Confident89.5Confident68 Ų6844.1 Ų44.136%0.36426%0.256SS..  trans-79.6139.7171.8-72.8-39.4000111.1Y551 Q558 R647Y551-D556 WeakPolarHBondContact CE1-OD2 3.33Å; Y551-D556 PolarHBondContact OH-OD2 3.38Å; D556-Q558 PolarHBondContact O-N 2.86Å; D556-R647 VanDerWaalsContact N-NH2 3.1Å; D556-R647 IonicContact OD1-CZ 3.28Å; D556-R647 VanDerWaalsContact OD1-CZ 3.23Å; D556-R647 IonicContact OD1-NE 3.95Å; D556-R647 IonicContact OD1-NH1 2.83Å; D556-R647 IonicContact OD1-NH2 3.23Å; D556-R647 PolarHBondContact OD1-NH2 3.24Å; D556-R647 IonicContact OD2-NH2 2.78Å; D556-R647 PolarHBondContact OD2-NH2 2.98Å
557P71.4Confident89.3Confident58 Ų5847.2 Ų47.238%0.37727%0.27SS..  trans-72.995.2179.229.7-33.6000110.6G559 P562 K650P557-G559 PolarHBondContact O-N 2.81Å; P557-G559 VanDerWaalsContact O-N 3.07Å; P557-P562 HydrophobicContact CB-CG 4.39Å; P557-K650 HydrophobicContact CG-CD 4.28Å
558Q66.2Low89.3Confident186 Ų18647.2 Ų47.287%0.86927%0.27SS*.SBendtrans-84.159.5173.1-63.7-172.11.200111.6D556 E560D556-Q558 PolarHBondContact O-N 2.86Å; Q558-E560 PolarHBondContact O-N 2.85Å
559G70.3Confident89.1Confident84 Ų8447.6 Ų47.687%0.86627%0.272SS*.SBendtrans78.3-7.4179.700000115.8P557P557-G559 PolarHBondContact O-N 2.81Å; P557-G559 VanDerWaalsContact O-N 3.07Å
560E80.6Confident89Confident164 Ų16454 Ų5477%0.76630%0.302SS*.SBendtrans-109.7169.5175.5-62.6-172.1170.600112.2Q558 P562Q558-E560 PolarHBondContact O-N 2.85Å; E560-P562 WeakPolarHBondContact O-CD 3.31Å
561T84.3Confident88.9Confident67 Ų6754.5 Ų54.541%0.41130%0.304SS..PPolyproline II helixtrans-74.7119.1172.1-70.20000108.9K716T561-K716 VanDerWaalsContact CG2-NZ 3.28Å; T561-K716 PolarHBondContact OG1-NZ 2.97Å
562P89Confident88.9Confident18 Ų1854 Ų5412%0.11730%0.302CS..PPolyproline II helixtrans-67.8136.8179.229-34000110.2P557 E560 K650P557-P562 HydrophobicContact CB-CG 4.39Å; E560-P562 WeakPolarHBondContact O-CD 3.31Å; P562-K650 HydrophobicContact CG-CB 3.7Å
563M91.6Very high88.9Confident96 Ų9656.3 Ų56.347%0.47331%0.314SS..PPolyproline II helixtrans-100.2161174.3-61.3-166.7-61.600110.3L659 Y660M563-L659 HydrophobicContact SD-CB 4.12Å; M563-Y660 WeakPolarHBondContact CA-OH 3.38Å; M563-Y660 HydrophobicContact CB-CE1 4.11Å
564I95.6Very high88.7Confident6 Ų661.8 Ų61.83%0.03134%0.338CS..PPolyproline II helixtrans-64.4126.3166.9-61.5171.4000107.2S566 V568 M569 S651 Y652 V655 Y660I564-S566 PolarHBondContact O-N 3.1Å; I564-V568 HydrophobicContact CG2-CB 4.27Å; I564-V568 HydrophobicContact CG2-CG1 4.29Å; I564-M569 HydrophobicContact CB-CE 4.19Å; I564-M569 HydrophobicContact CD1-CE 3.71Å; I564-M569 HydrophobicContact CG2-CB 4.33Å; I564-M569 HydrophobicContact CG2-CE 4.16Å; I564-S651 WeakPolarHBondContact CG1-O 3.36Å; I564-Y652 HydrophobicContact CB-CE1 4.41Å; I564-Y652 HydrophobicContact CD1-CD1 3.53Å; I564-Y652 HydrophobicContact CD1-CE1 3.74Å; I564-Y652 HydrophobicContact CD1-CG 4.17Å; I564-Y652 HydrophobicContact CG1-CD1 3.78Å; I564-Y652 HydrophobicContact CG1-CD2 4.42Å; I564-Y652 HydrophobicContact CG1-CE1 3.73Å; I564-Y652 HydrophobicContact CG1-CE2 4.36Å; I564-Y652 HydrophobicContact CG1-CG 4.12Å; I564-Y652 HydrophobicContact CG2-CE1 3.83Å; I564-V655 HydrophobicContact CD1-CG2 4.19Å; I564-Y660 HydrophobicContact CB-CE1 4.01Å; I564-Y660 PolarHBondContact N-OH 3.08Å
565P95Very high88.7Confident7 Ų763.6 Ų63.65%0.04535%0.345CS..PPolyproline II helixtrans-53.7139.4178.5-26.234.3000111.8R489 L553 E567 V568 M569R489-P565 VanDerWaalsContact CZ-CG 3.42Å; L553-P565 WeakPolarHBondContact O-CD 3.36Å; P565-E567 VanDerWaalsContact C-N 3.26Å; P565-E567 PolarHBondContact O-N 3.22Å; P565-V568 HydrophobicContact CB-CB 4.49Å; P565-V568 HydrophobicContact CB-CG2 4.11Å; P565-V568 HydrophobicContact CG-CG2 4.42Å; P565-V568 PolarHBondContact O-N 3.23Å; P565-M569 PolarHBondContact O-N 3.3Å
566S93.1Very high88.9Confident84 Ų8461.8 Ų61.859%0.58734%0.338SS*.Hα-helixtrans-58.2-38.5-170.564.50000113I564 M569 E570I564-S566 PolarHBondContact O-N 3.1Å; S566-M569 PolarHBondContact O-N 3.01Å; S566-E570 WeakPolarHBondContact O-CB 3.36Å; S566-E570 PolarHBondContact O-N 3.43Å
567E94.2Very high89.5Confident64 Ų6464.2 Ų64.230%0.29936%0.356SS..Hα-helixtrans-67.4-38.1-180-58.186.7158.700111.3R489 P565 F571R489-E567 HydrophobicContact CB-CB 3.94Å; R489-E567 HydrophobicContact CB-CG 4.19Å; P565-E567 VanDerWaalsContact C-N 3.26Å; P565-E567 PolarHBondContact O-N 3.22Å; E567-F571 WeakPolarHBondContact O-CB 3.41Å; E567-F571 PolarHBondContact O-N 3.16Å
568V96.9Very high90.5Very high0 Ų067.3 Ų67.30%037%0.365CS..Hα-helixtrans-70.1-41.6177179.50000110.2R489 L552 L553 I564 P565 S572 V607R489-V568 HydrophobicContact CG-CG2 4.18Å; L552-V568 HydrophobicContact CD2-CG2 4.45Å; L553-V568 HydrophobicContact CD2-CG1 4.2Å; I564-V568 HydrophobicContact CG2-CB 4.27Å; I564-V568 HydrophobicContact CG2-CG1 4.29Å; P565-V568 HydrophobicContact CB-CB 4.49Å; P565-V568 HydrophobicContact CB-CG2 4.11Å; P565-V568 HydrophobicContact CG-CG2 4.42Å; P565-V568 PolarHBondContact O-N 3.23Å; V568-S572 PolarHBondContact O-N 3.37Å; V568-V607 HydrophobicContact CG1-CB 4.36Å; V568-V607 HydrophobicContact CG1-CG1 3.68Å; V568-V607 HydrophobicContact CG1-CG2 3.69Å
569M96.3Very high91.9Very high9 Ų959.3 Ų59.34%0.04433%0.329CS..Hα-helixtrans-63.6-48.1174.3-174.959.972.300111.2I564 P565 S566 F571 S572 I573 Y660 I663 S664 L667I564-M569 HydrophobicContact CB-CE 4.19Å; I564-M569 HydrophobicContact CD1-CE 3.71Å; I564-M569 HydrophobicContact CG2-CB 4.33Å; I564-M569 HydrophobicContact CG2-CE 4.16Å; P565-M569 PolarHBondContact O-N 3.3Å; S566-M569 PolarHBondContact O-N 3.01Å; M569-F571 VanDerWaalsContact C-N 3.33Å; M569-F571 PolarHBondContact O-N 3.02Å; M569-S572 PolarHBondContact O-N 3.21Å; M569-I573 HydrophobicContact CG-CD1 3.9Å; M569-I573 HydrophobicContact CG-CG1 4.48Å; M569-I573 VanDerWaalsContact O-CG1 3.29Å; M569-I573 WeakPolarHBondContact O-CG1 3.27Å; M569-I573 PolarHBondContact O-N 2.99Å; M569-I573 HydrophobicContact SD-CD1 4.39Å; M569-I573 HydrophobicContact SD-CG1 4.5Å; M569-Y660 HydrophobicContact CE-CD1 4.2Å; M569-Y660 HydrophobicContact CE-CE1 4.27Å; M569-I663 HydrophobicContact CE-CB 4.46Å; M569-I663 HydrophobicContact CE-CG1 4.3Å; M569-I663 HydrophobicContact CE-CG2 4.02Å; M569-I663 HydrophobicContact SD-CB 4.38Å; M569-I663 HydrophobicContact SD-CG2 4.13Å; M569-S664 PolarHBondContact SD-N 3.26Å; M569-L667 HydrophobicContact CE-CD1 3.9Å; M569-L667 HydrophobicContact SD-CD1 3.76Å
570E94.8Very high93.1Very high134 Ų13457.9 Ų57.963%0.62630%0.302SS*.Hα-helixtrans-60.9-42.3177.8-172178.2-178.200111.4S566 S572 I573 K574S566-E570 WeakPolarHBondContact O-CB 3.36Å; S566-E570 PolarHBondContact O-N 3.43Å; E570-S572 PolarHBondContact O-N 3.08Å; E570-I573 PolarHBondContact O-N 3.1Å; E570-K574 VanDerWaalsContact O-CB 3.29Å; E570-K574 WeakPolarHBondContact O-CB 3.4Å; E570-K574 PolarHBondContact O-N 3.21Å
571F96.2Very high93.8Very high14 Ų1452.6 Ų52.66%0.06128%0.278CS..Hα-helixtrans-58-45.8174.7172.4-97000111.9A492 D493 I496 E567 M569 H575 V607A492-F571 HydrophobicContact CB-CB 4.19Å; A492-F571 HydrophobicContact CB-CD2 4.06Å; A492-F571 HydrophobicContact CB-CG 4.06Å; D493-F571 HydrophobicContact CB-CE2 4.46Å; I496-F571 HydrophobicContact CD1-CD1 3.9Å; I496-F571 HydrophobicContact CD1-CE1 4.03Å; E567-F571 WeakPolarHBondContact O-CB 3.41Å; E567-F571 PolarHBondContact O-N 3.16Å; M569-F571 VanDerWaalsContact C-N 3.33Å; M569-F571 PolarHBondContact O-N 3.02Å; F571-H575 AromaticContact CD2-CE1 3.5Å; F571-H575 VanDerWaalsContact CD2-CE1 3.5Å; F571-H575 WeakPolarHBondContact CD2-CE1 3.47Å; F571-H575 AromaticContact CD2-ND1 3.56Å; F571-H575 AromaticContact CE2-CE1 3.3Å; F571-H575 WeakPolarHBondContact CE2-CE1 3.5Å; F571-H575 AromaticContact CE2-ND1 3.42Å; F571-H575 WeakPolarHBondContact CE2-ND1 3.07Å; F571-H575 AromaticContact CZ-ND1 3.9Å; F571-H575 PolarHBondContact O-N 2.75Å; F571-H575 PolarHBondContact O-ND1 2.86Å; F571-V607 HydrophobicContact CD1-CG2 3.81Å; F571-V607 HydrophobicContact CE1-CG2 4.14Å
572S97.1Very high94.3Very high0 Ų055 Ų550%029%0.289CS..Hα-helixtrans-67.7-38.7176.6-176.10000112.2V568 M569 E570 H575 S576 D605 S664V568-S572 PolarHBondContact O-N 3.37Å; M569-S572 PolarHBondContact O-N 3.21Å; E570-S572 PolarHBondContact O-N 3.08Å; S572-H575 PolarHBondContact O-N 2.92Å; S572-S576 WeakPolarHBondContact O-CB 3.44Å; S572-S576 PolarHBondContact O-N 3.14Å; S572-D605 WeakPolarHBondContact CB-OD2 3.08Å; S572-D605 PolarHBondContact OG-OD2 2.86Å; S572-S664 VanDerWaalsContact OG-CB 3.24Å; S572-S664 WeakPolarHBondContact OG-CB 3.27Å; S572-S664 PolarHBondContact OG-OG 3.48Å
573I96.8Very high94.6Very high50 Ų5054.9 Ų54.926%0.25629%0.287SS..Hα-helixtrans-60.8-49175.4-69.9168.6000110.5M569 E570 H575 S576 Q662M569-I573 HydrophobicContact CG-CD1 3.9Å; M569-I573 HydrophobicContact CG-CG1 4.48Å; M569-I573 VanDerWaalsContact O-CG1 3.29Å; M569-I573 WeakPolarHBondContact O-CG1 3.27Å; M569-I573 PolarHBondContact O-N 2.99Å; M569-I573 HydrophobicContact SD-CD1 4.39Å; M569-I573 HydrophobicContact SD-CG1 4.5Å; E570-I573 PolarHBondContact O-N 3.1Å; I573-H575 VanDerWaalsContact C-N 3.3Å; I573-H575 PolarHBondContact O-N 3.19Å; I573-S576 WeakPolarHBondContact O-CB 3.26Å; I573-S576 PolarHBondContact O-N 2.71Å; I573-S576 PolarHBondContact O-OG 2.83Å; I573-Q662 HydrophobicContact CD1-CB 3.92Å
574K95.1Very high94.8Very high119 Ų11950.4 Ų50.452%0.51727%0.266SS..Hα-helixtrans-57.1-40.5-178.7-179.4-176.8167.7-158.60112.4D493 E570D493-K574 IonicContact OD1-NZ 2.73Å; D493-K574 PolarHBondContact OD1-NZ 2.75Å; D493-K574 IonicContact OD2-NZ 3.63Å; D493-K574 PolarHBondContact OD2-NZ 3.38Å; E570-K574 VanDerWaalsContact O-CB 3.29Å; E570-K574 WeakPolarHBondContact O-CB 3.4Å; E570-K574 PolarHBondContact O-N 3.21Å
575H93.7Very high94.9Very high39 Ų3953 Ų5318%0.18128%0.279CS..Hα-helixtrans-95.8-2-177.4-58.995.2000114.3D493 F571 S572 I573 T577 E578D493-H575 IonicContact OD1-CE1 3.56Å; D493-H575 PolarHBondContact OD1-CE1 3.39Å; D493-H575 IonicContact OD1-NE2 2.9Å; D493-H575 PolarHBondContact OD1-NE2 3.31Å; F571-H575 AromaticContact CD2-CE1 3.5Å; F571-H575 VanDerWaalsContact CD2-CE1 3.5Å; F571-H575 WeakPolarHBondContact CD2-CE1 3.47Å; F571-H575 AromaticContact CD2-ND1 3.56Å; F571-H575 AromaticContact CE2-CE1 3.3Å; F571-H575 WeakPolarHBondContact CE2-CE1 3.5Å; F571-H575 AromaticContact CE2-ND1 3.42Å; F571-H575 WeakPolarHBondContact CE2-ND1 3.07Å; F571-H575 AromaticContact CZ-ND1 3.9Å; F571-H575 PolarHBondContact O-N 2.75Å; F571-H575 PolarHBondContact O-ND1 2.86Å; S572-H575 PolarHBondContact O-N 2.92Å; I573-H575 VanDerWaalsContact C-N 3.3Å; I573-H575 PolarHBondContact O-N 3.19Å; H575-T577 PolarHBondContact O-N 3.19Å; H575-E578 IonicContact CD2-OE2 3.39Å; H575-E578 PolarHBondContact O-N 3.36Å
576S91.8Very high94.9Very high30 Ų3057.2 Ų57.221%0.2130%0.298CS..THydrogen-bonded Turntrans-55.3-27.8-175.662.70000114.5S572 I573S572-S576 WeakPolarHBondContact O-CB 3.44Å; S572-S576 PolarHBondContact O-N 3.14Å; I573-S576 WeakPolarHBondContact O-CB 3.26Å; I573-S576 PolarHBondContact O-N 2.71Å; I573-S576 PolarHBondContact O-OG 2.83Å
577T90.6Very high95Very high120 Ų12053.3 Ų53.374%0.73627%0.271SS*.THydrogen-bonded Turntrans-79.2-17.4178.963.80000114.2H575H575-T577 PolarHBondContact O-N 3.19Å
578E92.4Very high95.1Very high122 Ų12250.3 Ų50.357%0.5726%0.257SS*.THydrogen-bonded Turntrans-91.5-19.2-177.7-56.8-177171.900111.8H575 R603H575-E578 IonicContact CD2-OE2 3.39Å; H575-E578 PolarHBondContact O-N 3.36Å; E578-R603 PolarHBondContact O-NE 2.82Å; E578-R603 PolarHBondContact O-NH2 3.08Å
579V94.8Very high95Very high19 Ų1952.2 Ų52.212%0.11528%0.276CS..  trans-88.2142.6-174.9172.80000112.5T584 R603 D605 P666V579-T584 WeakPolarHBondContact CG1-OG1 3.22Å; V579-R603 CarbonylContact C-O 3.33Å; V579-R603 WeakPolarHBondContact CA-O 3.29Å; V579-D605 HydrophobicContact CG1-CB 4.11Å; V579-D605 VanDerWaalsContact CG1-N 3.27Å; V579-D605 HydrophobicContact CG2-CB 4.3Å; V579-P666 HydrophobicContact CG1-CG 4.35Å
580D96.1Very high94.9Very high54 Ų5452.8 Ų52.829%0.28928%0.281SS..  trans-97116.6163.5179.260.7000110.2N582 T583 T584 R603D580-N582 VanDerWaalsContact C-N 3.34Å; D580-N582 PolarHBondContact O-N 2.75Å; D580-T583 PolarHBondContact O-N 3.38Å; D580-T583 VanDerWaalsContact OD2-CB 3.31Å; D580-T583 WeakPolarHBondContact OD2-CB 3.31Å; D580-T583 PolarHBondContact OD2-N 2.99Å; D580-T583 PolarHBondContact OD2-OG1 3.48Å; D580-T584 PolarHBondContact O-N 3.46Å; D580-T584 PolarHBondContact O-OG1 3.44Å; D580-R603 PolarHBondContact N-O 2.97Å
581I94.3Very high94.9Very high53 Ų5347 Ų4727%0.27226%0.255SS..Hα-helixtrans-64.8-39.3-175-61.7162.4000110.8T583 T584 L585 I665 T669I581-T583 PolarHBondContact O-N 2.93Å; I581-T584 WeakPolarHBondContact O-CB 3.37Å; I581-T584 PolarHBondContact O-N 2.92Å; I581-T584 VanDerWaalsContact O-N 3.17Å; I581-L585 HydrophobicContact CG2-CD1 4.06Å; I581-L585 HydrophobicContact CG2-CG 4.28Å; I581-L585 WeakPolarHBondContact O-CG 3.33Å; I581-L585 PolarHBondContact O-N 3.45Å; I581-I665 HydrophobicContact CD1-CB 4.49Å; I581-I665 HydrophobicContact CD1-CG2 3.52Å; I581-T669 HydrophobicContact CG2-CG2 4.49Å; I581-T669 WeakPolarHBondContact CG2-OG1 3.48Å
582N94.8Very high94.7Very high118 Ų11847.4 Ų47.463%0.63126%0.263SS*.Hα-helixtrans-64-44.7-179.1-63.3-48.5000111.6D580 T584 L585 Q586D580-N582 VanDerWaalsContact C-N 3.34Å; D580-N582 PolarHBondContact O-N 2.75Å; N582-T584 VanDerWaalsContact C-N 3.3Å; N582-T584 PolarHBondContact O-N 3.35Å; N582-L585 PolarHBondContact O-N 3.03Å; N582-Q586 WeakPolarHBondContact O-CB 3.44Å; N582-Q586 PolarHBondContact O-N 2.65Å
583T95.9Very high94.4Very high15 Ų1552.7 Ų52.79%0.09229%0.288CS..Hα-helixtrans-64.2-37.4175-53.80000111.3D580 I581 Q586 I587 I598 P599 T604D580-T583 PolarHBondContact O-N 3.38Å; D580-T583 VanDerWaalsContact OD2-CB 3.31Å; D580-T583 WeakPolarHBondContact OD2-CB 3.31Å; D580-T583 PolarHBondContact OD2-N 2.99Å; D580-T583 PolarHBondContact OD2-OG1 3.48Å; I581-T583 PolarHBondContact O-N 2.93Å; T583-Q586 PolarHBondContact O-N 3.29Å; T583-I587 WeakPolarHBondContact O-CG1 3.33Å; T583-I587 PolarHBondContact O-N 3.09Å; T583-I598 HydrophobicContact CG2-CG2 4.14Å; T583-P599 WeakPolarHBondContact CG2-O 3.39Å; T583-T604 HydrophobicContact CG2-CG2 3.76Å
584T96.5Very high94.2Very high2 Ų255.3 Ų55.31%0.01230%0.298CS..Hα-helixtrans-62.9-47.2176-57.40000111.8V579 D580 I581 N582 Q586 I587 L588 T604 D605 I608V579-T584 WeakPolarHBondContact CG1-OG1 3.22Å; D580-T584 PolarHBondContact O-N 3.46Å; D580-T584 PolarHBondContact O-OG1 3.44Å; I581-T584 WeakPolarHBondContact O-CB 3.37Å; I581-T584 PolarHBondContact O-N 2.92Å; I581-T584 VanDerWaalsContact O-N 3.17Å; N582-T584 VanDerWaalsContact C-N 3.3Å; N582-T584 PolarHBondContact O-N 3.35Å; T584-Q586 VanDerWaalsContact C-N 3.3Å; T584-Q586 PolarHBondContact O-N 3.05Å; T584-I587 WeakPolarHBondContact O-CB 3.36Å; T584-I587 PolarHBondContact O-N 2.97Å; T584-L588 PolarHBondContact O-N 3.05Å; T584-T604 WeakPolarHBondContact OG1-CA 3.48Å; T584-D605 HydrophobicContact CG2-CB 3.94Å; T584-D605 PolarHBondContact OG1-N 3.23Å; T584-I608 HydrophobicContact CG2-CB 3.81Å; T584-I608 HydrophobicContact CG2-CD1 3.65Å; T584-I608 HydrophobicContact CG2-CG1 4.31Å; T584-I608 HydrophobicContact CG2-CG2 3.7Å
585L95.9Very high94Very high61 Ų6149.8 Ų49.832%0.31927%0.274SS..Hα-helixtrans-64.6-34.8175.1-68175.2000111.9I581 N582 L588 G589 A670I581-L585 HydrophobicContact CG2-CD1 4.06Å; I581-L585 HydrophobicContact CG2-CG 4.28Å; I581-L585 WeakPolarHBondContact O-CG 3.33Å; I581-L585 PolarHBondContact O-N 3.45Å; N582-L585 PolarHBondContact O-N 3.03Å; L585-L588 PolarHBondContact O-N 2.94Å; L585-G589 PolarHBondContact O-N 2.89Å; L585-A670 HydrophobicContact CD2-CB 3.79Å
586Q95.4Very high93.9Very high95 Ų9551.8 Ų51.844%0.44429%0.292SS..Hα-helixtrans-64.6-42.7173.7-171.6178.8-100111.4N582 T583 T584 L588 G589 S590 I598N582-Q586 WeakPolarHBondContact O-CB 3.44Å; N582-Q586 PolarHBondContact O-N 2.65Å; T583-Q586 PolarHBondContact O-N 3.29Å; T584-Q586 VanDerWaalsContact C-N 3.3Å; T584-Q586 PolarHBondContact O-N 3.05Å; Q586-L588 VanDerWaalsContact C-N 3.33Å; Q586-L588 PolarHBondContact O-N 3.35Å; Q586-G589 PolarHBondContact O-N 2.85Å; Q586-S590 WeakPolarHBondContact O-CB 3.44Å; Q586-S590 PolarHBondContact O-N 3.07Å; Q586-S590 VanDerWaalsContact O-N 3.14Å; Q586-S590 PolarHBondContact O-OG 3.42Å; Q586-I598 HydrophobicContact CB-CG2 4.5Å; Q586-I598 HydrophobicContact CG-CD1 4.22Å; Q586-I598 HydrophobicContact CG-CG2 4.09Å
587I95.5Very high93.9Very high1 Ų153.9 Ų53.91%0.00531%0.307CS..Hα-helixtrans-61.3-41.6175.8-73.4-84.7000111.6T583 T584 A595 I598 C601 T604 R609 R616T583-I587 WeakPolarHBondContact O-CG1 3.33Å; T583-I587 PolarHBondContact O-N 3.09Å; T584-I587 WeakPolarHBondContact O-CB 3.36Å; T584-I587 PolarHBondContact O-N 2.97Å; I587-A595 HydrophobicContact CD1-CB 3.71Å; I587-I598 HydrophobicContact CD1-CB 3.99Å; I587-I598 HydrophobicContact CD1-CD1 3.54Å; I587-I598 HydrophobicContact CD1-CG1 4.11Å; I587-I598 HydrophobicContact CD1-CG2 4.43Å; I587-I598 HydrophobicContact CG1-CD1 3.95Å; I587-I598 HydrophobicContact CG1-CG2 4.46Å; I587-C601 HydrophobicContact CD1-CB 4.23Å; I587-T604 HydrophobicContact CG1-CG2 3.87Å; I587-R609 HydrophobicContact CG2-CG 4.35Å; I587-R616 PolarHBondContact O-NH1 3.2Å; I587-R616 VanDerWaalsContact O-NH1 3.1Å; I587-R616 PolarHBondContact O-NH2 2.82Å
588L96.1Very high94Very high2 Ų248.3 Ų48.31%0.0127%0.273CS..Hα-helixtrans-66.8-50.1177176.562.7000111.7T584 L585 Q586 S590 I608 S612 L615 W648 A670 F671 W680 I681T584-L588 PolarHBondContact O-N 3.05Å; L585-L588 PolarHBondContact O-N 2.94Å; Q586-L588 VanDerWaalsContact C-N 3.33Å; Q586-L588 PolarHBondContact O-N 3.35Å; L588-S590 VanDerWaalsContact C-N 3.25Å; L588-S590 PolarHBondContact O-N 3.3Å; L588-I608 HydrophobicContact CB-CG2 4.07Å; L588-I608 HydrophobicContact CD1-CG2 4.45Å; L588-I608 HydrophobicContact CD2-CG2 4.3Å; L588-S612 WeakPolarHBondContact CA-OG 3.5Å; L588-L615 HydrophobicContact CD1-CD2 4.26Å; L588-W648 HydrophobicContact CD1-CH2 3.89Å; L588-W648 HydrophobicContact CD1-CZ2 4.12Å; L588-A670 HydrophobicContact CD2-CB 3.99Å; L588-F671 HydrophobicContact CD1-CE1 4.46Å; L588-F671 HydrophobicContact CD2-CE1 3.85Å; L588-F671 HydrophobicContact CD2-CZ 4.46Å; L588-W680 HydrophobicContact CD1-CZ3 4.45Å; L588-W680 HydrophobicContact CG-CZ3 4.34Å; L588-W680 VanDerWaalsContact O-CH2 3.24Å; L588-W680 WeakPolarHBondContact O-CH2 3.38Å; L588-W680 WeakPolarHBondContact O-CZ3 3.16Å; L588-I681 HydrophobicContact CD2-CD1 4.33Å
589G95Very high93.9Very high39 Ų3947.4 Ų47.440%0.40228%0.278SS..Hα-helixtrans-77.10.1-176.100000115.5L585 Q586 P591L585-G589 PolarHBondContact O-N 2.89Å; Q586-G589 PolarHBondContact O-N 2.85Å; G589-P591 VanDerWaalsContact C-CD 3.42Å
590S95.1Very high93.6Very high22 Ų2248.6 Ų48.615%0.15429%0.293CS..  trans-127.957.9178.363.70000113Q586 L588 G592 E593 I598 R616Q586-S590 WeakPolarHBondContact O-CB 3.44Å; Q586-S590 PolarHBondContact O-N 3.07Å; Q586-S590 VanDerWaalsContact O-N 3.14Å; Q586-S590 PolarHBondContact O-OG 3.42Å; L588-S590 VanDerWaalsContact C-N 3.25Å; L588-S590 PolarHBondContact O-N 3.3Å; S590-G592 PolarHBondContact O-N 2.83Å; S590-E593 PolarHBondContact O-N 2.86Å; S590-E593 VanDerWaalsContact O-N 3.09Å; S590-I598 WeakPolarHBondContact OG-CD1 3.31Å; S590-R616 PolarHBondContact O-NH2 3.33Å; S590-R616 VanDerWaalsContact O-NH2 3.14Å
591P94.6Very high93.2Very high12 Ų1246.8 Ų46.88%0.07829%0.285CS..THydrogen-bonded Turntrans-64.4-10.9177.531-37000112.5G589 L615 R616 E619 W680 Y684G589-P591 VanDerWaalsContact C-CD 3.42Å; P591-L615 HydrophobicContact CB-CB 4.26Å; P591-L615 HydrophobicContact CB-CD2 4.07Å; P591-L615 HydrophobicContact CB-CG 3.91Å; P591-L615 HydrophobicContact CG-CD2 4.17Å; P591-L615 HydrophobicContact CG-CG 4.29Å; P591-R616 HydrophobicContact CB-CG 4.24Å; P591-R616 VanDerWaalsContact O-CG 3.27Å; P591-R616 WeakPolarHBondContact O-CG 3.32Å; P591-E619 HydrophobicContact CB-CB 4.04Å; P591-E619 HydrophobicContact CB-CG 4.48Å; P591-E619 HydrophobicContact CG-CB 4.41Å; P591-W680 HydrophobicContact CG-CH2 3.96Å; P591-W680 HydrophobicContact CG-CZ2 4.28Å; P591-Y684 HydrophobicContact CG-CE2 4Å
592G90.8Very high93Very high23 Ų2351.1 Ų51.124%0.23731%0.309CS..THydrogen-bonded Turntrans-79.3-15.6175.200000116.1S590 R623S590-G592 PolarHBondContact O-N 2.83Å; G592-R623 VanDerWaalsContact CA-CZ 3.48Å; G592-R623 PolarHBondContact O-NH1 2.9Å; G592-R623 PolarHBondContact O-NH2 3.34Å
593E91.3Very high93Very high111 Ų11152.4 Ų52.452%0.51931%0.305SS..SBendtrans-112.3153.7-176.7-64.2-173.8-17900111S590 A595 R616S590-E593 PolarHBondContact O-N 2.86Å; S590-E593 VanDerWaalsContact O-N 3.09Å; E593-A595 PolarHBondContact O-N 3.32Å; E593-R616 PolarHBondContact O-NE 3.46Å; E593-R616 PolarHBondContact O-NH2 3.43Å
594K91.7Very high93Very high105 Ų10552.1 Ų52.146%0.45730%0.303SS..  trans-65131.7174.5-60.3-167.3177.2-169.50109.1N508 S596 S597N508-K594 VanDerWaalsContact OD1-CD 3.27Å; N508-K594 WeakPolarHBondContact OD1-CD 3.18Å; N508-K594 WeakPolarHBondContact OD1-CE 3.45Å; N508-K594 WeakPolarHBondContact OD1-CG 3.27Å; K594-S596 PolarHBondContact O-N 2.86Å; K594-S597 PolarHBondContact O-N 2.96Å; K594-S597 PolarHBondContact O-OG 3.04Å
595A91.1Very high93Very high2 Ų252.1 Ų52.12%0.01730%0.303CS..G310 helixtrans-56-38.4176.300000111.8E504 I587 E593 S597 I598 C601E504-A595 WeakPolarHBondContact OE1-CB 3.47Å; I587-A595 HydrophobicContact CD1-CB 3.71Å; E593-A595 PolarHBondContact O-N 3.32Å; A595-S597 PolarHBondContact O-N 3.39Å; A595-I598 PolarHBondContact O-N 3.43Å; A595-I598 VanDerWaalsContact O-N 3.13Å; A595-C601 VanDerWaalsContact O-CB 3.27Å; A595-C601 WeakPolarHBondContact O-CB 3.31Å
596S91.6Very high93.1Very high81 Ų8150.9 Ų50.957%0.56630%0.299SS*.G310 helixtrans-65.7-18.1178.358.20000115K594K594-S596 PolarHBondContact O-N 2.86Å
597S92.2Very high93.2Very high75 Ų7546.4 Ų46.452%0.52428%0.278SS..G310 helixtrans-84.3-9.7174.650.20000113.9K594 A595K594-S597 PolarHBondContact O-N 2.96Å; K594-S597 PolarHBondContact O-OG 3.04Å; A595-S597 PolarHBondContact O-N 3.39Å
598I92.9Very high93.3Very high3 Ų346.4 Ų46.42%0.01528%0.278CS..SBendtrans-83.6124.9-179.6-57.4-174.1000109.8T583 Q586 I587 S590 A595 G600 C601T583-I598 HydrophobicContact CG2-CG2 4.14Å; Q586-I598 HydrophobicContact CB-CG2 4.5Å; Q586-I598 HydrophobicContact CG-CD1 4.22Å; Q586-I598 HydrophobicContact CG-CG2 4.09Å; I587-I598 HydrophobicContact CD1-CB 3.99Å; I587-I598 HydrophobicContact CD1-CD1 3.54Å; I587-I598 HydrophobicContact CD1-CG1 4.11Å; I587-I598 HydrophobicContact CD1-CG2 4.43Å; I587-I598 HydrophobicContact CG1-CD1 3.95Å; I587-I598 HydrophobicContact CG1-CG2 4.46Å; S590-I598 WeakPolarHBondContact OG-CD1 3.31Å; A595-I598 PolarHBondContact O-N 3.43Å; A595-I598 VanDerWaalsContact O-N 3.13Å; I598-G600 PolarHBondContact O-N 3.37Å; I598-C601 WeakPolarHBondContact O-CB 3.47Å; I598-C601 PolarHBondContact O-N 2.98Å
599P90.1Very high93.4Very high103 Ų10348.2 Ų48.267%0.66929%0.285SS*.THydrogen-bonded Turntrans-58.2127.2178.2-24.234.2000111.7T583T583-P599 WeakPolarHBondContact CG2-O 3.39Å
600G87.9Confident93.5Very high43 Ų4346.4 Ų46.444%0.44327%0.266SS..THydrogen-bonded Turntrans84.411.2178.600000115.2I598 N602 R603I598-G600 PolarHBondContact O-N 3.37Å; G600-N602 PolarHBondContact O-N 2.82Å; G600-R603 PolarHBondContact O-N 3.46Å
601C88.6Confident93.7Very high16 Ų1645.4 Ų45.411%0.10826%0.259CS..THydrogen-bonded Turntrans-53.2-17.1-179.362.90000116I587 A595 I598 R603 T604 R609I587-C601 HydrophobicContact CD1-CB 4.23Å; A595-C601 VanDerWaalsContact O-CB 3.27Å; A595-C601 WeakPolarHBondContact O-CB 3.31Å; I598-C601 WeakPolarHBondContact O-CB 3.47Å; I598-C601 PolarHBondContact O-N 2.98Å; C601-R603 VanDerWaalsContact C-N 3.3Å; C601-T604 WeakPolarHBondContact O-CG2 3.15Å; C601-T604 PolarHBondContact O-OG1 3.27Å; C601-R609 PolarHBondContact O-NH1 3.08Å
602N90Very high93.8Very high145 Ų14544.8 Ų44.878%0.77526%0.255SS*.THydrogen-bonded Turntrans-78.5-11.8174.3-63.1-29.2000113.6G600G600-N602 PolarHBondContact O-N 2.82Å
603R93.9Very high94.1Very high145 Ų14543.8 Ų43.855%0.54724%0.244SC..SBendtrans-111.247.1179.6-62.1-173.565.8-161.6-3.7110.3E578 V579 D580 G600 C601E578-R603 PolarHBondContact O-NE 2.82Å; E578-R603 PolarHBondContact O-NH2 3.08Å; V579-R603 CarbonylContact C-O 3.33Å; V579-R603 WeakPolarHBondContact CA-O 3.29Å; D580-R603 PolarHBondContact N-O 2.97Å; G600-R603 PolarHBondContact O-N 3.46Å; C601-R603 VanDerWaalsContact C-N 3.3Å
604T95.9Very high94.4Very high9 Ų938.5 Ų38.56%0.05522%0.219CC..SBendtrans-117.5147.3-179.358.40000109.6T583 T584 I587 C601 S606 R609T583-T604 HydrophobicContact CG2-CG2 3.76Å; T584-T604 WeakPolarHBondContact OG1-CA 3.48Å; I587-T604 HydrophobicContact CG1-CG2 3.87Å; C601-T604 WeakPolarHBondContact O-CG2 3.15Å; C601-T604 PolarHBondContact O-OG1 3.27Å; T604-S606 PolarHBondContact O-N 3.28Å; T604-R609 WeakPolarHBondContact OG1-CD 3.42Å
605D97.6Very high94.7Very high2 Ų233.5 Ų33.51%0.01120%0.198CC..  trans-59.1126.4173.7-179-85.5000109.8S572 V579 T584 V607 I608 R609 P666S572-D605 WeakPolarHBondContact CB-OD2 3.08Å; S572-D605 PolarHBondContact OG-OD2 2.86Å; V579-D605 HydrophobicContact CG1-CB 4.11Å; V579-D605 VanDerWaalsContact CG1-N 3.27Å; V579-D605 HydrophobicContact CG2-CB 4.3Å; T584-D605 HydrophobicContact CG2-CB 3.94Å; T584-D605 PolarHBondContact OG1-N 3.23Å; D605-V607 VanDerWaalsContact C-N 3.34Å; D605-V607 PolarHBondContact O-N 3.2Å; D605-V607 WeakPolarHBondContact OD1-CA 3.29Å; D605-V607 VanDerWaalsContact OD1-CB 3.25Å; D605-V607 WeakPolarHBondContact OD1-CB 3.44Å; D605-V607 PolarHBondContact OD1-N 2.89Å; D605-I608 HydrophobicContact CB-CB 4.28Å; D605-I608 HydrophobicContact CB-CD1 4.14Å; D605-I608 HydrophobicContact CB-CG1 4.3Å; D605-I608 PolarHBondContact O-N 3.45Å; D605-I608 PolarHBondContact OD1-N 2.85Å; D605-R609 WeakPolarHBondContact O-CB 3.47Å; D605-R609 PolarHBondContact O-N 3.45Å; D605-P666 HydrophobicContact CB-CB 3.82Å; D605-P666 HydrophobicContact CB-CG 4.25Å
606S97.2Very high95Very high35 Ų3534 Ų3425%0.24520%0.199CC..Hα-helixtrans-74.3-25.9-172.1-49.70000112.7I496 T604 R609 L610I496-S606 WeakPolarHBondContact CG2-O 3.41Å; T604-S606 PolarHBondContact O-N 3.28Å; S606-R609 PolarHBondContact O-N 2.89Å; S606-L610 WeakPolarHBondContact O-CB 3.47Å; S606-L610 PolarHBondContact O-N 3.06Å
607V97.9Very high95.2Very high0 Ų030.2 Ų30.20%017%0.172CC..Hα-helixtrans-67-51174.1-1760000109.2I496 L553 V568 F571 D605 R609 L610 L611 Y652 L667I496-V607 HydrophobicContact CD1-CG2 4.2Å; L553-V607 HydrophobicContact CD2-CG1 3.82Å; V568-V607 HydrophobicContact CG1-CB 4.36Å; V568-V607 HydrophobicContact CG1-CG1 3.68Å; V568-V607 HydrophobicContact CG1-CG2 3.69Å; F571-V607 HydrophobicContact CD1-CG2 3.81Å; F571-V607 HydrophobicContact CE1-CG2 4.14Å; D605-V607 VanDerWaalsContact C-N 3.34Å; D605-V607 PolarHBondContact O-N 3.2Å; D605-V607 WeakPolarHBondContact OD1-CA 3.29Å; D605-V607 VanDerWaalsContact OD1-CB 3.25Å; D605-V607 WeakPolarHBondContact OD1-CB 3.44Å; D605-V607 PolarHBondContact OD1-N 2.89Å; V607-R609 VanDerWaalsContact C-N 3.28Å; V607-R609 PolarHBondContact O-N 3.14Å; V607-L610 PolarHBondContact O-N 2.8Å; V607-L611 HydrophobicContact CG1-CD1 4.4Å; V607-L611 WeakPolarHBondContact O-CG 3.39Å; V607-L611 PolarHBondContact O-N 3.45Å; V607-Y652 HydrophobicContact CG1-CE1 4.03Å; V607-L667 HydrophobicContact CG1-CD2 4.37Å
608I97.8Very high95.5Very high1 Ų126.6 Ų26.61%0.00515%0.147CC..Hα-helixtrans-62.9-37.7177.1-62.5173000110.5T584 L588 D605 L611 S612 P666 L667 A670 F671T584-I608 HydrophobicContact CG2-CB 3.81Å; T584-I608 HydrophobicContact CG2-CD1 3.65Å; T584-I608 HydrophobicContact CG2-CG1 4.31Å; T584-I608 HydrophobicContact CG2-CG2 3.7Å; L588-I608 HydrophobicContact CB-CG2 4.07Å; L588-I608 HydrophobicContact CD1-CG2 4.45Å; L588-I608 HydrophobicContact CD2-CG2 4.3Å; D605-I608 HydrophobicContact CB-CB 4.28Å; D605-I608 HydrophobicContact CB-CD1 4.14Å; D605-I608 HydrophobicContact CB-CG1 4.3Å; D605-I608 PolarHBondContact O-N 3.45Å; D605-I608 PolarHBondContact OD1-N 2.85Å; I608-L611 PolarHBondContact O-N 3.17Å; I608-S612 VanDerWaalsContact O-CB 3.25Å; I608-S612 WeakPolarHBondContact O-CB 3.2Å; I608-S612 PolarHBondContact O-N 3.34Å; I608-S612 PolarHBondContact O-OG 3.25Å; I608-P666 HydrophobicContact CD1-CB 3.87Å; I608-L667 HydrophobicContact CD1-CD2 4.18Å; I608-L667 HydrophobicContact CG1-CD2 3.85Å; I608-A670 HydrophobicContact CD1-CB 3.86Å; I608-F671 HydrophobicContact CD1-CE2 4.49Å; I608-F671 HydrophobicContact CG1-CE2 3.93Å; I608-F671 HydrophobicContact CG1-CZ 4.05Å; I608-F671 HydrophobicContact CG2-CZ 4.48Å
609R97.7Very high95.7Very high41 Ų4127.7 Ų27.716%0.15515%0.153CC..Hα-helixtrans-64.6-39.4176.8-167.9176.5172.7176.1-9.6112.3T500 E504 I587 C601 T604 D605 S606 V607 S612 A613T500-R609 HydrophobicContact CG2-CB 4.33Å; T500-R609 HydrophobicContact CG2-CG 3.67Å; E504-R609 IonicContact OE1-CZ 3.51Å; E504-R609 IonicContact OE1-NE 2.88Å; E504-R609 PolarHBondContact OE1-NE 3.5Å; E504-R609 IonicContact OE1-NH2 2.96Å; E504-R609 PolarHBondContact OE1-NH2 2.89Å; E504-R609 IonicContact OE2-CZ 2.74Å; E504-R609 IonicContact OE2-NE 2.67Å; E504-R609 IonicContact OE2-NH2 3.64Å; E504-R609 PolarHBondContact OE2-NH2 2.97Å; I587-R609 HydrophobicContact CG2-CG 4.35Å; C601-R609 PolarHBondContact O-NH1 3.08Å; T604-R609 WeakPolarHBondContact OG1-CD 3.42Å; D605-R609 WeakPolarHBondContact O-CB 3.47Å; D605-R609 PolarHBondContact O-N 3.45Å; S606-R609 PolarHBondContact O-N 2.89Å; V607-R609 VanDerWaalsContact C-N 3.28Å; V607-R609 PolarHBondContact O-N 3.14Å; R609-S612 CarbonylContact O-C 3.6Å; R609-S612 WeakPolarHBondContact O-CB 3.45Å; R609-S612 PolarHBondContact O-N 2.74Å; R609-A613 PolarHBondContact O-N 3.12Å
610L98.3Very high96.1Very high0 Ų023.3 Ų23.30%012%0.124CC..Hα-helixtrans-64.8-48.4174.6-178.456.7000111.7I496 L499 T500 L503 L553 S606 V607 S612 A613 V614I496-L610 HydrophobicContact CG2-CB 4.25Å; I496-L610 HydrophobicContact CG2-CD2 4.14Å; L499-L610 HydrophobicContact CB-CD1 3.8Å; L499-L610 HydrophobicContact CB-CD2 4.34Å; L499-L610 HydrophobicContact CD1-CD2 4.2Å; T500-L610 WeakPolarHBondContact OG1-CB 3.29Å; L503-L610 HydrophobicContact CD1-CD1 3.77Å; L553-L610 HydrophobicContact CD1-CD2 3.87Å; L553-L610 HydrophobicContact CD1-CG 4.03Å; L553-L610 HydrophobicContact CD2-CD2 4.21Å; L553-L610 HydrophobicContact CG-CD2 4.12Å; S606-L610 WeakPolarHBondContact O-CB 3.47Å; S606-L610 PolarHBondContact O-N 3.06Å; V607-L610 PolarHBondContact O-N 2.8Å; L610-S612 PolarHBondContact O-N 2.96Å; L610-A613 VanDerWaalsContact O-CB 3.31Å; L610-A613 WeakPolarHBondContact O-CB 3.42Å; L610-A613 PolarHBondContact O-N 3.47Å; L610-V614 PolarHBondContact O-N 3.37Å
611L97.9Very high96.5Very high1 Ų121.3 Ų21.31%0.00510%0.103CC..Hα-helixtrans-54.4-42.3172.5-70.9168000111.1L553 V607 I608 A613 V614 L615 F644 W648 Y652 F671L553-L611 HydrophobicContact CD1-CD2 3.76Å; L553-L611 HydrophobicContact CD1-CG 4.08Å; V607-L611 HydrophobicContact CG1-CD1 4.4Å; V607-L611 WeakPolarHBondContact O-CG 3.39Å; V607-L611 PolarHBondContact O-N 3.45Å; I608-L611 PolarHBondContact O-N 3.17Å; L611-A613 VanDerWaalsContact C-N 3.28Å; L611-A613 PolarHBondContact O-N 2.84Å; L611-V614 PolarHBondContact O-N 3.47Å; L611-L615 PolarHBondContact O-N 2.98Å; L611-F644 HydrophobicContact CD2-CE1 3.93Å; L611-F644 HydrophobicContact CD2-CZ 3.86Å; L611-W648 HydrophobicContact CB-CE3 4.37Å; L611-W648 HydrophobicContact CB-CH2 3.81Å; L611-W648 HydrophobicContact CB-CZ2 4.08Å; L611-W648 HydrophobicContact CB-CZ3 3.96Å; L611-W648 HydrophobicContact CD1-CZ2 4.3Å; L611-W648 HydrophobicContact CD2-CD2 3.81Å; L611-W648 HydrophobicContact CD2-CE3 3.92Å; L611-W648 HydrophobicContact CD2-CG 4.18Å; L611-W648 HydrophobicContact CD2-CZ3 4.37Å; L611-Y652 HydrophobicContact CD1-CD1 4.08Å; L611-Y652 HydrophobicContact CD1-CE1 4.3Å; L611-Y652 HydrophobicContact CD1-CG 4.36Å; L611-F671 HydrophobicContact CD1-CE2 3.66Å; L611-F671 HydrophobicContact CD1-CZ 3.64Å
612S97.5Very high96.9Very high0 Ų021 Ų210%010%0.101CC..Hα-helixtrans-71.2-20178.1-530000113.5L588 I608 R609 L610 R616L588-S612 WeakPolarHBondContact CA-OG 3.5Å; I608-S612 VanDerWaalsContact O-CB 3.25Å; I608-S612 WeakPolarHBondContact O-CB 3.2Å; I608-S612 PolarHBondContact O-N 3.34Å; I608-S612 PolarHBondContact O-OG 3.25Å; R609-S612 CarbonylContact O-C 3.6Å; R609-S612 WeakPolarHBondContact O-CB 3.45Å; R609-S612 PolarHBondContact O-N 2.74Å; L610-S612 PolarHBondContact O-N 2.96Å; S612-R616 VanDerWaalsContact CB-NH1 3.27Å; S612-R616 VanDerWaalsContact O-CG 3.24Å; S612-R616 WeakPolarHBondContact O-CG 3.43Å; S612-R616 PolarHBondContact O-N 3.36Å; S612-R616 VanDerWaalsContact O-N 3.08Å; S612-R616 PolarHBondContact O-NH1 3.08Å
613A97.6Very high97.1Very high1 Ų118.5 Ų18.51%0.0088%0.081CC..Hα-helixtrans-73.1-43.1173.900000110.4L503 E504 R609 L610 L611 L615 R616 T617L503-A613 HydrophobicContact CB-CB 3.95Å; L503-A613 HydrophobicContact CD1-CB 4.35Å; E504-A613 HydrophobicContact CG-CB 4.37Å; R609-A613 PolarHBondContact O-N 3.12Å; L610-A613 VanDerWaalsContact O-CB 3.31Å; L610-A613 WeakPolarHBondContact O-CB 3.42Å; L610-A613 PolarHBondContact O-N 3.47Å; L611-A613 VanDerWaalsContact C-N 3.28Å; L611-A613 PolarHBondContact O-N 2.84Å; A613-L615 VanDerWaalsContact C-N 3.33Å; A613-R616 WeakPolarHBondContact O-CB 3.23Å; A613-R616 PolarHBondContact O-N 2.92Å; A613-T617 PolarHBondContact O-N 2.79Å; A613-T617 VanDerWaalsContact O-N 3.13Å; A613-T617 PolarHBondContact O-OG1 3.37Å
614V97.1Very high97.1Very high0 Ų011.8 Ų11.80%06%0.056CC..Hα-helixtrans-66.3-37.6172.8-175.70000111.2L503 I546 L610 L611 R616 T617 S618 F644L503-V614 HydrophobicContact CD1-CG2 3.96Å; I546-V614 HydrophobicContact CD1-CG1 4.33Å; I546-V614 HydrophobicContact CG1-CG1 4.25Å; I546-V614 HydrophobicContact CG1-CG2 4.41Å; L610-V614 PolarHBondContact O-N 3.37Å; L611-V614 PolarHBondContact O-N 3.47Å; V614-R616 VanDerWaalsContact C-N 3.25Å; V614-R616 PolarHBondContact O-N 2.95Å; V614-T617 VanDerWaalsContact O-CB 3.3Å; V614-T617 WeakPolarHBondContact O-CB 3.45Å; V614-T617 PolarHBondContact O-N 2.71Å; V614-T617 VanDerWaalsContact O-N 3.07Å; V614-S618 PolarHBondContact O-N 3.18Å; V614-F644 HydrophobicContact CB-CD1 3.99Å; V614-F644 HydrophobicContact CB-CE1 3.76Å; V614-F644 HydrophobicContact CB-CZ 4.11Å; V614-F644 HydrophobicContact CG1-CB 4.32Å; V614-F644 HydrophobicContact CG1-CD1 3.52Å; V614-F644 HydrophobicContact CG1-CD2 4.42Å; V614-F644 HydrophobicContact CG1-CE1 3.85Å; V614-F644 HydrophobicContact CG1-CG 3.84Å; V614-F644 HydrophobicContact CG1-CZ 4.43Å; V614-F644 HydrophobicContact CG2-CD1 4.31Å; V614-F644 HydrophobicContact CG2-CD2 4.36Å; V614-F644 HydrophobicContact CG2-CE1 3.91Å; V614-F644 HydrophobicContact CG2-CE2 3.96Å; V614-F644 HydrophobicContact CG2-CZ 3.72Å
615L97.4Very high96.9Very high1 Ų111.8 Ų11.81%0.0056%0.056CC..Hα-helixtrans-60.9-35.1173.3-157.367.7000112.3L588 P591 L611 A613 S618 E619 L645 W648 W680 Y684L588-L615 HydrophobicContact CD1-CD2 4.26Å; P591-L615 HydrophobicContact CB-CB 4.26Å; P591-L615 HydrophobicContact CB-CD2 4.07Å; P591-L615 HydrophobicContact CB-CG 3.91Å; P591-L615 HydrophobicContact CG-CD2 4.17Å; P591-L615 HydrophobicContact CG-CG 4.29Å; L611-L615 PolarHBondContact O-N 2.98Å; A613-L615 VanDerWaalsContact C-N 3.33Å; L615-S618 WeakPolarHBondContact O-CB 3.44Å; L615-S618 PolarHBondContact O-N 3.36Å; L615-E619 PolarHBondContact O-N 2.91Å; L615-L645 HydrophobicContact CD1-CD2 4.14Å; L615-W648 HydrophobicContact CB-CZ3 4.34Å; L615-W648 HydrophobicContact CD1-CH2 4.47Å; L615-W648 HydrophobicContact CD1-CZ3 4.06Å; L615-W648 HydrophobicContact CD2-CH2 4.35Å; L615-W680 HydrophobicContact CD2-CH2 3.68Å; L615-W680 HydrophobicContact CD2-CZ3 3.72Å; L615-Y684 HydrophobicContact CD1-CD1 3.5Å; L615-Y684 VanDerWaalsContact CD1-CD1 3.5Å; L615-Y684 HydrophobicContact CD1-CE1 3.2Å; L615-Y684 HydrophobicContact CD1-CG 4.35Å; L615-Y684 HydrophobicContact CG-CD1 4.39Å; L615-Y684 HydrophobicContact CG-CE1 3.96Å; L615-Y684 PolarHBondContact O-OH 3.28Å
616R97.6Very high96.6Very high13 Ų1319.2 Ų19.25%0.0498%0.084CC..Hα-helixtrans-66.4-39.2172.6-76.2170.1170.976.78.1111.8V507 I587 S590 P591 E593 S612 A613 V614 S618 E619 V620V507-R616 HydrophobicContact CG1-CB 4.06Å; I587-R616 PolarHBondContact O-NH1 3.2Å; I587-R616 VanDerWaalsContact O-NH1 3.1Å; I587-R616 PolarHBondContact O-NH2 2.82Å; S590-R616 PolarHBondContact O-NH2 3.33Å; S590-R616 VanDerWaalsContact O-NH2 3.14Å; P591-R616 HydrophobicContact CB-CG 4.24Å; P591-R616 VanDerWaalsContact O-CG 3.27Å; P591-R616 WeakPolarHBondContact O-CG 3.32Å; E593-R616 PolarHBondContact O-NE 3.46Å; E593-R616 PolarHBondContact O-NH2 3.43Å; S612-R616 VanDerWaalsContact CB-NH1 3.27Å; S612-R616 VanDerWaalsContact O-CG 3.24Å; S612-R616 WeakPolarHBondContact O-CG 3.43Å; S612-R616 PolarHBondContact O-N 3.36Å; S612-R616 VanDerWaalsContact O-N 3.08Å; S612-R616 PolarHBondContact O-NH1 3.08Å; A613-R616 WeakPolarHBondContact O-CB 3.23Å; A613-R616 PolarHBondContact O-N 2.92Å; V614-R616 VanDerWaalsContact C-N 3.25Å; V614-R616 PolarHBondContact O-N 2.95Å; R616-S618 VanDerWaalsContact C-N 3.33Å; R616-E619 PolarHBondContact O-N 3.19Å; R616-V620 WeakPolarHBondContact O-CG2 3.44Å; R616-V620 PolarHBondContact O-N 3.08Å
617T96.9Very high96.2Very high0 Ų019.3 Ų19.30%09%0.087CC..Hα-helixtrans-58.2-48.2171.9-430000110.7V507 I542 I546 A613 V614 E619 V620 E621 M637 I641V507-T617 HydrophobicContact CG2-CG2 4.24Å; V507-T617 WeakPolarHBondContact CG2-OG1 3.32Å; I542-T617 HydrophobicContact CG2-CG2 3.7Å; I546-T617 HydrophobicContact CD1-CG2 4.3Å; A613-T617 PolarHBondContact O-N 2.79Å; A613-T617 VanDerWaalsContact O-N 3.13Å; A613-T617 PolarHBondContact O-OG1 3.37Å; V614-T617 VanDerWaalsContact O-CB 3.3Å; V614-T617 WeakPolarHBondContact O-CB 3.45Å; V614-T617 PolarHBondContact O-N 2.71Å; V614-T617 VanDerWaalsContact O-N 3.07Å; T617-E619 VanDerWaalsContact C-N 3.29Å; T617-E619 PolarHBondContact O-N 3.31Å; T617-V620 PolarHBondContact O-N 3.42Å; T617-V620 VanDerWaalsContact O-N 3.12Å; T617-E621 PolarHBondContact O-N 3.17Å; T617-M637 HydrophobicContact CG2-SD 4.01Å; T617-I641 HydrophobicContact CG2-CD1 3.84Å; T617-I641 HydrophobicContact CG2-CG1 4.37Å
618S98Very high95.7Very high0 Ų024.5 Ų24.50%012%0.123CC..Hα-helixtrans-58-39.4176.9-164.60000112.8V614 L615 R616 S622 I641 K688V614-S618 PolarHBondContact O-N 3.18Å; L615-S618 WeakPolarHBondContact O-CB 3.44Å; L615-S618 PolarHBondContact O-N 3.36Å; R616-S618 VanDerWaalsContact C-N 3.33Å; S618-S622 WeakPolarHBondContact O-CB 3.43Å; S618-S622 PolarHBondContact O-N 2.99Å; S618-S622 PolarHBondContact O-OG 2.76Å; S618-I641 WeakPolarHBondContact OG-CG2 3.46Å; S618-K688 WeakPolarHBondContact OG-CE 3.16Å
619E97.6Very high95.3Very high26 Ų2625.3 Ų25.312%0.12113%0.128CC..Hα-helixtrans-71.3-36.1176.4-179.759.1-161.600112.4P591 L615 R616 T617 S622 R623 R626 Y684P591-E619 HydrophobicContact CB-CB 4.04Å; P591-E619 HydrophobicContact CB-CG 4.48Å; P591-E619 HydrophobicContact CG-CB 4.41Å; L615-E619 PolarHBondContact O-N 2.91Å; R616-E619 PolarHBondContact O-N 3.19Å; T617-E619 VanDerWaalsContact C-N 3.29Å; T617-E619 PolarHBondContact O-N 3.31Å; E619-S622 PolarHBondContact O-N 3.36Å; E619-R623 HydrophobicContact CG-CG 4.49Å; E619-R623 WeakPolarHBondContact O-CB 3.32Å; E619-R623 WeakPolarHBondContact O-CG 3.49Å; E619-R623 PolarHBondContact O-N 2.94Å; E619-R623 IonicContact OE1-CZ 2.97Å; E619-R623 IonicContact OE1-NE 3.85Å; E619-R623 PolarHBondContact OE1-NE 3.23Å; E619-R623 IonicContact OE1-NH2 3.67Å; E619-R626 IonicContact OE1-NH2 3.37Å; E619-R626 PolarHBondContact OE1-NH2 3.46Å; E619-R626 IonicContact OE2-NH2 3.54Å; E619-Y684 WeakPolarHBondContact CA-OH 3.48Å; E619-Y684 PolarHBondContact N-OH 3.28Å; E619-Y684 VanDerWaalsContact N-OH 3.14Å
620V97Very high95Very high11 Ų1124.8 Ų24.87%0.06713%0.129CC..Hα-helixtrans-62.6-46.5173.6168.50000110.6V507 L510 H511 L514 R616 T617 R623 A624V507-V620 HydrophobicContact CG1-CG2 3.74Å; L510-V620 HydrophobicContact CD2-CG1 4.09Å; L510-V620 HydrophobicContact CG-CG1 4.15Å; H511-V620 HydrophobicContact CB-CG1 4.29Å; H511-V620 HydrophobicContact CB-CG2 4.02Å; L514-V620 HydrophobicContact CD1-CG1 4.01Å; R616-V620 WeakPolarHBondContact O-CG2 3.44Å; R616-V620 PolarHBondContact O-N 3.08Å; T617-V620 PolarHBondContact O-N 3.42Å; T617-V620 VanDerWaalsContact O-N 3.12Å; V620-R623 PolarHBondContact O-N 3.09Å; V620-A624 PolarHBondContact O-N 3.29Å
621E97.1Very high94.5Very high0 Ų033.7 Ų33.70%017%0.171CC..Hα-helixtrans-59.4-49.5174.7-166.6-159.7152.200110.9T617 R623 A624 T625 L633 M637 I641 K688 W696T617-E621 PolarHBondContact O-N 3.17Å; E621-R623 VanDerWaalsContact C-N 3.26Å; E621-R623 PolarHBondContact O-N 2.94Å; E621-A624 WeakPolarHBondContact O-CB 3.38Å; E621-A624 PolarHBondContact O-N 3.24Å; E621-T625 PolarHBondContact O-N 3.42Å; E621-L633 HydrophobicContact CG-CD1 3.75Å; E621-L633 HydrophobicContact CG-CD2 4.31Å; E621-M637 HydrophobicContact CB-CE 4.25Å; E621-M637 HydrophobicContact CG-CE 4.11Å; E621-I641 HydrophobicContact CB-CD1 4.42Å; E621-I641 WeakPolarHBondContact OE2-CD1 3.45Å; E621-K688 IonicContact OE1-NZ 2.64Å; E621-K688 PolarHBondContact OE1-NZ 2.95Å; E621-K688 VanDerWaalsContact OE1-NZ 3.08Å; E621-K688 IonicContact OE2-NZ 2.89Å; E621-K688 PolarHBondContact OE2-NZ 2.81Å; E621-W696 PolarHBondContact OE1-NE1 3.35Å
622S96.3Very high94.1Very high9 Ų935 Ų356%0.06318%0.177CC..Hα-helixtrans-66.6-23.9-179.5-55.20000113.5S618 E619 T625 R626S618-S622 WeakPolarHBondContact O-CB 3.43Å; S618-S622 PolarHBondContact O-N 2.99Å; S618-S622 PolarHBondContact O-OG 2.76Å; E619-S622 PolarHBondContact O-N 3.36Å; S622-T625 WeakPolarHBondContact CA-OG1 3.19Å; S622-T625 PolarHBondContact O-OG1 2.94Å; S622-R626 WeakPolarHBondContact O-CG 3.41Å; S622-R626 PolarHBondContact O-N 3.19Å; S622-R626 PolarHBondContact O-NE 3.11Å
623R94.8Very high93.9Very high94 Ų9435.5 Ų35.536%0.35518%0.18SC..Hα-helixtrans-76.6-38.4170.6-77.1172.7179.5-162.5-8111.7G592 E619 V620 E621 R626 A627G592-R623 VanDerWaalsContact CA-CZ 3.48Å; G592-R623 PolarHBondContact O-NH1 2.9Å; G592-R623 PolarHBondContact O-NH2 3.34Å; E619-R623 HydrophobicContact CG-CG 4.49Å; E619-R623 WeakPolarHBondContact O-CB 3.32Å; E619-R623 WeakPolarHBondContact O-CG 3.49Å; E619-R623 PolarHBondContact O-N 2.94Å; E619-R623 IonicContact OE1-CZ 2.97Å; E619-R623 IonicContact OE1-NE 3.85Å; E619-R623 PolarHBondContact OE1-NE 3.23Å; E619-R623 IonicContact OE1-NH2 3.67Å; V620-R623 PolarHBondContact O-N 3.09Å; E621-R623 VanDerWaalsContact C-N 3.26Å; E621-R623 PolarHBondContact O-N 2.94Å; R623-R626 PolarHBondContact O-N 3.09Å; R623-A627 WeakPolarHBondContact O-CB 3.47Å; R623-A627 PolarHBondContact O-N 2.85Å
624A93.6Very high93.8Very high4 Ų436.5 Ų36.53%0.03319%0.187CC..Hα-helixtrans-65.1-42.5177.200000111.2L514 V620 E621 R626 A627 S628 L629 L633L514-A624 HydrophobicContact CD1-CB 4.09Å; V620-A624 PolarHBondContact O-N 3.29Å; E621-A624 WeakPolarHBondContact O-CB 3.38Å; E621-A624 PolarHBondContact O-N 3.24Å; A624-R626 PolarHBondContact O-N 2.57Å; A624-A627 CarbonylContact O-C 3.52Å; A624-A627 PolarHBondContact O-N 3.2Å; A624-A627 VanDerWaalsContact O-N 3.12Å; A624-S628 PolarHBondContact O-N 3.31Å; A624-L629 HydrophobicContact CB-CB 4.2Å; A624-L629 WeakPolarHBondContact O-CB 3.47Å; A624-L629 PolarHBondContact O-N 3.44Å; A624-L633 HydrophobicContact CB-CD1 4.01Å; A624-L633 HydrophobicContact CB-CD2 3.8Å; A624-L633 HydrophobicContact CB-CG 4.18Å
625T92.8Very high93.7Very high9 Ų938.7 Ų38.76%0.05520%0.201CC..Hα-helixtrans-60.9-45.6173.959.70000111.6E621 S622 A627 S628 L633 N691 V695E621-T625 PolarHBondContact O-N 3.42Å; S622-T625 WeakPolarHBondContact CA-OG1 3.19Å; S622-T625 PolarHBondContact O-OG1 2.94Å; T625-A627 PolarHBondContact O-N 2.96Å; T625-S628 PolarHBondContact O-N 2.73Å; T625-L633 HydrophobicContact CG2-CD1 3.71Å; T625-N691 VanDerWaalsContact OG1-CG 3.3Å; T625-N691 PolarHBondContact OG1-ND2 2.74Å; T625-N691 PolarHBondContact OG1-OD1 3.21Å; T625-V695 HydrophobicContact CG2-CG2 3.89Å
626R90Very high93.6Very high157 Ų15741 Ų4159%0.59221%0.212SC*.Hα-helixtrans-62.1-26.8174.7-77.2-177.8-71.9162.7-12.7113.6E619 S622 R623 A624 S628E619-R626 IonicContact OE1-NH2 3.37Å; E619-R626 PolarHBondContact OE1-NH2 3.46Å; E619-R626 IonicContact OE2-NH2 3.54Å; S622-R626 WeakPolarHBondContact O-CG 3.41Å; S622-R626 PolarHBondContact O-N 3.19Å; S622-R626 PolarHBondContact O-NE 3.11Å; R623-R626 PolarHBondContact O-N 3.09Å; A624-R626 PolarHBondContact O-N 2.57Å; R626-S628 VanDerWaalsContact C-N 3.31Å
627A89.4Confident93.5Very high37 Ų3740.5 Ų40.531%0.30621%0.21SC..THydrogen-bonded Turntrans-897.4176.100000113.5R623 A624 T625 L629R623-A627 WeakPolarHBondContact O-CB 3.47Å; R623-A627 PolarHBondContact O-N 2.85Å; A624-A627 CarbonylContact O-C 3.52Å; A624-A627 PolarHBondContact O-N 3.2Å; A624-A627 VanDerWaalsContact O-N 3.12Å; T625-A627 PolarHBondContact O-N 2.96Å; A627-L629 VanDerWaalsContact C-N 3.3Å; A627-L629 HydrophobicContact CB-CD1 4.18Å; A627-L629 HydrophobicContact CB-CG 4.11Å; A627-L629 PolarHBondContact O-N 2.88Å
628S87.6Confident93.5Very high110 Ų11040.5 Ų40.577%0.76921%0.21SC*.THydrogen-bonded Turntrans59.337.3-176.4-52.80000113.5A624 T625 R626A624-S628 PolarHBondContact O-N 3.31Å; T625-S628 PolarHBondContact O-N 2.73Å; R626-S628 VanDerWaalsContact C-N 3.31Å
629L89.9Confident93.5Very high18 Ų1841.2 Ų41.29%0.09421%0.213CC..  trans-104.920.9176.3-57.6177.5000112.5Q518 A624 A627 E631 L632Q518-L629 HydrophobicContact CB-CD1 4.09Å; Q518-L629 HydrophobicContact CB-CD2 4.34Å; Q518-L629 HydrophobicContact CG-CD1 4.34Å; Q518-L629 HydrophobicContact CG-CD2 4.29Å; A624-L629 HydrophobicContact CB-CB 4.2Å; A624-L629 WeakPolarHBondContact O-CB 3.47Å; A624-L629 PolarHBondContact O-N 3.44Å; A627-L629 VanDerWaalsContact C-N 3.3Å; A627-L629 HydrophobicContact CB-CD1 4.18Å; A627-L629 HydrophobicContact CB-CG 4.11Å; A627-L629 PolarHBondContact O-N 2.88Å; L629-E631 VanDerWaalsContact C-N 3.26Å; L629-E631 PolarHBondContact O-N 3.46Å; L629-L632 HydrophobicContact CB-CD1 4.39Å; L629-L632 HydrophobicContact CD2-CD1 4.15Å; L629-L632 WeakPolarHBondContact O-CB 3.41Å; L629-L632 PolarHBondContact O-N 3.02Å
630T90.5Very high93.5Very high30 Ų3040 Ų4018%0.18421%0.207CC..G310 helixtrans-57.3-37.4-175.5-47.40000112.7L632 L633 V695 W696T630-L632 PolarHBondContact O-N 3.29Å; T630-L632 VanDerWaalsContact O-N 3.08Å; T630-L633 WeakPolarHBondContact O-CB 3.47Å; T630-L633 PolarHBondContact O-N 3.08Å; T630-V695 HydrophobicContact CG2-CB 4.27Å; T630-V695 HydrophobicContact CG2-CG2 4.2Å; T630-W696 HydrophobicContact CG2-CD2 4.29Å; T630-W696 HydrophobicContact CG2-CE3 4.2Å; T630-W696 HydrophobicContact CG2-CH2 3.87Å; T630-W696 HydrophobicContact CG2-CZ2 3.94Å; T630-W696 HydrophobicContact CG2-CZ3 4Å
631E88.1Confident93.6Very high187 Ų18739.5 Ų39.587%0.87420%0.204SC*.G310 helixtrans-63.9-12.8178.1-61.2179.6179.700114.1L629L629-E631 VanDerWaalsContact C-N 3.26Å; L629-E631 PolarHBondContact O-N 3.46Å
632L89.5Confident93.7Very high27 Ų2739.5 Ų39.514%0.14121%0.205CC..G310 helixtrans-97.6-8.3176.6-60.1178000112.6L514 T517 L521 L535 Y539 L629 T630L514-L632 HydrophobicContact CD2-CB 4.22Å; T517-L632 HydrophobicContact CG2-CD1 3.61Å; T517-L632 HydrophobicContact CG2-CD2 4.43Å; L521-L632 HydrophobicContact CD1-CD1 4.25Å; L535-L632 WeakPolarHBondContact CD2-O 3.31Å; Y539-L632 WeakPolarHBondContact CE2-O 3.29Å; Y539-L632 PolarHBondContact OH-O 3.2Å; L629-L632 HydrophobicContact CB-CD1 4.39Å; L629-L632 HydrophobicContact CD2-CD1 4.15Å; L629-L632 WeakPolarHBondContact O-CB 3.41Å; L629-L632 PolarHBondContact O-N 3.02Å; T630-L632 PolarHBondContact O-N 3.29Å; T630-L632 VanDerWaalsContact O-N 3.08Å
633L93.7Very high93.7Very high12 Ų1240.7 Ų40.76%0.06321%0.207CC..SBendtrans-86.5145.8-177.3-65.4175.6000111.1L514 Y539 E621 A624 T625 T630 W696L514-L633 HydrophobicContact CD1-CD2 4.23Å; Y539-L633 WeakPolarHBondContact OH-CA 3.09Å; E621-L633 HydrophobicContact CG-CD1 3.75Å; E621-L633 HydrophobicContact CG-CD2 4.31Å; A624-L633 HydrophobicContact CB-CD1 4.01Å; A624-L633 HydrophobicContact CB-CD2 3.8Å; A624-L633 HydrophobicContact CB-CG 4.18Å; T625-L633 HydrophobicContact CG2-CD1 3.71Å; T630-L633 WeakPolarHBondContact O-CB 3.47Å; T630-L633 PolarHBondContact O-N 3.08Å; L633-W696 HydrophobicContact CB-CH2 3.86Å; L633-W696 HydrophobicContact CB-CZ2 3.83Å; L633-W696 HydrophobicContact CD1-CZ2 4.08Å
634S94.5Very high93.9Very high22 Ų2236.4 Ų36.415%0.15419%0.191CC..  trans-80123.5170.1167.20000110.2Y539 Q636 M637 G638Y539-S634 VanDerWaalsContact CG-CB 3.45Å; S634-Q636 VanDerWaalsContact C-N 3.28Å; S634-Q636 PolarHBondContact OG-N 3.18Å; S634-M637 PolarHBondContact O-N 3.27Å; S634-M637 PolarHBondContact OG-N 3.25Å; S634-G638 PolarHBondContact O-N 3Å
635P94.5Very high94.1Very high45 Ų4536.2 Ų36.229%0.29219%0.19SC..Hα-helixtrans-66.2-31.1172.727.5-33.6000112.1G638 K639 W696 E699 L702P635-G638 CarbonylContact O-C 3.25Å; P635-G638 WeakPolarHBondContact O-CA 3.34Å; P635-G638 PolarHBondContact O-N 3.2Å; P635-G638 VanDerWaalsContact O-N 3.08Å; P635-K639 PolarHBondContact O-N 2.84Å; P635-W696 HydrophobicContact CB-CH2 4.49Å; P635-W696 HydrophobicContact CB-CZ3 4.27Å; P635-E699 HydrophobicContact CB-CB 4.46Å; P635-E699 HydrophobicContact CB-CG 3.94Å; P635-L702 HydrophobicContact CB-CD2 4.4Å
636Q95.3Very high94.2Very high51 Ų5139.2 Ų39.224%0.23820%0.2CC..Hα-helixtrans-61-47.9174.4-175.357.439.900111.3D472 S634 G638 K639 D640D472-Q636 PolarHBondContact OD1-NE2 2.95Å; S634-Q636 VanDerWaalsContact C-N 3.28Å; S634-Q636 PolarHBondContact OG-N 3.18Å; Q636-G638 PolarHBondContact O-N 2.97Å; Q636-K639 WeakPolarHBondContact O-CA 3.46Å; Q636-K639 WeakPolarHBondContact O-CB 3.41Å; Q636-K639 PolarHBondContact O-N 3.05Å; Q636-D640 PolarHBondContact NE2-OD1 3.25Å; Q636-D640 PolarHBondContact O-N 3.33Å
637M96.7Very high94.4Very high1 Ų132.5 Ų32.51%0.00518%0.175CC..Hα-helixtrans-58-36.3173.2-172.8-168.766.500111.7L510 Y539 I542 T617 E621 S634 D640 I641L510-M637 HydrophobicContact CD2-CE 4.27Å; L510-M637 HydrophobicContact CD2-SD 3.92Å; Y539-M637 HydrophobicContact CD1-CB 4.3Å; Y539-M637 HydrophobicContact CD1-CE 4.22Å; Y539-M637 HydrophobicContact CD1-SD 3.66Å; Y539-M637 HydrophobicContact CE1-CE 3.91Å; Y539-M637 HydrophobicContact CE1-SD 3.89Å; I542-M637 HydrophobicContact CD1-SD 4.37Å; I542-M637 HydrophobicContact CG2-CG 3.98Å; I542-M637 HydrophobicContact CG2-SD 3.93Å; T617-M637 HydrophobicContact CG2-SD 4.01Å; E621-M637 HydrophobicContact CB-CE 4.25Å; E621-M637 HydrophobicContact CG-CE 4.11Å; S634-M637 PolarHBondContact O-N 3.27Å; S634-M637 PolarHBondContact OG-N 3.25Å; M637-D640 WeakPolarHBondContact CA-OD2 3.44Å; M637-D640 PolarHBondContact O-N 3.48Å; M637-I641 HydrophobicContact CE-CD1 4.18Å; M637-I641 HydrophobicContact CG-CD1 3.98Å; M637-I641 WeakPolarHBondContact O-CD1 3.23Å; M637-I641 VanDerWaalsContact O-CG1 3.24Å; M637-I641 WeakPolarHBondContact O-CG1 3.34Å; M637-I641 PolarHBondContact O-N 2.67Å; M637-I641 HydrophobicContact SD-CD1 4.43Å
638G97.4Very high94.7Very high0 Ų030.9 Ų30.90%016%0.161CC..Hα-helixtrans-60.2-44.2172.700000112.6S634 P635 Q636 I641 V642 L702S634-G638 PolarHBondContact O-N 3Å; P635-G638 CarbonylContact O-C 3.25Å; P635-G638 WeakPolarHBondContact O-CA 3.34Å; P635-G638 PolarHBondContact O-N 3.2Å; P635-G638 VanDerWaalsContact O-N 3.08Å; Q636-G638 PolarHBondContact O-N 2.97Å; G638-I641 PolarHBondContact O-N 2.81Å; G638-V642 WeakPolarHBondContact O-CB 3.38Å; G638-V642 VanDerWaalsContact O-CG2 3.3Å; G638-V642 WeakPolarHBondContact O-CG2 3.42Å; G638-V642 PolarHBondContact O-N 3.19Å; G638-L702 WeakPolarHBondContact O-CD1 3.43Å
639K97.4Very high95Very high16 Ų1625.6 Ų25.67%0.0712%0.124CC..Hα-helixtrans-61.3-46175.8-71.7174.959.9-176.30110.3D472 P635 Q636 I641 V642 W643 E701 L702D472-K639 WeakPolarHBondContact OD2-CE 3.24Å; D472-K639 IonicContact OD2-NZ 2.75Å; D472-K639 PolarHBondContact OD2-NZ 3.5Å; P635-K639 PolarHBondContact O-N 2.84Å; Q636-K639 WeakPolarHBondContact O-CA 3.46Å; Q636-K639 WeakPolarHBondContact O-CB 3.41Å; Q636-K639 PolarHBondContact O-N 3.05Å; K639-I641 PolarHBondContact O-N 3.21Å; K639-V642 PolarHBondContact O-N 3.41Å; K639-W643 VanDerWaalsContact O-CB 3.23Å; K639-W643 WeakPolarHBondContact O-CB 3.29Å; K639-W643 PolarHBondContact O-N 3.07Å; K639-E701 HydrophobicContact CD-CB 4.33Å; K639-E701 IonicContact NZ-OE2 3.41Å; K639-E701 PolarHBondContact NZ-OE2 3.34Å; K639-L702 HydrophobicContact CG-CB 4.15Å; K639-L702 HydrophobicContact CG-CD1 4.18Å
640D98.1Very high95.2Very high0 Ų026.6 Ų26.60%013%0.128CC..Hα-helixtrans-60.9-45.5179.5-51.2-38.1000112.1H543 I546 Q636 M637 W643 F644H543-D640 WeakPolarHBondContact CA-OD2 3.13Å; H543-D640 WeakPolarHBondContact CB-OD2 3.46Å; H543-D640 IonicContact CE1-OD1 3.56Å; H543-D640 PolarHBondContact CE1-OD1 2.85Å; H543-D640 IonicContact CE1-OD2 3.7Å; H543-D640 IonicContact CG-OD2 2.74Å; H543-D640 IonicContact ND1-OD1 3.57Å; H543-D640 PolarHBondContact ND1-OD1 3.28Å; H543-D640 IonicContact ND1-OD2 3.96Å; H543-D640 PolarHBondContact ND1-OD2 3.45Å; I546-D640 HydrophobicContact CB-CB 4.23Å; I546-D640 HydrophobicContact CD1-CB 4.35Å; I546-D640 HydrophobicContact CG2-CB 3.81Å; Q636-D640 PolarHBondContact NE2-OD1 3.25Å; Q636-D640 PolarHBondContact O-N 3.33Å; M637-D640 WeakPolarHBondContact CA-OD2 3.44Å; M637-D640 PolarHBondContact O-N 3.48Å; D640-W643 PolarHBondContact O-N 3.48Å; D640-F644 VanDerWaalsContact O-CB 3.28Å; D640-F644 WeakPolarHBondContact O-CB 3.16Å; D640-F644 PolarHBondContact O-N 2.86Å
641I98.5Very high95.3Very high0 Ų025.5 Ų25.50%012%0.121CC..Hα-helixtrans-61.6-49.6178.3-70.4163.3000109.7I546 T617 S618 E621 M637 G638 K639 F644 L645I546-I641 HydrophobicContact CD1-CG1 3.74Å; T617-I641 HydrophobicContact CG2-CD1 3.84Å; T617-I641 HydrophobicContact CG2-CG1 4.37Å; S618-I641 WeakPolarHBondContact OG-CG2 3.46Å; E621-I641 HydrophobicContact CB-CD1 4.42Å; E621-I641 WeakPolarHBondContact OE2-CD1 3.45Å; M637-I641 HydrophobicContact CE-CD1 4.18Å; M637-I641 HydrophobicContact CG-CD1 3.98Å; M637-I641 WeakPolarHBondContact O-CD1 3.23Å; M637-I641 VanDerWaalsContact O-CG1 3.24Å; M637-I641 WeakPolarHBondContact O-CG1 3.34Å; M637-I641 PolarHBondContact O-N 2.67Å; M637-I641 HydrophobicContact SD-CD1 4.43Å; G638-I641 PolarHBondContact O-N 2.81Å; K639-I641 PolarHBondContact O-N 3.21Å; I641-F644 PolarHBondContact O-N 3.44Å; I641-L645 HydrophobicContact CG2-CD1 3.86Å; I641-L645 HydrophobicContact CG2-CG 4.32Å; I641-L645 WeakPolarHBondContact O-CB 3.26Å; I641-L645 WeakPolarHBondContact O-CG 3.45Å; I641-L645 PolarHBondContact O-N 3.35Å
642V98.3Very high95.7Very high1 Ų116.7 Ų16.71%0.0068%0.08CC..Hα-helixtrans-64.5-43-178.1171.70000111.3G638 K639 L645 R646 N692 L702 D705 L709G638-V642 WeakPolarHBondContact O-CB 3.38Å; G638-V642 VanDerWaalsContact O-CG2 3.3Å; G638-V642 WeakPolarHBondContact O-CG2 3.42Å; G638-V642 PolarHBondContact O-N 3.19Å; K639-V642 PolarHBondContact O-N 3.41Å; V642-L645 PolarHBondContact O-N 3.07Å; V642-R646 WeakPolarHBondContact O-CB 3.21Å; V642-R646 PolarHBondContact O-N 3.22Å; V642-N692 WeakPolarHBondContact CG2-ND2 3.48Å; V642-L702 HydrophobicContact CG2-CD1 4.11Å; V642-D705 VanDerWaalsContact CG1-C 3.43Å; V642-D705 HydrophobicContact CG1-CB 3.96Å; V642-D705 VanDerWaalsContact CG1-O 3.22Å; V642-D705 WeakPolarHBondContact CG1-O 3.48Å; V642-L709 HydrophobicContact CG1-CB 4Å; V642-L709 HydrophobicContact CG1-CD2 4.21Å
643W97.4Very high95.9Very high33 Ų3315.7 Ų15.713%0.1258%0.075CC..Hα-helixtrans-57.7-48.9173.7166.786.8000112I546 L547 Y551 K639 D640 L645 R646 R647I546-W643 HydrophobicContact CG2-CZ3 4.45Å; L547-W643 HydrophobicContact CD2-CE3 3.97Å; L547-W643 HydrophobicContact CD2-CH2 4.1Å; L547-W643 HydrophobicContact CD2-CZ3 3.71Å; Y551-W643 AromaticContact CD2-CH2 3.72Å; Y551-W643 HydrophobicContact CD2-CH2 3.72Å; Y551-W643 AromaticContact CD2-CZ2 3.92Å; Y551-W643 HydrophobicContact CD2-CZ2 3.92Å; Y551-W643 AromaticContact CE2-CH2 3.78Å; Y551-W643 HydrophobicContact CE2-CH2 3.78Å; Y551-W643 AromaticContact CE2-CZ2 3.54Å; Y551-W643 HydrophobicContact CE2-CZ2 3.54Å; K639-W643 VanDerWaalsContact O-CB 3.23Å; K639-W643 WeakPolarHBondContact O-CB 3.29Å; K639-W643 PolarHBondContact O-N 3.07Å; D640-W643 PolarHBondContact O-N 3.48Å; W643-L645 PolarHBondContact O-N 3.07Å; W643-R646 WeakPolarHBondContact O-CB 3.38Å; W643-R646 PolarHBondContact O-N 3.47Å; W643-R647 PolarHBondContact O-N 3.28Å
644F98.1Very high95.8Very high4 Ų415.8 Ų15.82%0.0188%0.075CC..Hα-helixtrans-61.3-46178.6-177.1-82.1000111.5I546 L553 L611 V614 D640 I641 R646 R647 W648I546-F644 HydrophobicContact CG2-CB 3.83Å; I546-F644 HydrophobicContact CG2-CD2 4.09Å; I546-F644 HydrophobicContact CG2-CG 4.23Å; L553-F644 HydrophobicContact CD1-CE2 4.21Å; L553-F644 HydrophobicContact CD1-CZ 3.84Å; L611-F644 HydrophobicContact CD2-CE1 3.93Å; L611-F644 HydrophobicContact CD2-CZ 3.86Å; V614-F644 HydrophobicContact CB-CD1 3.99Å; V614-F644 HydrophobicContact CB-CE1 3.76Å; V614-F644 HydrophobicContact CB-CZ 4.11Å; V614-F644 HydrophobicContact CG1-CB 4.32Å; V614-F644 HydrophobicContact CG1-CD1 3.52Å; V614-F644 HydrophobicContact CG1-CD2 4.42Å; V614-F644 HydrophobicContact CG1-CE1 3.85Å; V614-F644 HydrophobicContact CG1-CG 3.84Å; V614-F644 HydrophobicContact CG1-CZ 4.43Å; V614-F644 HydrophobicContact CG2-CD1 4.31Å; V614-F644 HydrophobicContact CG2-CD2 4.36Å; V614-F644 HydrophobicContact CG2-CE1 3.91Å; V614-F644 HydrophobicContact CG2-CE2 3.96Å; V614-F644 HydrophobicContact CG2-CZ 3.72Å; D640-F644 VanDerWaalsContact O-CB 3.28Å; D640-F644 WeakPolarHBondContact O-CB 3.16Å; D640-F644 PolarHBondContact O-N 2.86Å; I641-F644 PolarHBondContact O-N 3.44Å; F644-R646 VanDerWaalsContact C-N 3.28Å; F644-R646 PolarHBondContact O-N 2.82Å; F644-R647 PolarHBondContact O-N 3Å; F644-W648 HydrophobicContact CE1-CE3 4.03Å; F644-W648 WeakPolarHBondContact O-CB 3.08Å; F644-W648 PolarHBondContact O-N 3.5Å
645L97.8Very high95.7Very high0 Ų015.2 Ų15.20%07%0.071CC..Hα-helixtrans-63.8-34.2178.5-67.7177.5000112L615 I641 V642 W643 W648 A649 L685 K688 L709L615-L645 HydrophobicContact CD1-CD2 4.14Å; I641-L645 HydrophobicContact CG2-CD1 3.86Å; I641-L645 HydrophobicContact CG2-CG 4.32Å; I641-L645 WeakPolarHBondContact O-CB 3.26Å; I641-L645 WeakPolarHBondContact O-CG 3.45Å; I641-L645 PolarHBondContact O-N 3.35Å; V642-L645 PolarHBondContact O-N 3.07Å; W643-L645 PolarHBondContact O-N 3.07Å; L645-W648 HydrophobicContact CD2-CE3 3.92Å; L645-W648 HydrophobicContact CD2-CZ3 4.27Å; L645-A649 WeakPolarHBondContact O-CB 3.34Å; L645-A649 PolarHBondContact O-N 3.13Å; L645-L685 HydrophobicContact CB-CD2 3.78Å; L645-L685 HydrophobicContact CD1-CD2 3.77Å; L645-L685 HydrophobicContact CD2-CD2 3.77Å; L645-L685 HydrophobicContact CG-CD2 3.95Å; L645-K688 HydrophobicContact CD1-CG 4.09Å; L645-L709 HydrophobicContact CB-CD1 4.39Å; L645-L709 HydrophobicContact CB-CD2 4.12Å
646R95.8Very high95.4Very high73 Ų7315.9 Ų15.928%0.2757%0.072SC..Hα-helixtrans-65.8-43.7173.2-170.8-178.6-179.6-157.76.2111V642 W643 F644 A649 K650 E708 L709 T712V642-R646 WeakPolarHBondContact O-CB 3.21Å; V642-R646 PolarHBondContact O-N 3.22Å; W643-R646 WeakPolarHBondContact O-CB 3.38Å; W643-R646 PolarHBondContact O-N 3.47Å; F644-R646 VanDerWaalsContact C-N 3.28Å; F644-R646 PolarHBondContact O-N 2.82Å; R646-A649 PolarHBondContact O-N 3.24Å; R646-K650 WeakPolarHBondContact O-CG 3.25Å; R646-K650 PolarHBondContact O-N 3.07Å; R646-E708 IonicContact CZ-OE2 2.9Å; R646-E708 IonicContact NH2-OE2 2.61Å; R646-E708 PolarHBondContact NH2-OE2 3.49Å; R646-L709 HydrophobicContact CB-CD1 3.95Å; R646-L709 HydrophobicContact CG-CD1 4.5Å; R646-T712 HydrophobicContact CG-CG2 4.17Å; R646-T712 WeakPolarHBondContact CG-OG1 3.43Å; R646-T712 PolarHBondContact NE-OG1 3.08Å
647R94.4Very high95.1Very high15 Ų1519.8 Ų19.86%0.0579%0.09CC..Hα-helixtrans-64.3-41.8176.6-154.4179.6-161165.64.9111.9G550 Y551 A554 D555 D556 W643 F644 K650 S651G550-R647 VanDerWaalsContact C-NH1 3.34Å; G550-R647 PolarHBondContact O-NH1 3.36Å; Y551-R647 VanDerWaalsContact CA-NH1 3.34Å; Y551-R647 VanDerWaalsContact CD2-NH1 3.31Å; A554-R647 HydrophobicContact CB-CG 3.82Å; A554-R647 PolarHBondContact O-NE 3.13Å; A554-R647 PolarHBondContact O-NH2 2.85Å; D555-R647 PolarHBondContact O-NE 2.88Å; D556-R647 VanDerWaalsContact N-NH2 3.1Å; D556-R647 IonicContact OD1-CZ 3.28Å; D556-R647 VanDerWaalsContact OD1-CZ 3.23Å; D556-R647 IonicContact OD1-NE 3.95Å; D556-R647 IonicContact OD1-NH1 2.83Å; D556-R647 IonicContact OD1-NH2 3.23Å; D556-R647 PolarHBondContact OD1-NH2 3.24Å; D556-R647 IonicContact OD2-NH2 2.78Å; D556-R647 PolarHBondContact OD2-NH2 2.98Å; W643-R647 PolarHBondContact O-N 3.28Å; F644-R647 PolarHBondContact O-N 3Å; R647-K650 PolarHBondContact O-N 3.36Å; R647-S651 PolarHBondContact O-N 3.21Å; R647-S651 PolarHBondContact O-OG 2.73Å; R647-S651 VanDerWaalsContact O-OG 3.14Å
648W94.9Very high94.9Very high3 Ų328.6 Ų28.61%0.01113%0.128CC..Hα-helixtrans-56.3-56.8170.7-178.9-19.2000110.2L588 L611 L615 F644 L645 K650 S651 Y652 F671 I681L588-W648 HydrophobicContact CD1-CH2 3.89Å; L588-W648 HydrophobicContact CD1-CZ2 4.12Å; L611-W648 HydrophobicContact CB-CE3 4.37Å; L611-W648 HydrophobicContact CB-CH2 3.81Å; L611-W648 HydrophobicContact CB-CZ2 4.08Å; L611-W648 HydrophobicContact CB-CZ3 3.96Å; L611-W648 HydrophobicContact CD1-CZ2 4.3Å; L611-W648 HydrophobicContact CD2-CD2 3.81Å; L611-W648 HydrophobicContact CD2-CE3 3.92Å; L611-W648 HydrophobicContact CD2-CG 4.18Å; L611-W648 HydrophobicContact CD2-CZ3 4.37Å; L615-W648 HydrophobicContact CB-CZ3 4.34Å; L615-W648 HydrophobicContact CD1-CH2 4.47Å; L615-W648 HydrophobicContact CD1-CZ3 4.06Å; L615-W648 HydrophobicContact CD2-CH2 4.35Å; F644-W648 HydrophobicContact CE1-CE3 4.03Å; F644-W648 WeakPolarHBondContact O-CB 3.08Å; F644-W648 PolarHBondContact O-N 3.5Å; L645-W648 HydrophobicContact CD2-CE3 3.92Å; L645-W648 HydrophobicContact CD2-CZ3 4.27Å; W648-K650 PolarHBondContact O-N 2.9Å; W648-S651 PolarHBondContact O-N 2.63Å; W648-Y652 VanDerWaalsContact CD1-CB 3.41Å; W648-Y652 PolarHBondContact O-N 3.35Å; W648-F671 AromaticContact CZ2-CE1 3.7Å; W648-F671 HydrophobicContact CZ2-CE1 3.7Å; W648-F671 AromaticContact CZ2-CZ 3.84Å; W648-F671 HydrophobicContact CZ2-CZ 3.84Å; W648-I681 HydrophobicContact CZ2-CD1 3.83Å; W648-I681 HydrophobicContact CZ2-CG1 4.48Å
649A94.8Very high94.5Very high0 Ų032.6 Ų32.60%015%0.149CC..Hα-helixtrans-56.3-27.8-174.800000113.4L645 R646 L653 L685 T712 L713 R719L645-A649 WeakPolarHBondContact O-CB 3.34Å; L645-A649 PolarHBondContact O-N 3.13Å; R646-A649 PolarHBondContact O-N 3.24Å; A649-L653 HydrophobicContact CB-CD2 4.21Å; A649-L653 WeakPolarHBondContact O-CB 3.04Å; A649-L685 HydrophobicContact CB-CD1 4.08Å; A649-T712 HydrophobicContact CB-CG2 4.24Å; A649-L713 HydrophobicContact CB-CD2 4.46Å; A649-R719 PolarHBondContact O-NH1 3.43Å
650K93.4Very high94.3Very high39 Ų3933.5 Ų33.517%0.1715%0.153CC..Hα-helixtrans-79-31.4176.8-70.2-178175.8-176.70114.1P557 P562 R646 R647 W648 T712P557-K650 HydrophobicContact CG-CD 4.28Å; P562-K650 HydrophobicContact CG-CB 3.7Å; R646-K650 WeakPolarHBondContact O-CG 3.25Å; R646-K650 PolarHBondContact O-N 3.07Å; R647-K650 PolarHBondContact O-N 3.36Å; W648-K650 PolarHBondContact O-N 2.9Å; K650-T712 HydrophobicContact CD-CG2 4.34Å; K650-T712 HydrophobicContact CG-CG2 3.72Å
651S93.3Very high94Very high6 Ų643 Ų434%0.04220%0.197CC..Hα-helixtrans-110.3-38.4-168.5-43.20000114I564 R647 W648I564-S651 WeakPolarHBondContact CG1-O 3.36Å; R647-S651 PolarHBondContact O-N 3.21Å; R647-S651 PolarHBondContact O-OG 2.73Å; R647-S651 VanDerWaalsContact O-OG 3.14Å; W648-S651 PolarHBondContact O-N 2.63Å
652Y95.2Very high93.8Very high2 Ų249.5 Ų49.51%0.00823%0.227CC..SBendtrans-115.516.8-172-66.9-97000113.2L553 A554 I564 V607 L611 W648 L667 F671L553-Y652 HydrophobicContact CB-CE2 4.18Å; L553-Y652 WeakPolarHBondContact O-CE2 3.5Å; L553-Y652 VanDerWaalsContact O-CZ 3.29Å; L553-Y652 PolarHBondContact O-OH 2.82Å; A554-Y652 HydrophobicContact CB-CE2 4.38Å; I564-Y652 HydrophobicContact CB-CE1 4.41Å; I564-Y652 HydrophobicContact CD1-CD1 3.53Å; I564-Y652 HydrophobicContact CD1-CE1 3.74Å; I564-Y652 HydrophobicContact CD1-CG 4.17Å; I564-Y652 HydrophobicContact CG1-CD1 3.78Å; I564-Y652 HydrophobicContact CG1-CD2 4.42Å; I564-Y652 HydrophobicContact CG1-CE1 3.73Å; I564-Y652 HydrophobicContact CG1-CE2 4.36Å; I564-Y652 HydrophobicContact CG1-CG 4.12Å; I564-Y652 HydrophobicContact CG2-CE1 3.83Å; V607-Y652 HydrophobicContact CG1-CE1 4.03Å; L611-Y652 HydrophobicContact CD1-CD1 4.08Å; L611-Y652 HydrophobicContact CD1-CE1 4.3Å; L611-Y652 HydrophobicContact CD1-CG 4.36Å; W648-Y652 VanDerWaalsContact CD1-CB 3.41Å; W648-Y652 PolarHBondContact O-N 3.35Å; Y652-L667 HydrophobicContact CD1-CD2 4.38Å; Y652-L667 HydrophobicContact CE1-CD2 4.46Å; Y652-F671 HydrophobicContact CD1-CD2 4.17Å; Y652-F671 HydrophobicContact CD1-CE2 4.1Å; Y652-F671 WeakPolarHBondContact O-CB 3.32Å; Y652-F671 WeakPolarHBondContact O-CG 3.46Å
653L93.8Very high93.6Very high7 Ų751.3 Ų51.34%0.03724%0.236CC..SBendtrans-124.3121.1-179.7-168.565.6000109.8A649 A678 I681 V682 L685 L713A649-L653 HydrophobicContact CB-CD2 4.21Å; A649-L653 WeakPolarHBondContact O-CB 3.04Å; L653-A678 HydrophobicContact CD1-CB 4.04Å; L653-I681 HydrophobicContact CD1-CB 3.92Å; L653-I681 HydrophobicContact CD1-CD1 4.35Å; L653-I681 HydrophobicContact CD1-CG2 3.85Å; L653-V682 HydrophobicContact CD1-CG2 4.38Å; L653-V682 HydrophobicContact CD2-CG2 3.8Å; L653-V682 HydrophobicContact CG-CG2 4.37Å; L653-L685 HydrophobicContact CD2-CD1 4.31Å; L653-L713 HydrophobicContact CD2-CD2 4.49Å
654L93.4Very high93.6Very high13 Ų1349.9 Ų49.97%0.06823%0.231CC..SBendtrans59.156.8-172.1-47.4177.3000111.4D656 F671 A673 A678 E718 R719 I722L654-D656 PolarHBondContact O-N 3.18Å; L654-F671 VanDerWaalsContact CA-O 3.32Å; L654-F671 WeakPolarHBondContact CA-O 3.46Å; L654-F671 PolarHBondContact N-O 3.28Å; L654-A673 WeakPolarHBondContact CD2-O 3.34Å; L654-A678 HydrophobicContact CD2-CB 3.62Å; L654-E718 HydrophobicContact CD1-CB 3.8Å; L654-R719 HydrophobicContact CD1-CB 4.27Å; L654-R719 HydrophobicContact CD1-CG 3.57Å; L654-R719 HydrophobicContact CG-CG 4.34Å; L654-I722 HydrophobicContact CD1-CD1 3.88Å; L654-I722 HydrophobicContact CD2-CD1 3.58Å; L654-I722 HydrophobicContact CG-CD1 4.33Å
655V90.8Very high93.4Very high11 Ų1154.6 Ų54.67%0.06726%0.256CS..BIsolated β-bridgetrans-59.4121.2-178-175.70000110.2I564 E657 Y660 I663 F671I564-V655 HydrophobicContact CD1-CG2 4.19Å; V655-E657 PolarHBondContact O-N 3.02Å; V655-Y660 HydrophobicContact CG1-CD2 3.89Å; V655-Y660 HydrophobicContact CG1-CE2 3.41Å; V655-Y660 VanDerWaalsContact CG1-CE2 3.41Å; V655-I663 HydrophobicContact CG1-CD1 3.79Å; V655-F671 HydrophobicContact CG2-CB 4.07Å; V655-F671 PolarHBondContact N-O 2.96Å
656D89.5Confident93.3Very high59 Ų5954.7 Ų54.732%0.31626%0.257SS..  trans-79.4112.2174.8-175.8-1000110L654 K658 L659 Y660L654-D656 PolarHBondContact O-N 3.18Å; D656-K658 PolarHBondContact O-N 2.95Å; D656-K658 WeakPolarHBondContact OD1-CB 3.5Å; D656-K658 WeakPolarHBondContact OD1-CG 3.49Å; D656-K658 PolarHBondContact OD1-N 3.46Å; D656-L659 HydrophobicContact CB-CD1 4.09Å; D656-L659 HydrophobicContact CB-CG 4.11Å; D656-L659 PolarHBondContact O-N 3.01Å; D656-L659 VanDerWaalsContact O-N 3.08Å; D656-Y660 WeakPolarHBondContact O-CD2 3.45Å
657E89.3Confident93.4Very high133 Ų13351.2 Ų51.262%0.62124%0.244SC*.G310 helixtrans-57-22179-58.8-173.1168.500113.3V655 L659 Y660 I663V655-E657 PolarHBondContact O-N 3.02Å; E657-L659 VanDerWaalsContact C-N 3.28Å; E657-L659 PolarHBondContact O-N 2.78Å; E657-Y660 VanDerWaalsContact O-O 3.13Å; E657-I663 HydrophobicContact CB-CD1 4.31Å; E657-I663 HydrophobicContact CG-CD1 4.13Å
658K90.6Very high93.4Very high185 Ų18552.2 Ų52.280%0.80425%0.252SS*.G310 helixtrans-73.1-19.2179.6-62.7171.4-171.8160.60113.8D656 Y660D656-K658 PolarHBondContact O-N 2.95Å; D656-K658 WeakPolarHBondContact OD1-CB 3.5Å; D656-K658 WeakPolarHBondContact OD1-CG 3.49Å; D656-K658 PolarHBondContact OD1-N 3.46Å; K658-Y660 VanDerWaalsContact C-N 3.34Å
659L90Very high93.4Very high84 Ų8454.4 Ų54.444%0.4427%0.267SS..G310 helixtrans-84.9-10.8-178.3-61.2179000112.7M563 D656 E657M563-L659 HydrophobicContact SD-CB 4.12Å; D656-L659 HydrophobicContact CB-CD1 4.09Å; D656-L659 HydrophobicContact CB-CG 4.11Å; D656-L659 PolarHBondContact O-N 3.01Å; D656-L659 VanDerWaalsContact O-N 3.08Å; E657-L659 VanDerWaalsContact C-N 3.28Å; E657-L659 PolarHBondContact O-N 2.78Å
660Y92.8Very high93.4Very high36 Ų3654.5 Ų54.514%0.14127%0.267CS..  trans-126.2141.6-174.4-56.6-89.9000111M563 I564 M569 V655 D656 E657 K658 I663M563-Y660 WeakPolarHBondContact CA-OH 3.38Å; M563-Y660 HydrophobicContact CB-CE1 4.11Å; I564-Y660 HydrophobicContact CB-CE1 4.01Å; I564-Y660 PolarHBondContact N-OH 3.08Å; M569-Y660 HydrophobicContact CE-CD1 4.2Å; M569-Y660 HydrophobicContact CE-CE1 4.27Å; V655-Y660 HydrophobicContact CG1-CD2 3.89Å; V655-Y660 HydrophobicContact CG1-CE2 3.41Å; V655-Y660 VanDerWaalsContact CG1-CE2 3.41Å; D656-Y660 WeakPolarHBondContact O-CD2 3.45Å; E657-Y660 VanDerWaalsContact O-O 3.13Å; K658-Y660 VanDerWaalsContact C-N 3.34Å; Y660-I663 HydrophobicContact CD2-CD1 3.8Å; Y660-I663 HydrophobicContact CD2-CG1 4.12Å; Y660-I663 HydrophobicContact CG-CD1 4.16Å; Y660-I663 HydrophobicContact CG-CG1 3.97Å
661E92Very high93.5Very high199 Ų19952.6 Ų52.693%0.9326%0.259SS*.SBendtrans-68-39.4172.7-64.2-167.2164.800111.8
662Q93.8Very high93.6Very high136 Ų13652.7 Ų52.764%0.63626%0.261SS*.  trans-145.8141.9178.2-62.4-177.21400109.5I573I573-Q662 HydrophobicContact CD1-CB 3.92Å
663I95.1Very high93.1Very high39 Ų3955.1 Ų55.120%0.228%0.281CS..  trans-122.2136.9174.7-59.7176.1000108.6M569 V655 E657 Y660 L667M569-I663 HydrophobicContact CE-CB 4.46Å; M569-I663 HydrophobicContact CE-CG1 4.3Å; M569-I663 HydrophobicContact CE-CG2 4.02Å; M569-I663 HydrophobicContact SD-CB 4.38Å; M569-I663 HydrophobicContact SD-CG2 4.13Å; V655-I663 HydrophobicContact CG1-CD1 3.79Å; E657-I663 HydrophobicContact CB-CD1 4.31Å; E657-I663 HydrophobicContact CG-CD1 4.13Å; Y660-I663 HydrophobicContact CD2-CD1 3.8Å; Y660-I663 HydrophobicContact CD2-CG1 4.12Å; Y660-I663 HydrophobicContact CG-CD1 4.16Å; Y660-I663 HydrophobicContact CG-CG1 3.97Å; I663-L667 HydrophobicContact CG2-CB 4.34Å
664S96.1Very high92.8Very high3 Ų362.5 Ų62.52%0.02132%0.32CS..  trans-63.9144.3175.7840000111.1M569 S572 L667 S668M569-S664 PolarHBondContact SD-N 3.26Å; S572-S664 VanDerWaalsContact OG-CB 3.24Å; S572-S664 WeakPolarHBondContact OG-CB 3.27Å; S572-S664 PolarHBondContact OG-OG 3.48Å; S664-L667 PolarHBondContact O-N 2.96Å; S664-L667 WeakPolarHBondContact OG-CB 3.21Å; S664-L667 WeakPolarHBondContact OG-CD1 3.21Å; S664-L667 VanDerWaalsContact OG-CG 3.27Å; S664-L667 WeakPolarHBondContact OG-CG 3.43Å; S664-L667 PolarHBondContact OG-N 3.03Å; S664-S668 WeakPolarHBondContact O-CB 3.33Å; S664-S668 PolarHBondContact O-N 3.22Å
665I95.1Very high92.8Very high104 Ų10463.1 Ų63.153%0.53333%0.325SS..Hα-helixtrans-58.1-44.7178.7-56.9171.6000111.3I581 L667 S668 T669I581-I665 HydrophobicContact CD1-CB 4.49Å; I581-I665 HydrophobicContact CD1-CG2 3.52Å; I665-L667 PolarHBondContact O-N 3.09Å; I665-S668 PolarHBondContact O-N 3.43Å; I665-T669 HydrophobicContact CG2-CG2 4.01Å; I665-T669 WeakPolarHBondContact O-CB 3.32Å; I665-T669 VanDerWaalsContact O-CG2 3.27Å; I665-T669 WeakPolarHBondContact O-CG2 3.47Å; I665-T669 PolarHBondContact O-N 3.42Å; I665-T669 PolarHBondContact O-OG1 3.19Å
666P95.9Very high92.8Very high2 Ų270.7 Ų70.71%0.01336%0.359CS..Hα-helixtrans-56.2-48.9176.7-25.735.5000113.2V579 D605 I608 T669 A670V579-P666 HydrophobicContact CG1-CG 4.35Å; D605-P666 HydrophobicContact CB-CB 3.82Å; D605-P666 HydrophobicContact CB-CG 4.25Å; I608-P666 HydrophobicContact CD1-CB 3.87Å; P666-T669 PolarHBondContact O-N 2.83Å; P666-T669 PolarHBondContact O-OG1 3.22Å; P666-A670 WeakPolarHBondContact O-CB 3.5Å; P666-A670 PolarHBondContact O-N 3.18Å
667L96.3Very high93Very high0 Ų068.5 Ų68.50%035%0.351CS..Hα-helixtrans-66.9-43.7-178.9-66.7173.5000111.7M569 V607 I608 Y652 I663 S664 I665 T669 A670 F671M569-L667 HydrophobicContact CE-CD1 3.9Å; M569-L667 HydrophobicContact SD-CD1 3.76Å; V607-L667 HydrophobicContact CG1-CD2 4.37Å; I608-L667 HydrophobicContact CD1-CD2 4.18Å; I608-L667 HydrophobicContact CG1-CD2 3.85Å; Y652-L667 HydrophobicContact CD1-CD2 4.38Å; Y652-L667 HydrophobicContact CE1-CD2 4.46Å; I663-L667 HydrophobicContact CG2-CB 4.34Å; S664-L667 PolarHBondContact O-N 2.96Å; S664-L667 WeakPolarHBondContact OG-CB 3.21Å; S664-L667 WeakPolarHBondContact OG-CD1 3.21Å; S664-L667 VanDerWaalsContact OG-CG 3.27Å; S664-L667 WeakPolarHBondContact OG-CG 3.43Å; S664-L667 PolarHBondContact OG-N 3.03Å; I665-L667 PolarHBondContact O-N 3.09Å; L667-T669 VanDerWaalsContact C-N 3.34Å; L667-T669 PolarHBondContact O-N 3.19Å; L667-A670 PolarHBondContact O-N 2.97Å; L667-F671 HydrophobicContact CD2-CD2 3.76Å; L667-F671 HydrophobicContact CD2-CE2 3.59Å; L667-F671 WeakPolarHBondContact O-CB 3.42Å; L667-F671 PolarHBondContact O-N 2.73Å
668S95.4Very high93.2Very high35 Ų3562.1 Ų62.125%0.24532%0.321CS..Hα-helixtrans-59.1-44.2176173.30000111.7S664 I665 G672 T675S664-S668 WeakPolarHBondContact O-CB 3.33Å; S664-S668 PolarHBondContact O-N 3.22Å; I665-S668 PolarHBondContact O-N 3.43Å; S668-G672 VanDerWaalsContact O-CA 3.31Å; S668-G672 WeakPolarHBondContact O-CA 3.16Å; S668-G672 PolarHBondContact O-N 3.42Å; S668-T675 WeakPolarHBondContact O-CG2 3.15Å
669T94.4Very high93.3Very high50 Ų5057.7 Ų57.731%0.30730%0.303SS..Hα-helixtrans-72.7-30.8-179.257.40000114.4I581 I665 P666 L667 T675I581-T669 HydrophobicContact CG2-CG2 4.49Å; I581-T669 WeakPolarHBondContact CG2-OG1 3.48Å; I665-T669 HydrophobicContact CG2-CG2 4.01Å; I665-T669 WeakPolarHBondContact O-CB 3.32Å; I665-T669 VanDerWaalsContact O-CG2 3.27Å; I665-T669 WeakPolarHBondContact O-CG2 3.47Å; I665-T669 PolarHBondContact O-N 3.42Å; I665-T669 PolarHBondContact O-OG1 3.19Å; P666-T669 PolarHBondContact O-N 2.83Å; P666-T669 PolarHBondContact O-OG1 3.22Å; L667-T669 VanDerWaalsContact C-N 3.34Å; L667-T669 PolarHBondContact O-N 3.19Å; T669-T675 WeakPolarHBondContact O-CB 3.2Å; T669-T675 WeakPolarHBondContact O-CG2 3.31Å
670A95.5Very high93.6Very high1 Ų158.1 Ų58.11%0.00830%0.299CS..Hα-helixtrans-84.6-34.6179.700000112.9L585 L588 I608 P666 L667 G677 A678L585-A670 HydrophobicContact CD2-CB 3.79Å; L588-A670 HydrophobicContact CD2-CB 3.99Å; I608-A670 HydrophobicContact CD1-CB 3.86Å; P666-A670 WeakPolarHBondContact O-CB 3.5Å; P666-A670 PolarHBondContact O-N 3.18Å; L667-A670 PolarHBondContact O-N 2.97Å; A670-G677 CarbonylContact O-C 3.59Å; A670-G677 VanDerWaalsContact O-C 3.25Å; A670-G677 WeakPolarHBondContact O-CA 3.04Å; A670-A678 PolarHBondContact O-N 3.23Å; A670-A678 VanDerWaalsContact O-N 3.15Å
671F96.3Very high93.8Very high0 Ų056.5 Ų56.50%029%0.293CS..Hα-helixtrans-127.30.1-164.3-58.3-33.8000114.9L588 I608 L611 W648 Y652 L654 V655 L667 I681L588-F671 HydrophobicContact CD1-CE1 4.46Å; L588-F671 HydrophobicContact CD2-CE1 3.85Å; L588-F671 HydrophobicContact CD2-CZ 4.46Å; I608-F671 HydrophobicContact CD1-CE2 4.49Å; I608-F671 HydrophobicContact CG1-CE2 3.93Å; I608-F671 HydrophobicContact CG1-CZ 4.05Å; I608-F671 HydrophobicContact CG2-CZ 4.48Å; L611-F671 HydrophobicContact CD1-CE2 3.66Å; L611-F671 HydrophobicContact CD1-CZ 3.64Å; W648-F671 AromaticContact CZ2-CE1 3.7Å; W648-F671 HydrophobicContact CZ2-CE1 3.7Å; W648-F671 AromaticContact CZ2-CZ 3.84Å; W648-F671 HydrophobicContact CZ2-CZ 3.84Å; Y652-F671 HydrophobicContact CD1-CD2 4.17Å; Y652-F671 HydrophobicContact CD1-CE2 4.1Å; Y652-F671 WeakPolarHBondContact O-CB 3.32Å; Y652-F671 WeakPolarHBondContact O-CG 3.46Å; L654-F671 VanDerWaalsContact CA-O 3.32Å; L654-F671 WeakPolarHBondContact CA-O 3.46Å; L654-F671 PolarHBondContact N-O 3.28Å; V655-F671 HydrophobicContact CG2-CB 4.07Å; V655-F671 PolarHBondContact N-O 2.96Å; L667-F671 HydrophobicContact CD2-CD2 3.76Å; L667-F671 HydrophobicContact CD2-CE2 3.59Å; L667-F671 WeakPolarHBondContact O-CB 3.42Å; L667-F671 PolarHBondContact O-N 2.73Å; F671-I681 HydrophobicContact CD1-CD1 3.54Å; F671-I681 HydrophobicContact CE1-CD1 3.42Å; F671-I681 VanDerWaalsContact CE1-CD1 3.42Å
672G93.7Very high94Very high8 Ų847 Ų478%0.08225%0.248CC..BIsolated β-bridgetrans-64.9158.917800000113.2S668 D674 T675 A678S668-G672 VanDerWaalsContact O-CA 3.31Å; S668-G672 WeakPolarHBondContact O-CA 3.16Å; S668-G672 PolarHBondContact O-N 3.42Å; G672-D674 VanDerWaalsContact C-N 3.32Å; G672-D674 PolarHBondContact O-N 3.47Å; G672-T675 PolarHBondContact N-OG1 3.32Å; G672-T675 WeakPolarHBondContact O-CB 3.35Å; G672-T675 WeakPolarHBondContact O-CG2 3.36Å; G672-T675 PolarHBondContact O-N 3.3Å; G672-T675 PolarHBondContact O-OG1 3.43Å; G672-A678 WeakPolarHBondContact O-CB 3.27Å
673A85.4Confident94.1Very high52 Ų5241.3 Ų41.343%0.4323%0.226SC..THydrogen-bonded Turntrans-55.4-39.8-171.600000114.7L654L654-A673 WeakPolarHBondContact CD2-O 3.34Å
674D87.1Confident94.2Very high162 Ų16240.2 Ų40.287%0.86622%0.22SC*.THydrogen-bonded Turntrans-103.320.5-176-64.2-45000113.3G672G672-D674 VanDerWaalsContact C-N 3.32Å; G672-D674 PolarHBondContact O-N 3.47Å
675T93.6Very high94.3Very high26 Ų2640.1 Ų40.116%0.1622%0.219CC..  trans-93144.6-175.367.70000112.6S668 T669 G672 G677 A678 Q679S668-T675 WeakPolarHBondContact O-CG2 3.15Å; T669-T675 WeakPolarHBondContact O-CB 3.2Å; T669-T675 WeakPolarHBondContact O-CG2 3.31Å; G672-T675 PolarHBondContact N-OG1 3.32Å; G672-T675 WeakPolarHBondContact O-CB 3.35Å; G672-T675 WeakPolarHBondContact O-CG2 3.36Å; G672-T675 PolarHBondContact O-N 3.3Å; G672-T675 PolarHBondContact O-OG1 3.43Å; T675-G677 PolarHBondContact O-N 2.96Å; T675-A678 PolarHBondContact O-N 3.3Å; T675-A678 WeakPolarHBondContact OG1-CB 3.35Å; T675-A678 PolarHBondContact OG1-N 3.32Å; T675-Q679 PolarHBondContact O-N 3.2Å
676E91.8Very high94.5Very high170 Ų17035.2 Ų35.279%0.79419%0.194SC*.Hα-helixtrans-62.7-29171.2-66.9-176.3176.600111.7Q679 W680E676-Q679 PolarHBondContact O-N 3.3Å; E676-W680 WeakPolarHBondContact O-CB 3.1Å; E676-W680 PolarHBondContact O-N 3.37Å
677G92.8Very high94.5Very high13 Ų1341.6 Ų41.613%0.13422%0.224CC..Hα-helixtrans-61.8-48.317600000112.2A670 T675 Q679 W680 I681A670-G677 CarbonylContact O-C 3.59Å; A670-G677 VanDerWaalsContact O-C 3.25Å; A670-G677 WeakPolarHBondContact O-CA 3.04Å; T675-G677 PolarHBondContact O-N 2.96Å; G677-Q679 PolarHBondContact O-N 2.92Å; G677-W680 PolarHBondContact O-N 3.39Å; G677-I681 VanDerWaalsContact O-CG1 3.31Å; G677-I681 WeakPolarHBondContact O-CG1 3.3Å; G677-I681 PolarHBondContact O-N 3.28Å
678A93.1Very high94.6Very high0 Ų041.7 Ų41.70%022%0.224CC..Hα-helixtrans-63.3-40.7176.700000112.2L653 L654 A670 G672 T675 I681 V682L653-A678 HydrophobicContact CD1-CB 4.04Å; L654-A678 HydrophobicContact CD2-CB 3.62Å; A670-A678 PolarHBondContact O-N 3.23Å; A670-A678 VanDerWaalsContact O-N 3.15Å; G672-A678 WeakPolarHBondContact O-CB 3.27Å; T675-A678 PolarHBondContact O-N 3.3Å; T675-A678 WeakPolarHBondContact OG1-CB 3.35Å; T675-A678 PolarHBondContact OG1-N 3.32Å; A678-I681 PolarHBondContact O-N 3.04Å; A678-V682 WeakPolarHBondContact O-CG2 3.28Å; A678-V682 PolarHBondContact O-N 2.99Å
679Q94.2Very high94.7Very high92 Ų9240.1 Ų40.143%0.4321%0.213SC..Hα-helixtrans-62.3-43.8175.9-67.1178.41.900112.2T675 E676 G677 I681 V682 G683 I722T675-Q679 PolarHBondContact O-N 3.2Å; E676-Q679 PolarHBondContact O-N 3.3Å; G677-Q679 PolarHBondContact O-N 2.92Å; Q679-I681 PolarHBondContact O-N 3.49Å; Q679-V682 PolarHBondContact O-N 2.84Å; Q679-G683 PolarHBondContact O-N 2.96Å; Q679-G683 VanDerWaalsContact O-N 3.09Å; Q679-I722 HydrophobicContact CB-CG2 4.27Å; Q679-I722 HydrophobicContact CG-CD1 4.31Å; Q679-I722 HydrophobicContact CG-CG2 4.04Å
680W95.7Very high94.8Very high93 Ų9339.4 Ų39.435%0.35221%0.207SC..Hα-helixtrans-62.4-42.1177.2179.482.9000111.9L588 P591 L615 E676 G677 G683 Y684L588-W680 HydrophobicContact CD1-CZ3 4.45Å; L588-W680 HydrophobicContact CG-CZ3 4.34Å; L588-W680 VanDerWaalsContact O-CH2 3.24Å; L588-W680 WeakPolarHBondContact O-CH2 3.38Å; L588-W680 WeakPolarHBondContact O-CZ3 3.16Å; P591-W680 HydrophobicContact CG-CH2 3.96Å; P591-W680 HydrophobicContact CG-CZ2 4.28Å; L615-W680 HydrophobicContact CD2-CH2 3.68Å; L615-W680 HydrophobicContact CD2-CZ3 3.72Å; E676-W680 WeakPolarHBondContact O-CB 3.1Å; E676-W680 PolarHBondContact O-N 3.37Å; G677-W680 PolarHBondContact O-N 3.39Å; W680-G683 PolarHBondContact O-N 3.11Å; W680-Y684 HydrophobicContact CH2-CD2 4.27Å; W680-Y684 HydrophobicContact CZ2-CD2 4.26Å; W680-Y684 PolarHBondContact O-N 3.42Å
681I96.8Very high94.9Very high1 Ų140.7 Ų40.71%0.00521%0.213CC..Hα-helixtrans-64-45.1177.3-65.8163.4000110.9L588 W648 L653 F671 G677 A678 Q679 G683 Y684 L685L588-I681 HydrophobicContact CD2-CD1 4.33Å; W648-I681 HydrophobicContact CZ2-CD1 3.83Å; W648-I681 HydrophobicContact CZ2-CG1 4.48Å; L653-I681 HydrophobicContact CD1-CB 3.92Å; L653-I681 HydrophobicContact CD1-CD1 4.35Å; L653-I681 HydrophobicContact CD1-CG2 3.85Å; F671-I681 HydrophobicContact CD1-CD1 3.54Å; F671-I681 HydrophobicContact CE1-CD1 3.42Å; F671-I681 VanDerWaalsContact CE1-CD1 3.42Å; G677-I681 VanDerWaalsContact O-CG1 3.31Å; G677-I681 WeakPolarHBondContact O-CG1 3.3Å; G677-I681 PolarHBondContact O-N 3.28Å; A678-I681 PolarHBondContact O-N 3.04Å; Q679-I681 PolarHBondContact O-N 3.49Å; I681-G683 VanDerWaalsContact C-N 3.26Å; I681-G683 PolarHBondContact O-N 3.25Å; I681-Y684 PolarHBondContact O-N 3.36Å; I681-Y684 VanDerWaalsContact O-N 3.14Å; I681-L685 HydrophobicContact CG2-CD1 3.93Å; I681-L685 HydrophobicContact CG2-CG 4.01Å; I681-L685 WeakPolarHBondContact O-CB 3.5Å; I681-L685 VanDerWaalsContact O-CG 3.27Å; I681-L685 WeakPolarHBondContact O-CG 3.48Å; I681-L685 PolarHBondContact O-N 3.44Å
682V96.2Very high94.9Very high0 Ų040.7 Ų40.70%021%0.214CC..Hα-helixtrans-55.3-45175.3170.90000110.8L653 A678 Q679 L686 I722 V723L653-V682 HydrophobicContact CD1-CG2 4.38Å; L653-V682 HydrophobicContact CD2-CG2 3.8Å; L653-V682 HydrophobicContact CG-CG2 4.37Å; A678-V682 WeakPolarHBondContact O-CG2 3.28Å; A678-V682 PolarHBondContact O-N 2.99Å; Q679-V682 PolarHBondContact O-N 2.84Å; V682-L686 WeakPolarHBondContact O-CB 3.23Å; V682-L686 PolarHBondContact O-N 3.37Å; V682-I722 HydrophobicContact CB-CG2 3.92Å; V682-I722 HydrophobicContact CG1-CB 4.31Å; V682-I722 HydrophobicContact CG1-CG2 3.87Å; V682-I722 HydrophobicContact CG2-CB 4.47Å; V682-I722 HydrophobicContact CG2-CG2 4.11Å; V682-V723 HydrophobicContact CG1-CB 3.72Å; V682-V723 HydrophobicContact CG1-CG2 4.05Å
683G96.4Very high94.9Very high17 Ų1740.4 Ų40.418%0.17521%0.21CC..Hα-helixtrans-61-46.6175.500000112.9Q679 W680 I681 L686 E687Q679-G683 PolarHBondContact O-N 2.96Å; Q679-G683 VanDerWaalsContact O-N 3.09Å; W680-G683 PolarHBondContact O-N 3.11Å; I681-G683 VanDerWaalsContact C-N 3.26Å; I681-G683 PolarHBondContact O-N 3.25Å; G683-L686 WeakPolarHBondContact O-CB 3.26Å; G683-L686 PolarHBondContact O-N 3.32Å; G683-E687 WeakPolarHBondContact O-CG 3.17Å; G683-E687 PolarHBondContact O-N 2.9Å
684Y97.5Very high95.3Very high15 Ų1539.7 Ų39.76%0.05920%0.202CC..Hα-helixtrans-61.4-45.9177.9-177.2-85.3000112.4P591 L615 E619 W680 I681 L686 E687 K688P591-Y684 HydrophobicContact CG-CE2 4Å; L615-Y684 HydrophobicContact CD1-CD1 3.5Å; L615-Y684 VanDerWaalsContact CD1-CD1 3.5Å; L615-Y684 HydrophobicContact CD1-CE1 3.2Å; L615-Y684 HydrophobicContact CD1-CG 4.35Å; L615-Y684 HydrophobicContact CG-CD1 4.39Å; L615-Y684 HydrophobicContact CG-CE1 3.96Å; L615-Y684 PolarHBondContact O-OH 3.28Å; E619-Y684 WeakPolarHBondContact CA-OH 3.48Å; E619-Y684 PolarHBondContact N-OH 3.28Å; E619-Y684 VanDerWaalsContact N-OH 3.14Å; W680-Y684 HydrophobicContact CH2-CD2 4.27Å; W680-Y684 HydrophobicContact CZ2-CD2 4.26Å; W680-Y684 PolarHBondContact O-N 3.42Å; I681-Y684 PolarHBondContact O-N 3.36Å; I681-Y684 VanDerWaalsContact O-N 3.14Å; Y684-L686 VanDerWaalsContact C-N 3.28Å; Y684-L686 PolarHBondContact O-N 3.28Å; Y684-E687 PolarHBondContact O-N 3.47Å; Y684-K688 PolarHBondContact O-N 3.06Å
685L98.1Very high95.6Very high1 Ų134.1 Ų34.11%0.00517%0.174CC..Hα-helixtrans-61.6-39.4178-66.1-177000111.2L645 A649 L653 I681 K688 V689 L713L645-L685 HydrophobicContact CB-CD2 3.78Å; L645-L685 HydrophobicContact CD1-CD2 3.77Å; L645-L685 HydrophobicContact CD2-CD2 3.77Å; L645-L685 HydrophobicContact CG-CD2 3.95Å; A649-L685 HydrophobicContact CB-CD1 4.08Å; L653-L685 HydrophobicContact CD2-CD1 4.31Å; I681-L685 HydrophobicContact CG2-CD1 3.93Å; I681-L685 HydrophobicContact CG2-CG 4.01Å; I681-L685 WeakPolarHBondContact O-CB 3.5Å; I681-L685 VanDerWaalsContact O-CG 3.27Å; I681-L685 WeakPolarHBondContact O-CG 3.48Å; I681-L685 PolarHBondContact O-N 3.44Å; L685-K688 WeakPolarHBondContact O-CB 3.38Å; L685-K688 PolarHBondContact O-N 2.88Å; L685-V689 WeakPolarHBondContact O-CG2 3.45Å; L685-V689 PolarHBondContact O-N 3.46Å; L685-L713 HydrophobicContact CB-CD1 3.94Å; L685-L713 HydrophobicContact CB-CD2 4.23Å; L685-L713 HydrophobicContact CD1-CD2 3.8Å
686L98.1Very high95.6Very high2 Ų233.4 Ų33.41%0.0117%0.168CC..Hα-helixtrans-64.7-43.5174.5179.664.8000112V682 G683 Y684 K688 V689 I690 L710 V723 C726 W729V682-L686 WeakPolarHBondContact O-CB 3.23Å; V682-L686 PolarHBondContact O-N 3.37Å; G683-L686 WeakPolarHBondContact O-CB 3.26Å; G683-L686 PolarHBondContact O-N 3.32Å; Y684-L686 VanDerWaalsContact C-N 3.28Å; Y684-L686 PolarHBondContact O-N 3.28Å; L686-K688 VanDerWaalsContact C-N 3.3Å; L686-K688 PolarHBondContact O-N 3.34Å; L686-V689 PolarHBondContact O-N 3.23Å; L686-I690 HydrophobicContact CD1-CD1 4.24Å; L686-I690 HydrophobicContact CD1-CG1 4.49Å; L686-I690 HydrophobicContact CG-CD1 3.99Å; L686-I690 VanDerWaalsContact O-CG1 3.29Å; L686-I690 WeakPolarHBondContact O-CG1 3.45Å; L686-I690 PolarHBondContact O-N 3.13Å; L686-L710 HydrophobicContact CD1-CD1 3.77Å; L686-V723 HydrophobicContact CB-CG2 4.43Å; L686-V723 HydrophobicContact CD1-CG2 4.23Å; L686-V723 HydrophobicContact CD2-CG2 3.95Å; L686-V723 HydrophobicContact CG-CG2 4.44Å; L686-C726 HydrophobicContact CD2-CB 3.56Å; L686-W729 HydrophobicContact CD1-CE3 4.03Å; L686-W729 HydrophobicContact CD2-CB 3.94Å
687E97.1Very high95.5Very high135 Ų13527.3 Ų27.363%0.63114%0.144SC*.Hα-helixtrans-60.7-40.6174.4-73.8-176.3178.600111.8G683 Y684 I690 N691G683-E687 WeakPolarHBondContact O-CG 3.17Å; G683-E687 PolarHBondContact O-N 2.9Å; Y684-E687 PolarHBondContact O-N 3.47Å; E687-I690 PolarHBondContact O-N 3.07Å; E687-N691 WeakPolarHBondContact O-CB 3.4Å; E687-N691 PolarHBondContact O-N 3.18Å
688K97.6Very high95.4Very high3 Ų330.6 Ų30.61%0.01317%0.165CC..Hα-helixtrans-61.2-46.1175.3177.955.9176.4167.80111.6S618 E621 L645 Y684 L685 L686 N691 N692S618-K688 WeakPolarHBondContact OG-CE 3.16Å; E621-K688 IonicContact OE1-NZ 2.64Å; E621-K688 PolarHBondContact OE1-NZ 2.95Å; E621-K688 VanDerWaalsContact OE1-NZ 3.08Å; E621-K688 IonicContact OE2-NZ 2.89Å; E621-K688 PolarHBondContact OE2-NZ 2.81Å; L645-K688 HydrophobicContact CD1-CG 4.09Å; Y684-K688 PolarHBondContact O-N 3.06Å; L685-K688 WeakPolarHBondContact O-CB 3.38Å; L685-K688 PolarHBondContact O-N 2.88Å; L686-K688 VanDerWaalsContact C-N 3.3Å; L686-K688 PolarHBondContact O-N 3.34Å; K688-N691 PolarHBondContact O-N 3.5Å; K688-N692 VanDerWaalsContact CE-OD1 3.3Å; K688-N692 WeakPolarHBondContact CE-OD1 3.24Å; K688-N692 PolarHBondContact NZ-OD1 3.06Å; K688-N692 WeakPolarHBondContact O-CB 3.42Å; K688-N692 PolarHBondContact O-N 3.04Å; K688-N692 PolarHBondContact O-OD1 3.31Å
689V98.1Very high95.3Very high1 Ų133.9 Ų33.91%0.00618%0.181CC..Hα-helixtrans-57.8-50.3174.5166.70000111L685 L686 N691 N692 L693 T706 L709 L710L685-V689 WeakPolarHBondContact O-CG2 3.45Å; L685-V689 PolarHBondContact O-N 3.46Å; L686-V689 PolarHBondContact O-N 3.23Å; V689-N691 VanDerWaalsContact C-N 3.31Å; V689-N691 PolarHBondContact O-N 2.91Å; V689-N692 PolarHBondContact O-N 3Å; V689-L693 HydrophobicContact CG1-CD1 3.73Å; V689-L693 HydrophobicContact CG1-CG 4.19Å; V689-L693 WeakPolarHBondContact O-CB 3.34Å; V689-L693 WeakPolarHBondContact O-CG 3.27Å; V689-L693 PolarHBondContact O-N 3.3Å; V689-T706 HydrophobicContact CB-CG2 4.25Å; V689-T706 HydrophobicContact CG1-CG2 4.08Å; V689-T706 HydrophobicContact CG2-CG2 4.25Å; V689-L709 HydrophobicContact CG2-CB 4.35Å; V689-L709 HydrophobicContact CG2-CD2 3.98Å; V689-L709 HydrophobicContact CG2-CG 4.05Å; V689-L710 HydrophobicContact CG1-CB 3.96Å; V689-L710 HydrophobicContact CG1-CD1 4.03Å; V689-L710 HydrophobicContact CG1-CD2 4.17Å; V689-L710 HydrophobicContact CG1-CG 4.26Å; V689-L710 HydrophobicContact CG2-CB 4.31Å
690I96.8Very high95.2Very high35 Ų3532.7 Ų32.718%0.17918%0.18CC..Hα-helixtrans-60.4-43.4-178.6-68.6166000110.8L686 E687 S694 G728 L732L686-I690 HydrophobicContact CD1-CD1 4.24Å; L686-I690 HydrophobicContact CD1-CG1 4.49Å; L686-I690 HydrophobicContact CG-CD1 3.99Å; L686-I690 VanDerWaalsContact O-CG1 3.29Å; L686-I690 WeakPolarHBondContact O-CG1 3.45Å; L686-I690 PolarHBondContact O-N 3.13Å; E687-I690 PolarHBondContact O-N 3.07Å; I690-S694 WeakPolarHBondContact O-CB 3.3Å; I690-S694 PolarHBondContact O-N 3.05Å; I690-S694 PolarHBondContact O-OG 3.23Å; I690-G728 WeakPolarHBondContact CD1-O 3.5Å; I690-L732 HydrophobicContact CD1-CB 4.41Å; I690-L732 HydrophobicContact CG1-CB 4.34Å; I690-L732 HydrophobicContact CG1-CD1 4.47Å; I690-L732 HydrophobicContact CG1-CD2 4.3Å
691N95.7Very high95Very high28 Ų2832.9 Ų32.915%0.1519%0.185CC..Hα-helixtrans-61.2-49.3177177.269.4000111.3T625 E687 K688 V689 S694 V695T625-N691 VanDerWaalsContact OG1-CG 3.3Å; T625-N691 PolarHBondContact OG1-ND2 2.74Å; T625-N691 PolarHBondContact OG1-OD1 3.21Å; E687-N691 WeakPolarHBondContact O-CB 3.4Å; E687-N691 PolarHBondContact O-N 3.18Å; K688-N691 PolarHBondContact O-N 3.5Å; V689-N691 VanDerWaalsContact C-N 3.31Å; V689-N691 PolarHBondContact O-N 2.91Å; N691-S694 WeakPolarHBondContact O-CB 3.49Å; N691-S694 PolarHBondContact O-N 3.39Å; N691-S694 VanDerWaalsContact O-N 3.17Å; N691-V695 WeakPolarHBondContact O-CG2 3.31Å; N691-V695 PolarHBondContact O-N 3.5Å
692N96.5Very high94.9Very high1 Ų132.9 Ų32.91%0.00519%0.185CC..Hα-helixtrans-63.6-48.8-178.4-82.224.6000112.2V642 K688 V689 S694 V695 W696 T706V642-N692 WeakPolarHBondContact CG2-ND2 3.48Å; K688-N692 VanDerWaalsContact CE-OD1 3.3Å; K688-N692 WeakPolarHBondContact CE-OD1 3.24Å; K688-N692 PolarHBondContact NZ-OD1 3.06Å; K688-N692 WeakPolarHBondContact O-CB 3.42Å; K688-N692 PolarHBondContact O-N 3.04Å; K688-N692 PolarHBondContact O-OD1 3.31Å; V689-N692 PolarHBondContact O-N 3Å; N692-S694 PolarHBondContact O-N 3.49Å; N692-V695 PolarHBondContact O-N 3.32Å; N692-V695 VanDerWaalsContact O-N 3.08Å; N692-W696 WeakPolarHBondContact O-CB 3.4Å; N692-W696 PolarHBondContact O-N 3.27Å; N692-T706 HydrophobicContact CB-CG2 3.53Å; N692-T706 PolarHBondContact ND2-OG1 3.05Å
693L95.4Very high94.9Very high1 Ų133 Ų331%0.00519%0.185CC..Hα-helixtrans-62-17.8177.2-66.4-179.5000113.3V689 T706 L743 L746 V750 L754V689-L693 HydrophobicContact CG1-CD1 3.73Å; V689-L693 HydrophobicContact CG1-CG 4.19Å; V689-L693 WeakPolarHBondContact O-CB 3.34Å; V689-L693 WeakPolarHBondContact O-CG 3.27Å; V689-L693 PolarHBondContact O-N 3.3Å; L693-T706 HydrophobicContact CD2-CG2 3.93Å; L693-T706 HydrophobicContact CG-CG2 3.86Å; L693-L743 HydrophobicContact CB-CD2 3.84Å; L693-L746 HydrophobicContact CB-CD1 4.37Å; L693-L746 HydrophobicContact CD2-CD1 4.18Å; L693-V750 HydrophobicContact CD2-CG1 3.95Å; L693-L754 HydrophobicContact CD1-CD1 3.52Å
694S92.9Very high94.9Very high37 Ų3734.4 Ų34.426%0.25919%0.189SC..Hα-helixtrans-84.5-21.3177.7-62.60000114.1I690 N691 N692 P742I690-S694 WeakPolarHBondContact O-CB 3.3Å; I690-S694 PolarHBondContact O-N 3.05Å; I690-S694 PolarHBondContact O-OG 3.23Å; N691-S694 WeakPolarHBondContact O-CB 3.49Å; N691-S694 PolarHBondContact O-N 3.39Å; N691-S694 VanDerWaalsContact O-N 3.17Å; N692-S694 PolarHBondContact O-N 3.49Å; S694-P742 VanDerWaalsContact O-CB 3.24Å; S694-P742 WeakPolarHBondContact O-CB 3.36Å
695V93.2Very high94.8Very high45 Ų4535 Ų3527%0.27319%0.193SC..Hα-helixtrans-126.8-25.8-170.5-55.90000114.4T625 T630 N691 N692 S697T625-V695 HydrophobicContact CG2-CG2 3.89Å; T630-V695 HydrophobicContact CG2-CB 4.27Å; T630-V695 HydrophobicContact CG2-CG2 4.2Å; N691-V695 WeakPolarHBondContact O-CG2 3.31Å; N691-V695 PolarHBondContact O-N 3.5Å; N692-V695 PolarHBondContact O-N 3.32Å; N692-V695 VanDerWaalsContact O-N 3.08Å; V695-S697 PolarHBondContact O-N 2.94Å
696W93.6Very high94.8Very high12 Ų1235 Ų355%0.04519%0.193CC..  trans-98.637.8-173.7-67.6125.1000113.3E621 T630 L633 P635 N692 S698 E699 L702E621-W696 PolarHBondContact OE1-NE1 3.35Å; T630-W696 HydrophobicContact CG2-CD2 4.29Å; T630-W696 HydrophobicContact CG2-CE3 4.2Å; T630-W696 HydrophobicContact CG2-CH2 3.87Å; T630-W696 HydrophobicContact CG2-CZ2 3.94Å; T630-W696 HydrophobicContact CG2-CZ3 4Å; L633-W696 HydrophobicContact CB-CH2 3.86Å; L633-W696 HydrophobicContact CB-CZ2 3.83Å; L633-W696 HydrophobicContact CD1-CZ2 4.08Å; P635-W696 HydrophobicContact CB-CH2 4.49Å; P635-W696 HydrophobicContact CB-CZ3 4.27Å; N692-W696 WeakPolarHBondContact O-CB 3.4Å; N692-W696 PolarHBondContact O-N 3.27Å; W696-S698 VanDerWaalsContact C-N 3.28Å; W696-S698 PolarHBondContact O-N 3.3Å; W696-E699 HydrophobicContact CE3-CB 4.32Å; W696-E699 HydrophobicContact CE3-CG 3.52Å; W696-E699 HydrophobicContact CZ3-CG 3.87Å; W696-E699 PolarHBondContact O-N 3Å; W696-L702 HydrophobicContact CB-CD2 4.07Å; W696-L702 HydrophobicContact CB-CG 4.33Å; W696-L702 HydrophobicContact CD2-CD2 3.61Å; W696-L702 HydrophobicContact CE3-CD2 4.2Å; W696-L702 HydrophobicContact CG-CD2 3.54Å; W696-L702 HydrophobicContact CG-CG 4.25Å; W696-L702 HydrophobicContact CZ2-CD2 4.4Å
697S90.3Very high94.8Very high41 Ų4134.9 Ų34.929%0.28719%0.193SC..SBendtrans-71.9-19.717958.60000114V695V695-S697 PolarHBondContact O-N 2.94Å
698S89.6Confident94.8Very high83 Ų8330.8 Ų30.858%0.5817%0.173SC*.SBendtrans-76.2-28.1174.356.80000112.7W696 T700W696-S698 VanDerWaalsContact C-N 3.28Å; W696-S698 PolarHBondContact O-N 3.3Å; S698-T700 PolarHBondContact O-N 3.4Å
699E92Very high94.8Very high69 Ų6930.7 Ų30.732%0.32217%0.173SC..  trans-99.788.5-174.3-50.7-51.5129.200109.6P635 W696 E701 L702 A703P635-E699 HydrophobicContact CB-CB 4.46Å; P635-E699 HydrophobicContact CB-CG 3.94Å; W696-E699 HydrophobicContact CE3-CB 4.32Å; W696-E699 HydrophobicContact CE3-CG 3.52Å; W696-E699 HydrophobicContact CZ3-CG 3.87Å; W696-E699 PolarHBondContact O-N 3Å; E699-E701 VanDerWaalsContact C-N 3.35Å; E699-E701 PolarHBondContact O-N 3.44Å; E699-L702 HydrophobicContact CB-CB 4.01Å; E699-L702 PolarHBondContact O-N 3.46Å; E699-A703 WeakPolarHBondContact O-CB 3.47Å; E699-A703 PolarHBondContact O-N 2.97Å
700T90.7Very high94.8Very high67 Ų6730.6 Ų30.641%0.41117%0.173SC..Hα-helixtrans-63.5-38.2-170.3-650000112.8S698 A703 N704S698-T700 PolarHBondContact O-N 3.4Å; T700-A703 PolarHBondContact O-N 3.3Å; T700-N704 WeakPolarHBondContact O-CB 3.38Å; T700-N704 PolarHBondContact O-N 2.93Å; T700-N704 PolarHBondContact O-ND2 3.2Å
701E92.1Very high94.8Very high97 Ų9729.3 Ų29.345%0.45317%0.166SC..Hα-helixtrans-64-48.2176.8-64.8-171.7177.400112.3K639 E699 A703 N704 D705K639-E701 HydrophobicContact CD-CB 4.33Å; K639-E701 IonicContact NZ-OE2 3.41Å; K639-E701 PolarHBondContact NZ-OE2 3.34Å; E699-E701 VanDerWaalsContact C-N 3.35Å; E699-E701 PolarHBondContact O-N 3.44Å; E701-A703 VanDerWaalsContact C-N 3.3Å; E701-A703 PolarHBondContact O-N 2.95Å; E701-N704 WeakPolarHBondContact O-CB 3.45Å; E701-N704 PolarHBondContact O-N 3.03Å; E701-N704 VanDerWaalsContact O-N 3.16Å; E701-D705 PolarHBondContact O-N 2.92Å
702L95.6Very high94.8Very high1 Ų128 Ų281%0.00516%0.159CC..Hα-helixtrans-62.5-38.3177.4177.354.1000111.8P635 G638 K639 V642 W696 E699 T706P635-L702 HydrophobicContact CB-CD2 4.4Å; G638-L702 WeakPolarHBondContact O-CD1 3.43Å; K639-L702 HydrophobicContact CG-CB 4.15Å; K639-L702 HydrophobicContact CG-CD1 4.18Å; V642-L702 HydrophobicContact CG2-CD1 4.11Å; W696-L702 HydrophobicContact CB-CD2 4.07Å; W696-L702 HydrophobicContact CB-CG 4.33Å; W696-L702 HydrophobicContact CD2-CD2 3.61Å; W696-L702 HydrophobicContact CE3-CD2 4.2Å; W696-L702 HydrophobicContact CG-CD2 3.54Å; W696-L702 HydrophobicContact CG-CG 4.25Å; W696-L702 HydrophobicContact CZ2-CD2 4.4Å; E699-L702 HydrophobicContact CB-CB 4.01Å; E699-L702 PolarHBondContact O-N 3.46Å; L702-T706 WeakPolarHBondContact O-CB 3.29Å; L702-T706 PolarHBondContact O-N 3.35Å; L702-T706 PolarHBondContact O-OG1 3.03Å
703A96.3Very high94.8Very high2 Ų227.9 Ų27.92%0.01716%0.159CC..Hα-helixtrans-65.5-40.1175.100000112.1E699 T700 E701 T706 V707 L746 V750E699-A703 WeakPolarHBondContact O-CB 3.47Å; E699-A703 PolarHBondContact O-N 2.97Å; T700-A703 PolarHBondContact O-N 3.3Å; E701-A703 VanDerWaalsContact C-N 3.3Å; E701-A703 PolarHBondContact O-N 2.95Å; A703-T706 PolarHBondContact O-N 3.43Å; A703-V707 PolarHBondContact O-N 3.33Å; A703-L746 HydrophobicContact CB-CD2 4.44Å; A703-V750 HydrophobicContact CB-CG1 4.42Å; A703-V750 HydrophobicContact CB-CG2 3.74Å
704N95.5Very high94.9Very high47 Ų4728 Ų2825%0.25116%0.16SC..Hα-helixtrans-64.2-48.7173.9-79-37.2000111.4T700 E701 T706 V707 E708 S749 V750T700-N704 WeakPolarHBondContact O-CB 3.38Å; T700-N704 PolarHBondContact O-N 2.93Å; T700-N704 PolarHBondContact O-ND2 3.2Å; E701-N704 WeakPolarHBondContact O-CB 3.45Å; E701-N704 PolarHBondContact O-N 3.03Å; E701-N704 VanDerWaalsContact O-N 3.16Å; N704-T706 PolarHBondContact O-N 3.31Å; N704-V707 WeakPolarHBondContact O-CG1 3.36Å; N704-V707 PolarHBondContact O-N 3.07Å; N704-E708 WeakPolarHBondContact O-CB 3.49Å; N704-E708 WeakPolarHBondContact O-CG 3.36Å; N704-E708 PolarHBondContact O-N 3.25Å; N704-S749 PolarHBondContact OD1-OG 2.91Å; N704-V750 WeakPolarHBondContact OD1-CG2 3.26Å
705D96.1Very high94.8Very high27 Ų2729.5 Ų29.514%0.14416%0.162CC..Hα-helixtrans-58.2-39.9175.4-84.2-5.7000111.2R474 V642 E701 E708 L709R474-D705 IonicContact CZ-OD2 2.94Å; R474-D705 IonicContact NH1-OD2 3.84Å; R474-D705 PolarHBondContact NH1-OD2 2.97Å; R474-D705 IonicContact NH2-OD1 3.43Å; R474-D705 PolarHBondContact NH2-OD1 3.01Å; R474-D705 IonicContact NH2-OD2 2.76Å; R474-D705 PolarHBondContact NH2-OD2 2.87Å; V642-D705 VanDerWaalsContact CG1-C 3.43Å; V642-D705 HydrophobicContact CG1-CB 3.96Å; V642-D705 VanDerWaalsContact CG1-O 3.22Å; V642-D705 WeakPolarHBondContact CG1-O 3.48Å; E701-D705 PolarHBondContact O-N 2.92Å; D705-E708 PolarHBondContact O-N 3.45Å; D705-L709 PolarHBondContact O-N 3.41Å
706T98.3Very high94.6Very high1 Ų130.8 Ų30.81%0.00616%0.164CC..Hα-helixtrans-64.6-43.5179.1-64.20000111.8V689 N692 L693 L702 A703 N704 E708 L709 L710V689-T706 HydrophobicContact CB-CG2 4.25Å; V689-T706 HydrophobicContact CG1-CG2 4.08Å; V689-T706 HydrophobicContact CG2-CG2 4.25Å; N692-T706 HydrophobicContact CB-CG2 3.53Å; N692-T706 PolarHBondContact ND2-OG1 3.05Å; L693-T706 HydrophobicContact CD2-CG2 3.93Å; L693-T706 HydrophobicContact CG-CG2 3.86Å; L702-T706 WeakPolarHBondContact O-CB 3.29Å; L702-T706 PolarHBondContact O-N 3.35Å; L702-T706 PolarHBondContact O-OG1 3.03Å; A703-T706 PolarHBondContact O-N 3.43Å; N704-T706 PolarHBondContact O-N 3.31Å; T706-E708 VanDerWaalsContact C-N 3.35Å; T706-L709 WeakPolarHBondContact O-CB 3.34Å; T706-L709 PolarHBondContact O-N 3.4Å; T706-L710 PolarHBondContact O-N 3.33Å
707V97.6Very high94.5Very high0 Ų037.5 Ų37.50%019%0.189CC..Hα-helixtrans-73.8-28.9177.870.30000111.8A703 N704 L709 L710 V711 V750 L754A703-V707 PolarHBondContact O-N 3.33Å; N704-V707 WeakPolarHBondContact O-CG1 3.36Å; N704-V707 PolarHBondContact O-N 3.07Å; V707-L709 VanDerWaalsContact C-N 3.33Å; V707-L709 PolarHBondContact O-N 2.9Å; V707-L710 CarbonylContact O-C 3.57Å; V707-L710 WeakPolarHBondContact O-CA 3.49Å; V707-L710 VanDerWaalsContact O-CB 3.25Å; V707-L710 WeakPolarHBondContact O-CB 3.36Å; V707-L710 PolarHBondContact O-N 3.28Å; V707-V711 WeakPolarHBondContact O-CG2 3.36Å; V707-V711 PolarHBondContact O-N 3.33Å; V707-V750 HydrophobicContact CB-CG1 4.25Å; V707-V750 HydrophobicContact CG1-CG1 4.16Å; V707-L754 HydrophobicContact CG2-CB 4.03Å; V707-L754 HydrophobicContact CG2-CD1 4.2Å
708E96.6Very high94.5Very high48 Ų4840.8 Ų40.822%0.22420%0.2CC..Hα-helixtrans-66.5-33.4171.1-81.3-61.7127.700112.8R646 N704 D705 T706 L710 V711 T712R646-E708 IonicContact CZ-OE2 2.9Å; R646-E708 IonicContact NH2-OE2 2.61Å; R646-E708 PolarHBondContact NH2-OE2 3.49Å; N704-E708 WeakPolarHBondContact O-CB 3.49Å; N704-E708 WeakPolarHBondContact O-CG 3.36Å; N704-E708 PolarHBondContact O-N 3.25Å; D705-E708 PolarHBondContact O-N 3.45Å; T706-E708 VanDerWaalsContact C-N 3.35Å; E708-L710 VanDerWaalsContact C-N 3.34Å; E708-V711 PolarHBondContact O-N 3.08Å; E708-T712 WeakPolarHBondContact O-CB 3.36Å; E708-T712 PolarHBondContact O-N 3.37Å; E708-T712 PolarHBondContact O-OG1 2.83Å
709L97.8Very high94.7Very high1 Ų137.1 Ų37.11%0.00517%0.174CC..Hα-helixtrans-61.9-42.6166.8175.561.4000111V642 L645 R646 V689 D705 T706 V707 T712 L713V642-L709 HydrophobicContact CG1-CB 4Å; V642-L709 HydrophobicContact CG1-CD2 4.21Å; L645-L709 HydrophobicContact CB-CD1 4.39Å; L645-L709 HydrophobicContact CB-CD2 4.12Å; R646-L709 HydrophobicContact CB-CD1 3.95Å; R646-L709 HydrophobicContact CG-CD1 4.5Å; V689-L709 HydrophobicContact CG2-CB 4.35Å; V689-L709 HydrophobicContact CG2-CD2 3.98Å; V689-L709 HydrophobicContact CG2-CG 4.05Å; D705-L709 PolarHBondContact O-N 3.41Å; T706-L709 WeakPolarHBondContact O-CB 3.34Å; T706-L709 PolarHBondContact O-N 3.4Å; V707-L709 VanDerWaalsContact C-N 3.33Å; V707-L709 PolarHBondContact O-N 2.9Å; L709-T712 WeakPolarHBondContact O-CB 3.46Å; L709-T712 PolarHBondContact O-N 3.47Å; L709-L713 WeakPolarHBondContact O-CG 3.32Å; L709-L713 PolarHBondContact O-N 2.98Å; L709-L713 VanDerWaalsContact O-N 3.11Å
710L98.3Very high94.9Very high0 Ų033.9 Ų33.90%016%0.159CC..Hα-helixtrans-61.2-46.1175.5-169.861.6000112.1L686 V689 T706 V707 E708 T712 L713 V714 W729 L732 L754 A757L686-L710 HydrophobicContact CD1-CD1 3.77Å; V689-L710 HydrophobicContact CG1-CB 3.96Å; V689-L710 HydrophobicContact CG1-CD1 4.03Å; V689-L710 HydrophobicContact CG1-CD2 4.17Å; V689-L710 HydrophobicContact CG1-CG 4.26Å; V689-L710 HydrophobicContact CG2-CB 4.31Å; T706-L710 PolarHBondContact O-N 3.33Å; V707-L710 CarbonylContact O-C 3.57Å; V707-L710 WeakPolarHBondContact O-CA 3.49Å; V707-L710 VanDerWaalsContact O-CB 3.25Å; V707-L710 WeakPolarHBondContact O-CB 3.36Å; V707-L710 PolarHBondContact O-N 3.28Å; E708-L710 VanDerWaalsContact C-N 3.34Å; L710-T712 VanDerWaalsContact C-N 3.26Å; L710-T712 PolarHBondContact O-N 3.21Å; L710-L713 WeakPolarHBondContact O-CB 3.44Å; L710-L713 PolarHBondContact O-N 3.27Å; L710-L713 VanDerWaalsContact O-N 3.08Å; L710-V714 PolarHBondContact O-N 3.31Å; L710-W729 HydrophobicContact CD1-CE3 4.29Å; L710-W729 HydrophobicContact CD1-CZ3 3.7Å; L710-W729 HydrophobicContact CD2-CZ3 4.3Å; L710-W729 HydrophobicContact CG-CZ3 4.13Å; L710-L732 HydrophobicContact CD2-CD2 3.89Å; L710-L754 HydrophobicContact CD2-CD1 3.68Å; L710-A757 HydrophobicContact CD2-CB 3.92Å; L710-A757 HydrophobicContact CG-CB 3.94Å
711V97.5Very high95Very high7 Ų732.9 Ų32.94%0.04215%0.151CC..Hα-helixtrans-57.4-42.9174.81730000110.1V707 E708 L713 V714 E715 K756 A757 L760V707-V711 WeakPolarHBondContact O-CG2 3.36Å; V707-V711 PolarHBondContact O-N 3.33Å; E708-V711 PolarHBondContact O-N 3.08Å; V711-L713 VanDerWaalsContact C-N 3.25Å; V711-L713 PolarHBondContact O-N 2.82Å; V711-V714 CarbonylContact O-C 3.59Å; V711-V714 WeakPolarHBondContact O-CG2 3.34Å; V711-V714 PolarHBondContact O-N 3.01Å; V711-E715 WeakPolarHBondContact O-CB 3.4Å; V711-E715 PolarHBondContact O-N 3Å; V711-K756 HydrophobicContact CG2-CD 4.46Å; V711-A757 HydrophobicContact CG2-CB 3.98Å; V711-L760 HydrophobicContact CG1-CD1 4.46Å
712T95.9Very high95.1Very high0 Ų029.2 Ų29.20%013%0.134CC..Hα-helixtrans-59.2-35.2177-57.10000112R646 A649 K650 E708 L709 L710 V714 R719R646-T712 HydrophobicContact CG-CG2 4.17Å; R646-T712 WeakPolarHBondContact CG-OG1 3.43Å; R646-T712 PolarHBondContact NE-OG1 3.08Å; A649-T712 HydrophobicContact CB-CG2 4.24Å; K650-T712 HydrophobicContact CD-CG2 4.34Å; K650-T712 HydrophobicContact CG-CG2 3.72Å; E708-T712 WeakPolarHBondContact O-CB 3.36Å; E708-T712 PolarHBondContact O-N 3.37Å; E708-T712 PolarHBondContact O-OG1 2.83Å; L709-T712 WeakPolarHBondContact O-CB 3.46Å; L709-T712 PolarHBondContact O-N 3.47Å; L710-T712 VanDerWaalsContact C-N 3.26Å; L710-T712 PolarHBondContact O-N 3.21Å; T712-V714 VanDerWaalsContact C-N 3.27Å; T712-V714 PolarHBondContact O-N 3.03Å; T712-R719 VanDerWaalsContact O-CZ 3.23Å; T712-R719 PolarHBondContact O-NE 3.35Å; T712-R719 PolarHBondContact O-NH2 3.16Å
713L96.7Very high95.1Very high0 Ų029.1 Ų29.10%013%0.134CC..Hα-helixtrans-69.4-21.2176.1-63.8177.9000113.7A649 L653 L685 L709 L710 V711 R719 A720A649-L713 HydrophobicContact CB-CD2 4.46Å; L653-L713 HydrophobicContact CD2-CD2 4.49Å; L685-L713 HydrophobicContact CB-CD1 3.94Å; L685-L713 HydrophobicContact CB-CD2 4.23Å; L685-L713 HydrophobicContact CD1-CD2 3.8Å; L709-L713 WeakPolarHBondContact O-CG 3.32Å; L709-L713 PolarHBondContact O-N 2.98Å; L709-L713 VanDerWaalsContact O-N 3.11Å; L710-L713 WeakPolarHBondContact O-CB 3.44Å; L710-L713 PolarHBondContact O-N 3.27Å; L710-L713 VanDerWaalsContact O-N 3.08Å; V711-L713 VanDerWaalsContact C-N 3.25Å; V711-L713 PolarHBondContact O-N 2.82Å; L713-R719 CarbonylContact O-C 3.52Å; L713-R719 WeakPolarHBondContact O-CB 3.44Å; L713-A720 PolarHBondContact O-N 3.45Å
714V96.3Very high95.1Very high4 Ų429.4 Ų29.42%0.02414%0.135CC..Hα-helixtrans-115.7-10.1-176.8-65.20000114.9L710 V711 T712 K716 A720 V723 W729 A757 L760L710-V714 PolarHBondContact O-N 3.31Å; V711-V714 CarbonylContact O-C 3.59Å; V711-V714 WeakPolarHBondContact O-CG2 3.34Å; V711-V714 PolarHBondContact O-N 3.01Å; T712-V714 VanDerWaalsContact C-N 3.27Å; T712-V714 PolarHBondContact O-N 3.03Å; V714-K716 VanDerWaalsContact C-N 3.33Å; V714-K716 PolarHBondContact O-N 3.02Å; V714-A720 HydrophobicContact CB-CB 4.46Å; V714-V723 HydrophobicContact CG1-CG1 3.62Å; V714-W729 HydrophobicContact CG1-CH2 3.68Å; V714-W729 HydrophobicContact CG1-CZ2 4.31Å; V714-W729 HydrophobicContact CG1-CZ3 4.03Å; V714-A757 HydrophobicContact CG2-CB 3.95Å; V714-L760 HydrophobicContact CB-CB 4.2Å; V714-L760 HydrophobicContact CG2-CB 3.89Å; V714-L760 HydrophobicContact CG2-CD1 4.21Å
715E91.1Very high94.9Very high67 Ų6734 Ų3431%0.31316%0.155SC..Hα-helixtrans-63.4-37.7-178.474.4-173.9175.900112.4V711 R719V711-E715 WeakPolarHBondContact O-CB 3.4Å; V711-E715 PolarHBondContact O-N 3Å; E715-R719 IonicContact OE1-CZ 3.93Å; E715-R719 IonicContact OE1-NH2 2.72Å; E715-R719 PolarHBondContact OE1-NH2 3.4Å
716K89.9Confident94.9Very high72 Ų7234 Ų3431%0.31316%0.157SC..SBendtrans-99.3130.3176.6-73.3-167177.2-173.80109.4T561 V714 E718 R719 A720T561-K716 VanDerWaalsContact CG2-NZ 3.28Å; T561-K716 PolarHBondContact OG1-NZ 2.97Å; V714-K716 VanDerWaalsContact C-N 3.33Å; V714-K716 PolarHBondContact O-N 3.02Å; K716-E718 PolarHBondContact O-N 3.01Å; K716-E718 VanDerWaalsContact O-N 3.14Å; K716-R719 PolarHBondContact O-N 3.02Å; K716-A720 PolarHBondContact O-N 3.38Å
717R90.4Very high94.6Very high153 Ų15342.3 Ų42.358%0.57720%0.196SC*.Hα-helixtrans-53.6-37.5-178.4-69.5-175.1179.7163.20.3113.4A720 N721 D825R717-A720 PolarHBondContact O-N 3.21Å; R717-N721 WeakPolarHBondContact O-CB 3.48Å; R717-N721 PolarHBondContact O-N 3Å; R717-N721 PolarHBondContact O-ND2 3.45Å; R717-N721 VanDerWaalsContact O-ND2 3.15Å; R717-N721 PolarHBondContact O-OD1 3.46Å; R717-D825 IonicContact CZ-OD2 3.83Å; R717-D825 IonicContact NE-OD2 2.75Å; R717-D825 VanDerWaalsContact NH2-CG 3.26Å; R717-D825 IonicContact NH2-OD2 2.71Å; R717-D825 PolarHBondContact NH2-OD2 2.91Å
718E90.7Very high94.5Very high111 Ų11143.4 Ų43.452%0.51921%0.208SC..Hα-helixtrans-61-47.9-178.4-65.1169.1172.600111.9L654 K716L654-E718 HydrophobicContact CD1-CB 3.8Å; K716-E718 PolarHBondContact O-N 3.01Å; K716-E718 VanDerWaalsContact O-N 3.14Å
719R93.9Very high94.5Very high5 Ų541.1 Ų41.12%0.01920%0.197CC..Hα-helixtrans-70.4-40.4175.5-64.2-171.7-64.6-116-0.7111.5A649 L654 T712 L713 E715 K716 N721 I722 V723A649-R719 PolarHBondContact O-NH1 3.43Å; L654-R719 HydrophobicContact CD1-CB 4.27Å; L654-R719 HydrophobicContact CD1-CG 3.57Å; L654-R719 HydrophobicContact CG-CG 4.34Å; T712-R719 VanDerWaalsContact O-CZ 3.23Å; T712-R719 PolarHBondContact O-NE 3.35Å; T712-R719 PolarHBondContact O-NH2 3.16Å; L713-R719 CarbonylContact O-C 3.52Å; L713-R719 WeakPolarHBondContact O-CB 3.44Å; E715-R719 IonicContact OE1-CZ 3.93Å; E715-R719 IonicContact OE1-NH2 2.72Å; E715-R719 PolarHBondContact OE1-NH2 3.4Å; K716-R719 PolarHBondContact O-N 3.02Å; R719-N721 VanDerWaalsContact C-N 3.26Å; R719-N721 PolarHBondContact O-N 3.26Å; R719-I722 PolarHBondContact O-N 3.08Å; R719-V723 PolarHBondContact O-N 2.89Å
720A95Very high94.3Very high2 Ų243.2 Ų43.22%0.01721%0.205CC..Hα-helixtrans-57.4-38.8177.600000112.1L713 V714 K716 R717 I722 V723 V724 A764L713-A720 PolarHBondContact O-N 3.45Å; V714-A720 HydrophobicContact CB-CB 4.46Å; K716-A720 PolarHBondContact O-N 3.38Å; R717-A720 PolarHBondContact O-N 3.21Å; A720-I722 PolarHBondContact O-N 3.48Å; A720-V723 WeakPolarHBondContact O-CG1 3.44Å; A720-V723 PolarHBondContact O-N 3.04Å; A720-V724 WeakPolarHBondContact O-CG1 3.31Å; A720-V724 WeakPolarHBondContact O-CG2 3.49Å; A720-V724 PolarHBondContact O-N 3.16Å; A720-A764 HydrophobicContact CB-CB 4Å
721N93.9Very high94.1Very high46 Ų4646.5 Ų46.525%0.24623%0.228CC..Hα-helixtrans-63.3-27.9178.6-68-22.5000113.6R717 R719 Q725 N765R717-N721 WeakPolarHBondContact O-CB 3.48Å; R717-N721 PolarHBondContact O-N 3Å; R717-N721 PolarHBondContact O-ND2 3.45Å; R717-N721 VanDerWaalsContact O-ND2 3.15Å; R717-N721 PolarHBondContact O-OD1 3.46Å; R719-N721 VanDerWaalsContact C-N 3.26Å; R719-N721 PolarHBondContact O-N 3.26Å; N721-Q725 WeakPolarHBondContact O-CG 3.21Å; N721-Q725 PolarHBondContact O-NE2 3.29Å; N721-N765 VanDerWaalsContact OD1-CB 3.23Å; N721-N765 WeakPolarHBondContact OD1-CB 3.43Å; N721-N765 PolarHBondContact OD1-N 2.9Å
722I94.4Very high93.9Very high19 Ų1946.2 Ų46.210%0.09723%0.226CC..Hα-helixtrans-87.3-46.8179.4-59.7176.8000110L654 Q679 V682 R719 A720 V724 Q725L654-I722 HydrophobicContact CD1-CD1 3.88Å; L654-I722 HydrophobicContact CD2-CD1 3.58Å; L654-I722 HydrophobicContact CG-CD1 4.33Å; Q679-I722 HydrophobicContact CB-CG2 4.27Å; Q679-I722 HydrophobicContact CG-CD1 4.31Å; Q679-I722 HydrophobicContact CG-CG2 4.04Å; V682-I722 HydrophobicContact CB-CG2 3.92Å; V682-I722 HydrophobicContact CG1-CB 4.31Å; V682-I722 HydrophobicContact CG1-CG2 3.87Å; V682-I722 HydrophobicContact CG2-CB 4.47Å; V682-I722 HydrophobicContact CG2-CG2 4.11Å; R719-I722 PolarHBondContact O-N 3.08Å; A720-I722 PolarHBondContact O-N 3.48Å; I722-V724 VanDerWaalsContact C-N 3.3Å; I722-V724 PolarHBondContact O-N 3.02Å; I722-Q725 WeakPolarHBondContact O-CB 3.31Å; I722-Q725 PolarHBondContact O-N 3.35Å
723V95.6Very high93.9Very high0 Ų046.3 Ų46.30%023%0.227CC..Hα-helixtrans-62.8-35.8-174.5750000112.4V682 L686 V714 R719 A720 Q725 C726 W729V682-V723 HydrophobicContact CG1-CB 3.72Å; V682-V723 HydrophobicContact CG1-CG2 4.05Å; L686-V723 HydrophobicContact CB-CG2 4.43Å; L686-V723 HydrophobicContact CD1-CG2 4.23Å; L686-V723 HydrophobicContact CD2-CG2 3.95Å; L686-V723 HydrophobicContact CG-CG2 4.44Å; V714-V723 HydrophobicContact CG1-CG1 3.62Å; R719-V723 PolarHBondContact O-N 2.89Å; A720-V723 WeakPolarHBondContact O-CG1 3.44Å; A720-V723 PolarHBondContact O-N 3.04Å; V723-Q725 PolarHBondContact O-N 3.32Å; V723-C726 VanDerWaalsContact O-CB 3.28Å; V723-C726 WeakPolarHBondContact O-CB 3.36Å; V723-C726 PolarHBondContact O-N 3.09Å; V723-W729 HydrophobicContact CG2-CE3 4.16Å; V723-W729 WeakPolarHBondContact O-CB 3.47Å
724V95Very high93.6Very high7 Ų750.8 Ų50.84%0.04225%0.246CC..THydrogen-bonded Turntrans-68.2-14.9178.2-61.60000113.7A720 I722 C726 W730 G761 A764 M766A720-V724 WeakPolarHBondContact O-CG1 3.31Å; A720-V724 WeakPolarHBondContact O-CG2 3.49Å; A720-V724 PolarHBondContact O-N 3.16Å; I722-V724 VanDerWaalsContact C-N 3.3Å; I722-V724 PolarHBondContact O-N 3.02Å; V724-C726 VanDerWaalsContact C-N 3.33Å; V724-W730 PolarHBondContact O-NE1 3.29Å; V724-G761 WeakPolarHBondContact CG1-O 3.27Å; V724-A764 HydrophobicContact CG1-CB 3.87Å; V724-A764 HydrophobicContact CG2-CB 3.96Å; V724-M766 HydrophobicContact CG2-CG 4.3Å
725Q93.1Very high93.4Very high143 Ų14352.9 Ų52.967%0.66826%0.256SS*.THydrogen-bonded Turntrans-83-14.3175.3-57.7177.619.300112N721 I722 V723N721-Q725 WeakPolarHBondContact O-CG 3.21Å; N721-Q725 PolarHBondContact O-NE2 3.29Å; I722-Q725 WeakPolarHBondContact O-CB 3.31Å; I722-Q725 PolarHBondContact O-N 3.35Å; V723-Q725 PolarHBondContact O-N 3.32Å
726C94.3Very high93.4Very high28 Ų2851 Ų5119%0.18925%0.247CC..SBendtrans-77.8132-177.6-60.60000111.2L686 V723 V724 G728 W729L686-C726 HydrophobicContact CD2-CB 3.56Å; V723-C726 VanDerWaalsContact O-CB 3.28Å; V723-C726 WeakPolarHBondContact O-CB 3.36Å; V723-C726 PolarHBondContact O-N 3.09Å; V724-C726 VanDerWaalsContact C-N 3.33Å; C726-G728 PolarHBondContact O-N 3.01Å; C726-W729 VanDerWaalsContact O-CB 3.31Å; C726-W729 WeakPolarHBondContact O-CB 3.42Å; C726-W729 PolarHBondContact O-N 3.24Å
727E93.8Very high93.3Very high175 Ų17548.3 Ų48.382%0.81824%0.238SC*.Hα-helixtrans-58.7-35178.4-65.2-173.4168.400112.7W729 W730 S731E727-W729 PolarHBondContact O-N 3.49Å; E727-W730 PolarHBondContact O-N 3.2Å; E727-S731 PolarHBondContact O-N 2.93Å
728G93.7Very high93.2Very high24 Ų2444.3 Ų44.325%0.24723%0.233CC..Hα-helixtrans-56.7-33.2176.100000113.4I690 C726 S731 L732I690-G728 WeakPolarHBondContact CD1-O 3.5Å; C726-G728 PolarHBondContact O-N 3.01Å; G728-S731 PolarHBondContact O-N 2.7Å; G728-L732 WeakPolarHBondContact O-CB 3.24Å; G728-L732 PolarHBondContact O-N 2.67Å
729W96.4Very high92.8Very high0 Ų041 Ų410%022%0.216CC..Hα-helixtrans-66.2-46.2179.9178-104.2000111.2L686 L710 V714 V723 C726 E727 L732 A733 A757 L758 Y774L686-W729 HydrophobicContact CD1-CE3 4.03Å; L686-W729 HydrophobicContact CD2-CB 3.94Å; L710-W729 HydrophobicContact CD1-CE3 4.29Å; L710-W729 HydrophobicContact CD1-CZ3 3.7Å; L710-W729 HydrophobicContact CD2-CZ3 4.3Å; L710-W729 HydrophobicContact CG-CZ3 4.13Å; V714-W729 HydrophobicContact CG1-CH2 3.68Å; V714-W729 HydrophobicContact CG1-CZ2 4.31Å; V714-W729 HydrophobicContact CG1-CZ3 4.03Å; V723-W729 HydrophobicContact CG2-CE3 4.16Å; V723-W729 WeakPolarHBondContact O-CB 3.47Å; C726-W729 VanDerWaalsContact O-CB 3.31Å; C726-W729 WeakPolarHBondContact O-CB 3.42Å; C726-W729 PolarHBondContact O-N 3.24Å; E727-W729 PolarHBondContact O-N 3.49Å; W729-L732 PolarHBondContact O-N 3.18Å; W729-A733 WeakPolarHBondContact O-CB 3.37Å; W729-A733 PolarHBondContact O-N 2.77Å; W729-A757 WeakPolarHBondContact CH2-O 3.29Å; W729-L758 HydrophobicContact CH2-CD2 3.86Å; W729-L758 HydrophobicContact CZ2-CD2 3.76Å; W729-L758 HydrophobicContact CZ3-CD2 4.32Å; W729-Y774 AromaticContact CD1-CE2 3.83Å; W729-Y774 VanDerWaalsContact CE2-OH 3.31Å; W729-Y774 WeakPolarHBondContact CZ2-OH 3.47Å; W729-Y774 AromaticContact NE1-CE2 3.2Å; W729-Y774 AromaticContact NE1-CZ 3.5Å; W729-Y774 PolarHBondContact NE1-OH 3.08Å
730W95.1Very high92.2Very high44 Ų4442.9 Ų42.917%0.16723%0.229CC..Hα-helixtrans-68.9-35.5177.8-6582.7000112V724 E727 K734 T770 Q773 Y774V724-W730 PolarHBondContact O-NE1 3.29Å; E727-W730 PolarHBondContact O-N 3.2Å; W730-K734 WeakPolarHBondContact O-CB 3.39Å; W730-K734 VanDerWaalsContact O-CG 3.31Å; W730-K734 WeakPolarHBondContact O-CG 3.47Å; W730-K734 PolarHBondContact O-N 2.9Å; W730-T770 HydrophobicContact CH2-CG2 3.78Å; W730-T770 HydrophobicContact CZ2-CG2 3.75Å; W730-Q773 HydrophobicContact CZ3-CG 4.2Å; W730-Y774 HydrophobicContact CE3-CD2 4.29Å; W730-Y774 AromaticContact CH2-CD2 3.72Å; W730-Y774 HydrophobicContact CH2-CD2 3.72Å; W730-Y774 HydrophobicContact CH2-CG 4.34Å; W730-Y774 HydrophobicContact CZ2-CD2 4.03Å; W730-Y774 AromaticContact CZ3-CD2 3.85Å; W730-Y774 HydrophobicContact CZ3-CD2 3.85Å
731S93Very high91.6Very high69 Ų6947.1 Ų47.148%0.48326%0.257SS..Hα-helixtrans-62.8-46.3172.4-173.50000111.4E727 G728 K734 Q735E727-S731 PolarHBondContact O-N 2.93Å; G728-S731 PolarHBondContact O-N 2.7Å; S731-K734 PolarHBondContact O-N 2.91Å; S731-Q735 VanDerWaalsContact O-CB 3.28Å; S731-Q735 WeakPolarHBondContact O-CB 3.27Å; S731-Q735 PolarHBondContact O-N 3Å
732L94.9Very high91.2Very high2 Ų246.4 Ų46.41%0.0126%0.255CS..Hα-helixtrans-59.8-47.9176.8177.862.3000111.4I690 L710 G728 W729 K734 Q735 F736 L743 L754I690-L732 HydrophobicContact CD1-CB 4.41Å; I690-L732 HydrophobicContact CG1-CB 4.34Å; I690-L732 HydrophobicContact CG1-CD1 4.47Å; I690-L732 HydrophobicContact CG1-CD2 4.3Å; L710-L732 HydrophobicContact CD2-CD2 3.89Å; G728-L732 WeakPolarHBondContact O-CB 3.24Å; G728-L732 PolarHBondContact O-N 2.67Å; W729-L732 PolarHBondContact O-N 3.18Å; L732-K734 PolarHBondContact O-N 3.28Å; L732-Q735 PolarHBondContact O-N 2.89Å; L732-F736 WeakPolarHBondContact O-CB 3.46Å; L732-F736 PolarHBondContact O-N 2.61Å; L732-L743 HydrophobicContact CD1-CD1 3.72Å; L732-L743 HydrophobicContact CD1-CD2 4.48Å; L732-L754 HydrophobicContact CD1-CD1 4.45Å; L732-L754 HydrophobicContact CD2-CD1 4.39Å
733A93.9Very high91Very high2 Ų245.6 Ų45.62%0.01725%0.251CS..Hα-helixtrans-56.7-47.917700000112W729 A737 L758 V778W729-A733 WeakPolarHBondContact O-CB 3.37Å; W729-A733 PolarHBondContact O-N 2.77Å; A733-A737 WeakPolarHBondContact O-CB 3.33Å; A733-A737 PolarHBondContact O-N 3.46Å; A733-L758 HydrophobicContact CB-CD2 4.02Å; A733-V778 HydrophobicContact CB-CG2 4.03Å
734K91.8Very high90.5Very high93 Ų9349 Ų4940%0.40427%0.266SS..Hα-helixtrans-64.3-42.6178.2-75.3174.4177.8-178.50112.7W730 S731 L732 A737 S738 E777W730-K734 WeakPolarHBondContact O-CB 3.39Å; W730-K734 VanDerWaalsContact O-CG 3.31Å; W730-K734 WeakPolarHBondContact O-CG 3.47Å; W730-K734 PolarHBondContact O-N 2.9Å; S731-K734 PolarHBondContact O-N 2.91Å; L732-K734 PolarHBondContact O-N 3.28Å; K734-A737 PolarHBondContact O-N 2.85Å; K734-S738 WeakPolarHBondContact O-CB 3.34Å; K734-S738 PolarHBondContact O-N 2.62Å; K734-S738 PolarHBondContact O-OG 3.49Å; K734-E777 WeakPolarHBondContact CE-OE1 3.2Å; K734-E777 WeakPolarHBondContact CE-OE2 3.5Å; K734-E777 WeakPolarHBondContact CG-OE2 3.21Å; K734-E777 IonicContact NZ-OE1 3.5Å; K734-E777 PolarHBondContact NZ-OE1 3.34Å
735Q91.3Very high90.1Very high49 Ų4953.9 Ų53.923%0.22929%0.292CS..Hα-helixtrans-69.4-37.7-178.9-171177.511.600112.2S731 L732 S738 L743S731-Q735 VanDerWaalsContact O-CB 3.28Å; S731-Q735 WeakPolarHBondContact O-CB 3.27Å; S731-Q735 PolarHBondContact O-N 3Å; L732-Q735 PolarHBondContact O-N 2.89Å; Q735-S738 WeakPolarHBondContact CA-OG 3.38Å; Q735-S738 PolarHBondContact O-N 3.24Å; Q735-S738 PolarHBondContact O-OG 2.84Å; Q735-L743 HydrophobicContact CB-CD1 3.96Å; Q735-L743 HydrophobicContact CG-CD1 3.77Å; Q735-L743 HydrophobicContact CG-CG 4.28Å
736F92Very high90Very high28 Ų2847.4 Ų47.412%0.12326%0.262CS..Hα-helixtrans-68.2-45.8172.6-179.5-119.3000110.8L732 S738 R739 L743 Q751 L754 M755 L758L732-F736 WeakPolarHBondContact O-CB 3.46Å; L732-F736 PolarHBondContact O-N 2.61Å; F736-S738 PolarHBondContact O-N 2.92Å; F736-R739 PolarHBondContact O-N 2.59Å; F736-R739 VanDerWaalsContact O-N 3.16Å; F736-L743 HydrophobicContact CB-CD1 4.14Å; F736-Q751 HydrophobicContact CE2-CB 4.16Å; F736-Q751 HydrophobicContact CE2-CG 4.23Å; F736-Q751 HydrophobicContact CZ-CB 4.38Å; F736-L754 HydrophobicContact CB-CD2 3.79Å; F736-L754 HydrophobicContact CD1-CD2 3.8Å; F736-L754 HydrophobicContact CD2-CD2 3.2Å; F736-L754 HydrophobicContact CE1-CD2 4.1Å; F736-L754 HydrophobicContact CE2-CD2 3.56Å; F736-L754 HydrophobicContact CG-CD2 3.31Å; F736-L754 HydrophobicContact CZ-CD2 3.98Å; F736-M755 HydrophobicContact CE1-CB 4.13Å; F736-M755 HydrophobicContact CE1-CE 3.98Å; F736-M755 HydrophobicContact CE1-SD 4.31Å; F736-M755 HydrophobicContact CZ-CB 4.39Å; F736-L758 HydrophobicContact CB-CD1 4.37Å; F736-L758 HydrophobicContact CD1-CD1 3.51Å; F736-L758 HydrophobicContact CE1-CD1 4.15Å; F736-L758 HydrophobicContact CG-CD1 4.27Å
737A88.3Confident89.9Confident14 Ų1447.9 Ų47.912%0.11627%0.265CS..Hα-helixtrans-60.2-33.1175.900000112A733 K734 R739 E777 P781 R785A733-A737 WeakPolarHBondContact O-CB 3.33Å; A733-A737 PolarHBondContact O-N 3.46Å; K734-A737 PolarHBondContact O-N 2.85Å; A737-R739 VanDerWaalsContact C-N 3.3Å; A737-R739 PolarHBondContact O-N 3.22Å; A737-E777 WeakPolarHBondContact CB-O 3.45Å; A737-P781 HydrophobicContact CB-CB 4.5Å; A737-R785 PolarHBondContact O-NH1 3.28Å; A737-R785 PolarHBondContact O-NH2 3.38Å
738S87.3Confident89.7Confident69 Ų6942 Ų4248%0.48324%0.244SC..THydrogen-bonded Turntrans-75.2-10.2179.2630000115.1K734 Q735 F736 S740K734-S738 WeakPolarHBondContact O-CB 3.34Å; K734-S738 PolarHBondContact O-N 2.62Å; K734-S738 PolarHBondContact O-OG 3.49Å; Q735-S738 WeakPolarHBondContact CA-OG 3.38Å; Q735-S738 PolarHBondContact O-N 3.24Å; Q735-S738 PolarHBondContact O-OG 2.84Å; F736-S738 PolarHBondContact O-N 2.92Å; S738-S740 PolarHBondContact O-N 3.22Å; S738-S740 PolarHBondContact OG-OG 3.13Å
739R83.2Confident89.5Confident43 Ų4343.2 Ų43.216%0.16225%0.248CC..THydrogen-bonded Turntrans50.937-176.8-68.3-177.3-176.4-163.62.4113.4F736 A737 E807 T811F736-R739 PolarHBondContact O-N 2.59Å; F736-R739 VanDerWaalsContact O-N 3.16Å; A737-R739 VanDerWaalsContact C-N 3.3Å; A737-R739 PolarHBondContact O-N 3.22Å; R739-E807 WeakPolarHBondContact CD-OE2 3.39Å; R739-E807 IonicContact CZ-OE1 3.26Å; R739-E807 IonicContact CZ-OE2 3.43Å; R739-E807 IonicContact NE-OE1 3.08Å; R739-E807 IonicContact NE-OE2 3.19Å; R739-E807 VanDerWaalsContact NH1-CA 3.34Å; R739-E807 PolarHBondContact NH1-O 2.94Å; R739-E807 IonicContact NH1-OE1 2.71Å; R739-E807 PolarHBondContact NH1-OE1 2.85Å; R739-E807 IonicContact NH1-OE2 3.38Å; R739-E807 PolarHBondContact NH1-OE2 3.14Å; R739-T811 PolarHBondContact NH2-OG1 3.07Å; R739-T811 VanDerWaalsContact NH2-OG1 3.1Å
740S80.9Confident89.4Confident43 Ų4343.2 Ų43.230%0.30125%0.248SC..  trans-97.9152.1175.149.90000111.1S738S738-S740 PolarHBondContact O-N 3.22Å; S738-S740 PolarHBondContact OG-OG 3.13Å
741P82.3Confident89.3Confident92 Ų9242.2 Ų42.260%0.59725%0.245SC*.THydrogen-bonded Turntrans-53.2149.4167.7-23.933.7000111.4
742P85.8Confident89.4Confident31 Ų3140.3 Ų40.320%0.20123%0.228CC..THydrogen-bonded Turncis-84.4-20.93.232.3-33.7000114.9S694 H744 L745S694-P742 VanDerWaalsContact O-CB 3.24Å; S694-P742 WeakPolarHBondContact O-CB 3.36Å; P742-H744 VanDerWaalsContact C-N 3.27Å; P742-H744 PolarHBondContact O-N 3.39Å; P742-H744 VanDerWaalsContact O-N 3.15Å; P742-L745 WeakPolarHBondContact O-CB 3.36Å; P742-L745 PolarHBondContact O-N 2.86Å
743L88.6Confident89.4Confident2 Ų241 Ų411%0.0123%0.232CC..G310 helixtrans-63.4-27.6-170.1-58.5-179.5000114.6L693 L732 Q735 F736 L745 L746L693-L743 HydrophobicContact CB-CD2 3.84Å; L732-L743 HydrophobicContact CD1-CD1 3.72Å; L732-L743 HydrophobicContact CD1-CD2 4.48Å; Q735-L743 HydrophobicContact CB-CD1 3.96Å; Q735-L743 HydrophobicContact CG-CD1 3.77Å; Q735-L743 HydrophobicContact CG-CG 4.28Å; F736-L743 HydrophobicContact CB-CD1 4.14Å; L743-L745 PolarHBondContact O-N 3.24Å; L743-L746 HydrophobicContact CB-CD1 4.31Å; L743-L746 HydrophobicContact CD2-CD1 3.97Å; L743-L746 WeakPolarHBondContact O-CB 3.27Å; L743-L746 WeakPolarHBondContact O-CD1 3.5Å; L743-L746 WeakPolarHBondContact O-CG 3.34Å; L743-L746 PolarHBondContact O-N 3.02Å
744H86Confident89.5Confident71 Ų7140.9 Ų40.933%0.32923%0.232SC..G310 helixtrans-68-15.8175.9-175.653.9000113.6P742 L746 Q751P742-H744 VanDerWaalsContact C-N 3.27Å; P742-H744 PolarHBondContact O-N 3.39Å; P742-H744 VanDerWaalsContact O-N 3.15Å; H744-L746 VanDerWaalsContact C-N 3.35Å; H744-Q751 PolarHBondContact O-NE2 2.74Å
745L87.6Confident89.8Confident109 Ų10936.8 Ų36.857%0.57121%0.214SC*.G310 helixtrans-85.1-8.6178.9-58175.6000113.2P742 L743P742-L745 WeakPolarHBondContact O-CB 3.36Å; P742-L745 PolarHBondContact O-N 2.86Å; L743-L745 PolarHBondContact O-N 3.24Å
746L90.9Very high90Very high8 Ų836.7 Ų36.74%0.04221%0.213CC..SBendtrans-67.9152178.7-61.4170.4000110.8L693 A703 L743 H744 V750 Q751L693-L746 HydrophobicContact CB-CD1 4.37Å; L693-L746 HydrophobicContact CD2-CD1 4.18Å; A703-L746 HydrophobicContact CB-CD2 4.44Å; L743-L746 HydrophobicContact CB-CD1 4.31Å; L743-L746 HydrophobicContact CD2-CD1 3.97Å; L743-L746 WeakPolarHBondContact O-CB 3.27Å; L743-L746 WeakPolarHBondContact O-CD1 3.5Å; L743-L746 WeakPolarHBondContact O-CG 3.34Å; L743-L746 PolarHBondContact O-N 3.02Å; H744-L746 VanDerWaalsContact C-N 3.35Å; L746-V750 HydrophobicContact CB-CB 4.2Å; L746-V750 HydrophobicContact CB-CG1 4.1Å; L746-V750 HydrophobicContact CD1-CG1 3.9Å; L746-V750 HydrophobicContact CD2-CG1 4.33Å; L746-V750 HydrophobicContact CG-CG1 4.33Å; L746-Q751 HydrophobicContact CB-CG 4.16Å; L746-Q751 PolarHBondContact O-NE2 3.14Å
747S90.8Very high90.3Very high37 Ų3735.3 Ų35.326%0.25921%0.207SC..  trans-62.2160.5175.768.90000112.2S749 V750 Q751S747-S749 VanDerWaalsContact C-N 3.3Å; S747-S749 PolarHBondContact O-N 3.48Å; S747-S749 PolarHBondContact OG-OG 3.08Å; S747-S749 VanDerWaalsContact OG-OG 3.05Å; S747-V750 PolarHBondContact O-N 3.03Å; S747-V750 VanDerWaalsContact OG-CG2 3.32Å; S747-V750 WeakPolarHBondContact OG-CG2 3.41Å; S747-Q751 WeakPolarHBondContact O-CG 3.25Å; S747-Q751 PolarHBondContact O-N 3.1Å
748S89.4Confident90.7Very high52 Ų5234.7 Ų34.736%0.36420%0.202SC..Hα-helixtrans-56-41.6177.5-66.20000113.1V750 Q751 R752 E813S748-V750 VanDerWaalsContact C-N 3.32Å; S748-V750 PolarHBondContact O-N 2.84Å; S748-Q751 PolarHBondContact O-N 3.41Å; S748-R752 WeakPolarHBondContact O-CB 3.44Å; S748-R752 PolarHBondContact O-N 2.96Å; S748-E813 VanDerWaalsContact CB-OE1 3.31Å; S748-E813 WeakPolarHBondContact CB-OE1 3.47Å; S748-E813 PolarHBondContact OG-OE1 3.12Å
749S90.2Very high91.2Very high49 Ų4931.4 Ų31.434%0.34318%0.179SC..Hα-helixtrans-60.1-42.1179.464.10000112.2N704 S747 S753N704-S749 PolarHBondContact OD1-OG 2.91Å; S747-S749 VanDerWaalsContact C-N 3.3Å; S747-S749 PolarHBondContact O-N 3.48Å; S747-S749 PolarHBondContact OG-OG 3.08Å; S747-S749 VanDerWaalsContact OG-OG 3.05Å; S749-S753 WeakPolarHBondContact O-CB 3.07Å; S749-S753 PolarHBondContact O-N 3.03Å; S749-S753 PolarHBondContact O-OG 3.39Å
750V94.1Very high91.8Very high0 Ų030 Ų300%017%0.174CC..Hα-helixtrans-70.1-43.4179.3178.70000110.2L693 A703 N704 V707 L746 S747 S748 R752 S753 L754L693-V750 HydrophobicContact CD2-CG1 3.95Å; A703-V750 HydrophobicContact CB-CG1 4.42Å; A703-V750 HydrophobicContact CB-CG2 3.74Å; N704-V750 WeakPolarHBondContact OD1-CG2 3.26Å; V707-V750 HydrophobicContact CB-CG1 4.25Å; V707-V750 HydrophobicContact CG1-CG1 4.16Å; L746-V750 HydrophobicContact CB-CB 4.2Å; L746-V750 HydrophobicContact CB-CG1 4.1Å; L746-V750 HydrophobicContact CD1-CG1 3.9Å; L746-V750 HydrophobicContact CD2-CG1 4.33Å; L746-V750 HydrophobicContact CG-CG1 4.33Å; S747-V750 PolarHBondContact O-N 3.03Å; S747-V750 VanDerWaalsContact OG-CG2 3.32Å; S747-V750 WeakPolarHBondContact OG-CG2 3.41Å; S748-V750 VanDerWaalsContact C-N 3.32Å; S748-V750 PolarHBondContact O-N 2.84Å; V750-R752 VanDerWaalsContact C-N 3.33Å; V750-R752 PolarHBondContact O-N 3.39Å; V750-S753 PolarHBondContact O-N 3.42Å; V750-L754 VanDerWaalsContact O-CB 3.31Å; V750-L754 WeakPolarHBondContact O-CB 3.24Å; V750-L754 PolarHBondContact O-N 3.27Å
751Q93.2Very high92.4Very high23 Ų2328 Ų2811%0.10716%0.16CC..Hα-helixtrans-63.1-39.7177.4-66.3-176.321.300112.2F736 H744 L746 S747 S748 L754 M755F736-Q751 HydrophobicContact CE2-CB 4.16Å; F736-Q751 HydrophobicContact CE2-CG 4.23Å; F736-Q751 HydrophobicContact CZ-CB 4.38Å; H744-Q751 PolarHBondContact O-NE2 2.74Å; L746-Q751 HydrophobicContact CB-CG 4.16Å; L746-Q751 PolarHBondContact O-NE2 3.14Å; S747-Q751 WeakPolarHBondContact O-CG 3.25Å; S747-Q751 PolarHBondContact O-N 3.1Å; S748-Q751 PolarHBondContact O-N 3.41Å; Q751-L754 PolarHBondContact O-N 2.99Å; Q751-M755 PolarHBondContact O-N 3.17Å
752R94.2Very high93Very high30 Ų3023.6 Ų23.611%0.11313%0.132CC..Hα-helixtrans-59.4-51.9174.6-173.8-176.6-64.5-164.9-1.4111S748 V750 L754 M755 K756 E813 C816 G817 E820 E860S748-R752 WeakPolarHBondContact O-CB 3.44Å; S748-R752 PolarHBondContact O-N 2.96Å; V750-R752 VanDerWaalsContact C-N 3.33Å; V750-R752 PolarHBondContact O-N 3.39Å; R752-L754 VanDerWaalsContact C-N 3.31Å; R752-L754 PolarHBondContact O-N 3.37Å; R752-M755 PolarHBondContact O-N 3.24Å; R752-K756 PolarHBondContact O-N 3.39Å; R752-E813 IonicContact CZ-OE2 3.2Å; R752-E813 VanDerWaalsContact CZ-OE2 3.27Å; R752-E813 IonicContact NE-OE2 2.73Å; R752-E813 PolarHBondContact NE-OE2 3.35Å; R752-E813 IonicContact NH2-OE1 2.65Å; R752-E813 IonicContact NH2-OE2 3.52Å; R752-E813 PolarHBondContact NH2-OE2 2.87Å; R752-C816 HydrophobicContact CG-CB 4.05Å; R752-G817 WeakPolarHBondContact O-CA 3.39Å; R752-E820 WeakPolarHBondContact CD-OE1 3.18Å; R752-E820 IonicContact NH1-OE1 3.63Å; R752-E860 IonicContact CZ-OE1 3.82Å; R752-E860 IonicContact NH1-OE1 3.77Å; R752-E860 PolarHBondContact NH1-OE1 3.33Å; R752-E860 VanDerWaalsContact NH2-CD 3.33Å; R752-E860 IonicContact NH2-OE1 2.99Å; R752-E860 PolarHBondContact NH2-OE1 3.19Å; R752-E860 IonicContact NH2-OE2 2.67Å; R752-E860 PolarHBondContact NH2-OE2 2.96Å
753S96.1Very high93.3Very high16 Ų1623.9 Ų23.911%0.11213%0.13CC..Hα-helixtrans-65.4-33.5179.1-59.30000112.7S749 V750 K756 A757S749-S753 WeakPolarHBondContact O-CB 3.07Å; S749-S753 PolarHBondContact O-N 3.03Å; S749-S753 PolarHBondContact O-OG 3.39Å; V750-S753 PolarHBondContact O-N 3.42Å; S753-K756 WeakPolarHBondContact O-CB 3.39Å; S753-K756 PolarHBondContact O-N 3.23Å; S753-A757 PolarHBondContact O-N 2.99Å
754L96.2Very high93.4Very high0 Ų024 Ų240%013%0.131CC..Hα-helixtrans-66.5-44.5174.6-168.291.3000110.6L693 V707 L710 L732 F736 V750 Q751 R752 K756 A757 L758L693-L754 HydrophobicContact CD1-CD1 3.52Å; V707-L754 HydrophobicContact CG2-CB 4.03Å; V707-L754 HydrophobicContact CG2-CD1 4.2Å; L710-L754 HydrophobicContact CD2-CD1 3.68Å; L732-L754 HydrophobicContact CD1-CD1 4.45Å; L732-L754 HydrophobicContact CD2-CD1 4.39Å; F736-L754 HydrophobicContact CB-CD2 3.79Å; F736-L754 HydrophobicContact CD1-CD2 3.8Å; F736-L754 HydrophobicContact CD2-CD2 3.2Å; F736-L754 HydrophobicContact CE1-CD2 4.1Å; F736-L754 HydrophobicContact CE2-CD2 3.56Å; F736-L754 HydrophobicContact CG-CD2 3.31Å; F736-L754 HydrophobicContact CZ-CD2 3.98Å; V750-L754 VanDerWaalsContact O-CB 3.31Å; V750-L754 WeakPolarHBondContact O-CB 3.24Å; V750-L754 PolarHBondContact O-N 3.27Å; Q751-L754 PolarHBondContact O-N 2.99Å; R752-L754 VanDerWaalsContact C-N 3.31Å; R752-L754 PolarHBondContact O-N 3.37Å; L754-K756 VanDerWaalsContact C-N 3.32Å; L754-K756 PolarHBondContact O-N 3.2Å; L754-A757 PolarHBondContact O-N 2.89Å; L754-L758 HydrophobicContact CD2-CD1 4.49Å; L754-L758 WeakPolarHBondContact O-CG 3.5Å; L754-L758 PolarHBondContact O-N 3.34Å
755M96.8Very high93.6Very high7 Ų727 Ų273%0.03415%0.15CC..Hα-helixtrans-61.2-43.1174.8-177.556.997.100111.1F736 Q751 R752 A757 L758 V759 V778 L782 A814 I818F736-M755 HydrophobicContact CE1-CB 4.13Å; F736-M755 HydrophobicContact CE1-CE 3.98Å; F736-M755 HydrophobicContact CE1-SD 4.31Å; F736-M755 HydrophobicContact CZ-CB 4.39Å; Q751-M755 PolarHBondContact O-N 3.17Å; R752-M755 PolarHBondContact O-N 3.24Å; M755-A757 VanDerWaalsContact C-N 3.34Å; M755-A757 PolarHBondContact O-N 3.09Å; M755-L758 PolarHBondContact O-N 3.38Å; M755-V759 HydrophobicContact CG-CG2 4.3Å; M755-V759 VanDerWaalsContact O-CG2 3.22Å; M755-V759 WeakPolarHBondContact O-CG2 3.5Å; M755-V759 PolarHBondContact O-N 3.36Å; M755-V759 HydrophobicContact SD-CG2 4.02Å; M755-V778 HydrophobicContact SD-CG1 4.26Å; M755-L782 HydrophobicContact CE-CD2 4.08Å; M755-A814 HydrophobicContact CE-CB 3.66Å; M755-A814 HydrophobicContact CG-CB 4.17Å; M755-A814 WeakPolarHBondContact CG-O 3.32Å; M755-I818 HydrophobicContact CG-CD1 4.41Å; M755-I818 HydrophobicContact CG-CG1 3.79Å; M755-I818 HydrophobicContact SD-CG1 4.22Å
756K97.1Very high93.7Very high46 Ų4623.1 Ų23.120%0.213%0.129CC..Hα-helixtrans-53.9-49.7173.1174.7-170.8-176.6178.60111.6V711 R752 S753 L754 L758 V759 L760 G817 E820 A821V711-K756 HydrophobicContact CG2-CD 4.46Å; R752-K756 PolarHBondContact O-N 3.39Å; S753-K756 WeakPolarHBondContact O-CB 3.39Å; S753-K756 PolarHBondContact O-N 3.23Å; L754-K756 VanDerWaalsContact C-N 3.32Å; L754-K756 PolarHBondContact O-N 3.2Å; K756-L758 PolarHBondContact O-N 2.96Å; K756-V759 PolarHBondContact O-N 2.98Å; K756-L760 HydrophobicContact CG-CD1 4.17Å; K756-L760 WeakPolarHBondContact O-CG 3.48Å; K756-L760 PolarHBondContact O-N 2.92Å; K756-G817 WeakPolarHBondContact CA-O 3.42Å; K756-G817 WeakPolarHBondContact CB-O 3.42Å; K756-E820 HydrophobicContact CD-CB 3.95Å; K756-E820 HydrophobicContact CG-CB 4.23Å; K756-E820 IonicContact NZ-OE2 3.41Å; K756-A821 HydrophobicContact CB-CB 4.49Å; K756-A821 HydrophobicContact CG-CB 4.07Å
757A97.5Very high93.8Very high0 Ų027 Ų270%015%0.15CC..Hα-helixtrans-60.7-46178.100000112.3L710 V711 V714 W729 S753 L754 M755 V759 L760 G761L710-A757 HydrophobicContact CD2-CB 3.92Å; L710-A757 HydrophobicContact CG-CB 3.94Å; V711-A757 HydrophobicContact CG2-CB 3.98Å; V714-A757 HydrophobicContact CG2-CB 3.95Å; W729-A757 WeakPolarHBondContact CH2-O 3.29Å; S753-A757 PolarHBondContact O-N 2.99Å; L754-A757 PolarHBondContact O-N 2.89Å; M755-A757 VanDerWaalsContact C-N 3.34Å; M755-A757 PolarHBondContact O-N 3.09Å; A757-V759 VanDerWaalsContact C-N 3.3Å; A757-V759 PolarHBondContact O-N 3.21Å; A757-L760 PolarHBondContact O-N 3.46Å; A757-G761 PolarHBondContact O-N 3.38Å
758L96.9Very high93.7Very high1 Ų129 Ų291%0.00516%0.164CC..Hα-helixtrans-61.9-37.5179-69.9175.9000112.4W729 A733 F736 L754 M755 K756 G762 Y774 V778W729-L758 HydrophobicContact CH2-CD2 3.86Å; W729-L758 HydrophobicContact CZ2-CD2 3.76Å; W729-L758 HydrophobicContact CZ3-CD2 4.32Å; A733-L758 HydrophobicContact CB-CD2 4.02Å; F736-L758 HydrophobicContact CB-CD1 4.37Å; F736-L758 HydrophobicContact CD1-CD1 3.51Å; F736-L758 HydrophobicContact CE1-CD1 4.15Å; F736-L758 HydrophobicContact CG-CD1 4.27Å; L754-L758 HydrophobicContact CD2-CD1 4.49Å; L754-L758 WeakPolarHBondContact O-CG 3.5Å; L754-L758 PolarHBondContact O-N 3.34Å; M755-L758 PolarHBondContact O-N 3.38Å; K756-L758 PolarHBondContact O-N 2.96Å; L758-G762 PolarHBondContact O-N 3.23Å; L758-G762 VanDerWaalsContact O-N 3.17Å; L758-Y774 WeakPolarHBondContact O-CE1 3.49Å; L758-Y774 PolarHBondContact O-OH 3.3Å; L758-V778 HydrophobicContact CB-CG1 4.14Å
759V96.6Very high93.9Very high0 Ų032.4 Ų32.40%018%0.178CC..Hα-helixtrans-69.8-46.3176.8174.80000110.9M755 K756 A757 G761 G762 F763 W775 L779 I818 A821 L830M755-V759 HydrophobicContact CG-CG2 4.3Å; M755-V759 VanDerWaalsContact O-CG2 3.22Å; M755-V759 WeakPolarHBondContact O-CG2 3.5Å; M755-V759 PolarHBondContact O-N 3.36Å; M755-V759 HydrophobicContact SD-CG2 4.02Å; K756-V759 PolarHBondContact O-N 2.98Å; A757-V759 VanDerWaalsContact C-N 3.3Å; A757-V759 PolarHBondContact O-N 3.21Å; V759-G761 VanDerWaalsContact C-N 3.32Å; V759-G761 PolarHBondContact O-N 2.93Å; V759-G762 WeakPolarHBondContact O-CA 3.19Å; V759-G762 PolarHBondContact O-N 2.86Å; V759-F763 HydrophobicContact CG1-CE2 4.15Å; V759-F763 VanDerWaalsContact O-CD2 3.28Å; V759-F763 WeakPolarHBondContact O-CD2 3.06Å; V759-W775 HydrophobicContact CG1-CH2 4.42Å; V759-L779 HydrophobicContact CG2-CD2 4.33Å; V759-I818 HydrophobicContact CG2-CB 4.38Å; V759-I818 HydrophobicContact CG2-CG1 3.69Å; V759-A821 HydrophobicContact CB-CB 3.72Å; V759-A821 HydrophobicContact CG1-CB 3.56Å; V759-L830 HydrophobicContact CG1-CD1 3.9Å; V759-L830 HydrophobicContact CG1-CD2 3.8Å
760L96Very high93.9Very high14 Ų1431.9 Ų31.97%0.07317%0.173CC..Hα-helixtrans-56.3-45.9175.1-72.5173.7000111.4V711 V714 K756 A757 G762 F763 A821 Q823V711-L760 HydrophobicContact CG1-CD1 4.46Å; V714-L760 HydrophobicContact CB-CB 4.2Å; V714-L760 HydrophobicContact CG2-CB 3.89Å; V714-L760 HydrophobicContact CG2-CD1 4.21Å; K756-L760 HydrophobicContact CG-CD1 4.17Å; K756-L760 WeakPolarHBondContact O-CG 3.48Å; K756-L760 PolarHBondContact O-N 2.92Å; A757-L760 PolarHBondContact O-N 3.46Å; L760-G762 PolarHBondContact O-N 2.91Å; L760-F763 PolarHBondContact O-N 3.31Å; L760-F763 VanDerWaalsContact O-N 3.11Å; L760-A821 HydrophobicContact CD2-CB 4.18Å; L760-A821 WeakPolarHBondContact CD2-O 3.36Å; L760-A821 HydrophobicContact CG-CB 4.01Å; L760-Q823 HydrophobicContact CD2-CG 4.06Å
761G94.9Very high93.7Very high0 Ų035.2 Ų35.20%019%0.187CC..Hα-helixtrans-60.7-30.6174.800000113.6V724 A757 V759 F763 A764 M766V724-G761 WeakPolarHBondContact CG1-O 3.27Å; A757-G761 PolarHBondContact O-N 3.38Å; V759-G761 VanDerWaalsContact C-N 3.32Å; V759-G761 PolarHBondContact O-N 2.93Å; G761-F763 PolarHBondContact O-N 2.84Å; G761-F763 VanDerWaalsContact O-N 3.15Å; G761-A764 WeakPolarHBondContact O-CB 3.43Å; G761-A764 PolarHBondContact O-N 3.11Å; G761-M766 WeakPolarHBondContact O-CE 3.43Å
762G93.6Very high93.6Very high0 Ų040.1 Ų40.10%021%0.21CC..THydrogen-bonded Turntrans-63.4-16.6175.500000115.1L758 V759 L760 M766L758-G762 PolarHBondContact O-N 3.23Å; L758-G762 VanDerWaalsContact O-N 3.17Å; V759-G762 WeakPolarHBondContact O-CA 3.19Å; V759-G762 PolarHBondContact O-N 2.86Å; L760-G762 PolarHBondContact O-N 2.91Å; G762-M766 WeakPolarHBondContact O-CE 3.41Å
763F92.6Very high93.5Very high36 Ų3643.7 Ų43.716%0.15823%0.228CC..THydrogen-bonded Turntrans-99.85.4175-68.7-86.1000113.8V759 L760 G761 W775 N826 L830V759-F763 HydrophobicContact CG1-CE2 4.15Å; V759-F763 VanDerWaalsContact O-CD2 3.28Å; V759-F763 WeakPolarHBondContact O-CD2 3.06Å; L760-F763 PolarHBondContact O-N 3.31Å; L760-F763 VanDerWaalsContact O-N 3.11Å; G761-F763 PolarHBondContact O-N 2.84Å; G761-F763 VanDerWaalsContact O-N 3.15Å; F763-W775 HydrophobicContact CD2-CH2 4.12Å; F763-W775 HydrophobicContact CD2-CZ2 4.14Å; F763-W775 HydrophobicContact CE1-CZ2 4.43Å; F763-W775 AromaticContact CE2-CH2 3.57Å; F763-W775 HydrophobicContact CE2-CH2 3.57Å; F763-W775 AromaticContact CE2-CZ2 3.68Å; F763-W775 HydrophobicContact CE2-CZ2 3.68Å; F763-W775 HydrophobicContact CZ-CH2 4.09Å; F763-W775 AromaticContact CZ-CZ2 3.82Å; F763-W775 HydrophobicContact CZ-CZ2 3.82Å; F763-N826 HydrophobicContact CD1-CB 3.61Å; F763-N826 HydrophobicContact CD2-CB 3.87Å; F763-N826 HydrophobicContact CE1-CB 3.43Å; F763-N826 VanDerWaalsContact CE1-CB 3.43Å; F763-N826 HydrophobicContact CE2-CB 3.71Å; F763-N826 HydrophobicContact CG-CB 3.85Å; F763-N826 HydrophobicContact CZ-CB 3.51Å; F763-L830 HydrophobicContact CE2-CD1 4.31Å; F763-L830 HydrophobicContact CE2-CD2 3.88Å; F763-L830 HydrophobicContact CE2-CG 4.12Å; F763-L830 HydrophobicContact CZ-CD2 3.99Å; F763-L830 HydrophobicContact CZ-CG 4.11Å
764A92Very high93.4Very high5 Ų542.9 Ų42.94%0.04122%0.223CC..SBendtrans-61.6165.5167.400000112A720 V724 G761 M766A720-A764 HydrophobicContact CB-CB 4Å; V724-A764 HydrophobicContact CG1-CB 3.87Å; V724-A764 HydrophobicContact CG2-CB 3.96Å; G761-A764 WeakPolarHBondContact O-CB 3.43Å; G761-A764 PolarHBondContact O-N 3.11Å; A764-M766 PolarHBondContact O-N 3.07Å
765N89Confident93.3Very high135 Ų13544.6 Ų44.672%0.72223%0.229SC*.SBendtrans-72.493.6-179.9-17226.3000111.1N721N721-N765 VanDerWaalsContact OD1-CB 3.23Å; N721-N765 WeakPolarHBondContact OD1-CB 3.43Å; N721-N765 PolarHBondContact OD1-N 2.9Å
766M90.5Very high93.1Very high27 Ų2746.4 Ų46.413%0.13325%0.245CC..  trans-119.8150.3174.9-68.4178.7-87.600110V724 G761 G762 A764 T770 K771 Y774V724-M766 HydrophobicContact CG2-CG 4.3Å; G761-M766 WeakPolarHBondContact O-CE 3.43Å; G762-M766 WeakPolarHBondContact O-CE 3.41Å; A764-M766 PolarHBondContact O-N 3.07Å; M766-T770 HydrophobicContact CB-CG2 4.27Å; M766-T770 HydrophobicContact CG-CG2 4.21Å; M766-T770 HydrophobicContact SD-CG2 3.96Å; M766-K771 HydrophobicContact CB-CB 4.28Å; M766-Y774 HydrophobicContact CE-CD1 4.43Å; M766-Y774 HydrophobicContact CE-CG 4.24Å; M766-Y774 HydrophobicContact SD-CD2 4.46Å; M766-Y774 HydrophobicContact SD-CG 4.39Å
767D91.3Very high92.8Very high89 Ų8946.8 Ų46.848%0.47625%0.247SC..  trans-65163.916869.5-98.2000111.4D769 T770 K771D767-D769 VanDerWaalsContact C-N 3.29Å; D767-D769 PolarHBondContact O-N 3.35Å; D767-D769 PolarHBondContact OD2-N 3.3Å; D767-T770 VanDerWaalsContact CG-OG1 3.27Å; D767-T770 PolarHBondContact O-N 2.92Å; D767-T770 WeakPolarHBondContact OD1-CB 3.14Å; D767-T770 PolarHBondContact OD1-OG1 3Å; D767-T770 PolarHBondContact OD2-N 2.94Å; D767-T770 PolarHBondContact OD2-OG1 3.26Å; D767-K771 VanDerWaalsContact O-CB 3.29Å; D767-K771 WeakPolarHBondContact O-CB 3.43Å; D767-K771 PolarHBondContact O-N 2.82Å
768S90.3Very high92.5Very high80 Ų8047.1 Ų47.156%0.55925%0.249SC*.Hα-helixtrans-61.6-34.6-174.2-176.30000113.5Q772S768-Q772 WeakPolarHBondContact O-CG 3.43Å; S768-Q772 PolarHBondContact O-N 3.46Å; S768-Q772 VanDerWaalsContact O-N 3.11Å
769D92.3Very high92.3Very high122 Ų12247.5 Ų47.565%0.65225%0.252SS*.Hα-helixtrans-75.7-45.8-176.6-66.4-22.2000109.6D767 K771 Q772 Q773D767-D769 VanDerWaalsContact C-N 3.29Å; D767-D769 PolarHBondContact O-N 3.35Å; D767-D769 PolarHBondContact OD2-N 3.3Å; D769-K771 VanDerWaalsContact C-N 3.32Å; D769-K771 PolarHBondContact O-N 3.32Å; D769-Q772 PolarHBondContact O-N 3.12Å; D769-Q773 PolarHBondContact O-N 2.88Å
770T90.8Very high92Very high39 Ų3951.4 Ų51.424%0.23927%0.27CS..Hα-helixtrans-60.8-40.6174.4-58.40000111.3W730 M766 D767 Q773 Y774W730-T770 HydrophobicContact CH2-CG2 3.78Å; W730-T770 HydrophobicContact CZ2-CG2 3.75Å; M766-T770 HydrophobicContact CB-CG2 4.27Å; M766-T770 HydrophobicContact CG-CG2 4.21Å; M766-T770 HydrophobicContact SD-CG2 3.96Å; D767-T770 VanDerWaalsContact CG-OG1 3.27Å; D767-T770 PolarHBondContact O-N 2.92Å; D767-T770 WeakPolarHBondContact OD1-CB 3.14Å; D767-T770 PolarHBondContact OD1-OG1 3Å; D767-T770 PolarHBondContact OD2-N 2.94Å; D767-T770 PolarHBondContact OD2-OG1 3.26Å; T770-Q773 PolarHBondContact O-N 3.43Å; T770-Y774 WeakPolarHBondContact O-CB 3.33Å; T770-Y774 PolarHBondContact O-N 3.14Å
771K90.4Very high91.8Very high69 Ų6952.1 Ų52.130%0.328%0.275SS..Hα-helixtrans-65.7-40.4177.4-168.3168.7-172.4167.30112.2M766 D767 D769 Y774 W775M766-K771 HydrophobicContact CB-CB 4.28Å; D767-K771 VanDerWaalsContact O-CB 3.29Å; D767-K771 WeakPolarHBondContact O-CB 3.43Å; D767-K771 PolarHBondContact O-N 2.82Å; D769-K771 VanDerWaalsContact C-N 3.32Å; D769-K771 PolarHBondContact O-N 3.32Å; K771-Y774 PolarHBondContact O-N 2.76Å; K771-W775 PolarHBondContact O-N 3.41Å; K771-W775 VanDerWaalsContact O-N 3.13Å
772Q91.2Very high91.6Very high127 Ų12752.2 Ų52.259%0.59328%0.276SS*.Hα-helixtrans-64.4-42.8173.8-76.3179.417.200111.7S768 D769 Y774 W775 A776S768-Q772 WeakPolarHBondContact O-CG 3.43Å; S768-Q772 PolarHBondContact O-N 3.46Å; S768-Q772 VanDerWaalsContact O-N 3.11Å; D769-Q772 PolarHBondContact O-N 3.12Å; Q772-Y774 VanDerWaalsContact C-N 3.31Å; Q772-Y774 PolarHBondContact O-N 2.92Å; Q772-W775 PolarHBondContact O-N 2.9Å; Q772-A776 WeakPolarHBondContact O-CB 3.24Å; Q772-A776 PolarHBondContact O-N 2.92Å
773Q92.1Very high91.5Very high104 Ų10454.7 Ų54.749%0.48629%0.287SS..Hα-helixtrans-60.7-42.4174.8-175178.2-7.500111.3W730 D769 T770 A776 E777W730-Q773 HydrophobicContact CZ3-CG 4.2Å; D769-Q773 PolarHBondContact O-N 2.88Å; T770-Q773 PolarHBondContact O-N 3.43Å; Q773-A776 WeakPolarHBondContact O-CB 3.32Å; Q773-A776 PolarHBondContact O-N 3.34Å; Q773-E777 WeakPolarHBondContact O-CG 3.44Å; Q773-E777 PolarHBondContact O-N 3.29Å; Q773-E777 VanDerWaalsContact O-N 3.15Å
774Y94Very high91.5Very high0 Ų058.7 Ų58.70%031%0.306CS..Hα-helixtrans-59.9-50.4179.3-169.3-94.5000112.3W729 W730 L758 M766 T770 K771 Q772 A776 E777 V778W729-Y774 AromaticContact CD1-CE2 3.83Å; W729-Y774 VanDerWaalsContact CE2-OH 3.31Å; W729-Y774 WeakPolarHBondContact CZ2-OH 3.47Å; W729-Y774 AromaticContact NE1-CE2 3.2Å; W729-Y774 AromaticContact NE1-CZ 3.5Å; W729-Y774 PolarHBondContact NE1-OH 3.08Å; W730-Y774 HydrophobicContact CE3-CD2 4.29Å; W730-Y774 AromaticContact CH2-CD2 3.72Å; W730-Y774 HydrophobicContact CH2-CD2 3.72Å; W730-Y774 HydrophobicContact CH2-CG 4.34Å; W730-Y774 HydrophobicContact CZ2-CD2 4.03Å; W730-Y774 AromaticContact CZ3-CD2 3.85Å; W730-Y774 HydrophobicContact CZ3-CD2 3.85Å; L758-Y774 WeakPolarHBondContact O-CE1 3.49Å; L758-Y774 PolarHBondContact O-OH 3.3Å; M766-Y774 HydrophobicContact CE-CD1 4.43Å; M766-Y774 HydrophobicContact CE-CG 4.24Å; M766-Y774 HydrophobicContact SD-CD2 4.46Å; M766-Y774 HydrophobicContact SD-CG 4.39Å; T770-Y774 WeakPolarHBondContact O-CB 3.33Å; T770-Y774 PolarHBondContact O-N 3.14Å; K771-Y774 PolarHBondContact O-N 2.76Å; Q772-Y774 VanDerWaalsContact C-N 3.31Å; Q772-Y774 PolarHBondContact O-N 2.92Å; Y774-A776 PolarHBondContact O-N 2.99Å; Y774-E777 PolarHBondContact O-N 2.64Å; Y774-V778 HydrophobicContact CD1-CG2 4.2Å; Y774-V778 HydrophobicContact CE1-CB 4.4Å; Y774-V778 HydrophobicContact CE1-CG2 3.73Å; Y774-V778 HydrophobicContact CE2-CG2 4.23Å; Y774-V778 PolarHBondContact O-N 2.81Å
775W93.8Very high91.4Very high36 Ų3661.6 Ų61.614%0.13632%0.316CS..Hα-helixtrans-65.4-29.3177.4-65.7121.5000113V759 F763 K771 Q772 E777 L779 H780V759-W775 HydrophobicContact CG1-CH2 4.42Å; F763-W775 HydrophobicContact CD2-CH2 4.12Å; F763-W775 HydrophobicContact CD2-CZ2 4.14Å; F763-W775 HydrophobicContact CE1-CZ2 4.43Å; F763-W775 AromaticContact CE2-CH2 3.57Å; F763-W775 HydrophobicContact CE2-CH2 3.57Å; F763-W775 AromaticContact CE2-CZ2 3.68Å; F763-W775 HydrophobicContact CE2-CZ2 3.68Å; F763-W775 HydrophobicContact CZ-CH2 4.09Å; F763-W775 AromaticContact CZ-CZ2 3.82Å; F763-W775 HydrophobicContact CZ-CZ2 3.82Å; K771-W775 PolarHBondContact O-N 3.41Å; K771-W775 VanDerWaalsContact O-N 3.13Å; Q772-W775 PolarHBondContact O-N 2.9Å; W775-E777 VanDerWaalsContact C-N 3.25Å; W775-E777 PolarHBondContact O-N 2.99Å; W775-L779 HydrophobicContact CD2-CD1 4.26Å; W775-L779 HydrophobicContact CE3-CB 4.1Å; W775-L779 HydrophobicContact CE3-CD1 3.31Å; W775-L779 HydrophobicContact CE3-CG 3.45Å; W775-L779 VanDerWaalsContact CE3-CG 3.45Å; W775-L779 HydrophobicContact CH2-CD1 4.21Å; W775-L779 HydrophobicContact CZ3-CD1 3.27Å; W775-L779 HydrophobicContact CZ3-CD2 4.48Å; W775-L779 HydrophobicContact CZ3-CG 3.56Å; W775-L779 PolarHBondContact O-N 2.84Å; W775-L779 VanDerWaalsContact O-N 3.09Å; W775-H780 PolarHBondContact O-N 3Å
776A91.9Very high91.5Very high45 Ų4555.2 Ų55.237%0.37228%0.282SS..Hα-helixtrans-67-23.9172.700000113.8Q772 Q773 Y774 H780 P781Q772-A776 WeakPolarHBondContact O-CB 3.24Å; Q772-A776 PolarHBondContact O-N 2.92Å; Q773-A776 WeakPolarHBondContact O-CB 3.32Å; Q773-A776 PolarHBondContact O-N 3.34Å; Y774-A776 PolarHBondContact O-N 2.99Å; A776-H780 WeakPolarHBondContact CA-ND1 3.47Å; A776-P781 VanDerWaalsContact O-CD 3.3Å; A776-P781 WeakPolarHBondContact O-CD 3.44Å; A776-P781 WeakPolarHBondContact O-CG 3.27Å
777E90.4Very high91.5Very high53 Ų5356.9 Ų56.925%0.24829%0.291CS..Hα-helixtrans-95.3-26.8178.5-63.2-77.4-17000112.6K734 A737 Q773 Y774 W775 P781K734-E777 WeakPolarHBondContact CE-OE1 3.2Å; K734-E777 WeakPolarHBondContact CE-OE2 3.5Å; K734-E777 WeakPolarHBondContact CG-OE2 3.21Å; K734-E777 IonicContact NZ-OE1 3.5Å; K734-E777 PolarHBondContact NZ-OE1 3.34Å; A737-E777 WeakPolarHBondContact CB-O 3.45Å; Q773-E777 WeakPolarHBondContact O-CG 3.44Å; Q773-E777 PolarHBondContact O-N 3.29Å; Q773-E777 VanDerWaalsContact O-N 3.15Å; Y774-E777 PolarHBondContact O-N 2.64Å; W775-E777 VanDerWaalsContact C-N 3.25Å; W775-E777 PolarHBondContact O-N 2.99Å; E777-P781 WeakPolarHBondContact O-CG 3.39Å
778V91.5Very high91.5Very high7 Ų758 Ų584%0.04230%0.297CS..Hα-helixtrans-102-64-175.7-179.20000113A733 M755 L758 Y774A733-V778 HydrophobicContact CB-CG2 4.03Å; M755-V778 HydrophobicContact SD-CG1 4.26Å; L758-V778 HydrophobicContact CB-CG1 4.14Å; Y774-V778 HydrophobicContact CD1-CG2 4.2Å; Y774-V778 HydrophobicContact CE1-CB 4.4Å; Y774-V778 HydrophobicContact CE1-CG2 3.73Å; Y774-V778 HydrophobicContact CE2-CG2 4.23Å; Y774-V778 PolarHBondContact O-N 2.81Å
779L92.2Very high91.5Very high10 Ų1055.1 Ų55.15%0.05228%0.275CS..Hα-helixtrans-88.8-38.3-171-70.8-173.3000113.4V759 W775 L782 Q783 I818 F833V759-L779 HydrophobicContact CG2-CD2 4.33Å; W775-L779 HydrophobicContact CD2-CD1 4.26Å; W775-L779 HydrophobicContact CE3-CB 4.1Å; W775-L779 HydrophobicContact CE3-CD1 3.31Å; W775-L779 HydrophobicContact CE3-CG 3.45Å; W775-L779 VanDerWaalsContact CE3-CG 3.45Å; W775-L779 HydrophobicContact CH2-CD1 4.21Å; W775-L779 HydrophobicContact CZ3-CD1 3.27Å; W775-L779 HydrophobicContact CZ3-CD2 4.48Å; W775-L779 HydrophobicContact CZ3-CG 3.56Å; W775-L779 PolarHBondContact O-N 2.84Å; W775-L779 VanDerWaalsContact O-N 3.09Å; L779-L782 WeakPolarHBondContact O-CB 3.37Å; L779-L782 PolarHBondContact O-N 3.06Å; L779-Q783 PolarHBondContact O-N 3.32Å; L779-Q783 VanDerWaalsContact O-N 3.09Å; L779-I818 HydrophobicContact CD2-CD1 3.64Å; L779-I818 HydrophobicContact CD2-CG1 4.05Å; L779-F833 HydrophobicContact CB-CE2 3.87Å; L779-F833 HydrophobicContact CB-CZ 3.83Å; L779-F833 HydrophobicContact CD1-CD1 4.37Å; L779-F833 HydrophobicContact CD1-CD2 4.23Å; L779-F833 HydrophobicContact CD1-CE1 4.31Å; L779-F833 HydrophobicContact CD1-CE2 4.15Å; L779-F833 HydrophobicContact CD1-CG 4.33Å; L779-F833 HydrophobicContact CD1-CZ 4.18Å; L779-F833 HydrophobicContact CD2-CE1 4.01Å; L779-F833 HydrophobicContact CD2-CZ 3.99Å; L779-F833 HydrophobicContact CG-CE2 4.47Å; L779-F833 HydrophobicContact CG-CZ 4.21Å
780H91.3Very high91.4Very high81 Ų8150.8 Ų50.838%0.37525%0.252SS..Hα-helixtrans-62.3-39.5-178.9-64.5177.2000113.3W775 A776 L782 Q783 Q784W775-H780 PolarHBondContact O-N 3Å; A776-H780 WeakPolarHBondContact CA-ND1 3.47Å; H780-L782 VanDerWaalsContact C-N 3.3Å; H780-L782 PolarHBondContact O-N 3.27Å; H780-Q783 PolarHBondContact O-N 3.01Å; H780-Q784 WeakPolarHBondContact O-CB 3.44Å; H780-Q784 VanDerWaalsContact O-CG 3.32Å; H780-Q784 WeakPolarHBondContact O-CG 3.33Å; H780-Q784 PolarHBondContact O-N 2.94Å
781P91.8Very high91.3Very high29 Ų2954.6 Ų54.619%0.18827%0.271CS..Hα-helixtrans-64.8-34.2177.1-24.337.4000112.7A737 A776 E777 R785A737-P781 HydrophobicContact CB-CB 4.5Å; A776-P781 VanDerWaalsContact O-CD 3.3Å; A776-P781 WeakPolarHBondContact O-CD 3.44Å; A776-P781 WeakPolarHBondContact O-CG 3.27Å; E777-P781 WeakPolarHBondContact O-CG 3.39Å; P781-R785 WeakPolarHBondContact O-CB 3.3Å; P781-R785 VanDerWaalsContact O-CG 3.3Å; P781-R785 WeakPolarHBondContact O-CG 3.46Å; P781-R785 PolarHBondContact O-N 3.46Å; P781-R785 VanDerWaalsContact O-N 3.07Å; P781-R785 PolarHBondContact O-NE 3.28Å
782L91.6Very high91.3Very high3 Ų355 Ų552%0.01627%0.274CS..Hα-helixtrans-62.1-51.6172.7-173.972000110.6M755 L779 H780 Q784 R785 F786 T811 A814 L815 I818M755-L782 HydrophobicContact CE-CD2 4.08Å; L779-L782 WeakPolarHBondContact O-CB 3.37Å; L779-L782 PolarHBondContact O-N 3.06Å; H780-L782 VanDerWaalsContact C-N 3.3Å; H780-L782 PolarHBondContact O-N 3.27Å; L782-Q784 PolarHBondContact O-N 2.92Å; L782-R785 PolarHBondContact O-N 3.24Å; L782-F786 VanDerWaalsContact O-CB 3.29Å; L782-F786 WeakPolarHBondContact O-CB 3.47Å; L782-F786 PolarHBondContact O-N 2.92Å; L782-T811 HydrophobicContact CD1-CG2 3.92Å; L782-T811 HydrophobicContact CG-CG2 4.25Å; L782-A814 HydrophobicContact CD1-CB 4.02Å; L782-A814 HydrophobicContact CD2-CB 3.96Å; L782-L815 HydrophobicContact CD2-CD2 4.49Å; L782-I818 HydrophobicContact CD2-CD1 3.93Å
783Q91.3Very high91Very high52 Ų5259 Ų5924%0.24329%0.292CS..Hα-helixtrans-61.8-45.7180-168.4-177.623.800112.2L779 H780 F786 L787 F833 F837L779-Q783 PolarHBondContact O-N 3.32Å; L779-Q783 VanDerWaalsContact O-N 3.09Å; H780-Q783 PolarHBondContact O-N 3.01Å; Q783-F786 PolarHBondContact O-N 3.36Å; Q783-L787 HydrophobicContact CG-CD1 3.9Å; Q783-L787 HydrophobicContact CG-CG 4.34Å; Q783-L787 WeakPolarHBondContact O-CB 3.22Å; Q783-L787 VanDerWaalsContact O-CG 3.29Å; Q783-L787 WeakPolarHBondContact O-CG 3.36Å; Q783-L787 PolarHBondContact O-N 2.96Å; Q783-F833 HydrophobicContact CB-CE2 4.49Å; Q783-F837 HydrophobicContact CB-CE2 4.47Å; Q783-F837 HydrophobicContact CB-CZ 3.84Å; Q783-F837 HydrophobicContact CG-CE2 4.31Å; Q783-F837 HydrophobicContact CG-CZ 3.93Å
784Q91.1Very high90.8Very high119 Ų11957.2 Ų57.256%0.55629%0.286SS*.Hα-helixtrans-62.8-46179.9-74.9179.1-2.800111.9H780 L782 N788H780-Q784 WeakPolarHBondContact O-CB 3.44Å; H780-Q784 VanDerWaalsContact O-CG 3.32Å; H780-Q784 WeakPolarHBondContact O-CG 3.33Å; H780-Q784 PolarHBondContact O-N 2.94Å; L782-Q784 PolarHBondContact O-N 2.92Å; Q784-N788 WeakPolarHBondContact O-CB 3.41Å; Q784-N788 PolarHBondContact O-N 3.3Å; Q784-N788 PolarHBondContact O-ND2 3.3Å; Q784-N788 VanDerWaalsContact O-ND2 3.15Å
785R90.3Very high90.5Very high66 Ų6658 Ų5825%0.24929%0.29CS..Hα-helixtrans-63.6-46.4177.9-75.1-175.2-63.5-160.4-5.2112A737 P781 L782 N788 L789 E807A737-R785 PolarHBondContact O-NH1 3.28Å; A737-R785 PolarHBondContact O-NH2 3.38Å; P781-R785 WeakPolarHBondContact O-CB 3.3Å; P781-R785 VanDerWaalsContact O-CG 3.3Å; P781-R785 WeakPolarHBondContact O-CG 3.46Å; P781-R785 PolarHBondContact O-N 3.46Å; P781-R785 VanDerWaalsContact O-N 3.07Å; P781-R785 PolarHBondContact O-NE 3.28Å; L782-R785 PolarHBondContact O-N 3.24Å; R785-N788 PolarHBondContact O-N 2.69Å; R785-L789 VanDerWaalsContact O-CB 3.27Å; R785-L789 WeakPolarHBondContact O-CB 3.47Å; R785-L789 PolarHBondContact O-N 3.05Å; R785-E807 WeakPolarHBondContact CD-OE1 3.29Å; R785-E807 IonicContact NE-OE1 3.72Å
786F91.7Very high90.1Very high2 Ų259.8 Ų59.81%0.00931%0.312CS..Hα-helixtrans-58.2-52.7178.2180-109.5000111.5L782 Q783 N788 L789 I790 I808 T811 F837 L844L782-F786 VanDerWaalsContact O-CB 3.29Å; L782-F786 WeakPolarHBondContact O-CB 3.47Å; L782-F786 PolarHBondContact O-N 2.92Å; Q783-F786 PolarHBondContact O-N 3.36Å; F786-N788 PolarHBondContact O-N 3.16Å; F786-L789 WeakPolarHBondContact O-CB 3.48Å; F786-L789 PolarHBondContact O-N 3.02Å; F786-I790 HydrophobicContact CD1-CD1 4.16Å; F786-I790 HydrophobicContact CD2-CG2 4.32Å; F786-I790 HydrophobicContact CE1-CD1 3.72Å; F786-I790 HydrophobicContact CE2-CG2 4.05Å; F786-I790 HydrophobicContact CZ-CD1 4.11Å; F786-I790 HydrophobicContact CZ-CG2 4.23Å; F786-I790 WeakPolarHBondContact O-CG1 3.4Å; F786-I790 PolarHBondContact O-N 3.25Å; F786-I808 HydrophobicContact CD2-CD1 4.22Å; F786-I808 HydrophobicContact CE2-CD1 4.06Å; F786-T811 HydrophobicContact CB-CG2 4.14Å; F786-T811 HydrophobicContact CD2-CG2 3.66Å; F786-T811 HydrophobicContact CE2-CG2 4.3Å; F786-T811 HydrophobicContact CG-CG2 4.08Å; F786-F837 HydrophobicContact CB-CE1 3.98Å; F786-F837 AromaticContact CD1-CD1 3.51Å; F786-F837 HydrophobicContact CD1-CD1 3.51Å; F786-F837 AromaticContact CD1-CE1 3.51Å; F786-F837 HydrophobicContact CD1-CE1 3.51Å; F786-F837 AromaticContact CE1-CD1 3.62Å; F786-F837 HydrophobicContact CE1-CD1 3.62Å; F786-F837 HydrophobicContact CE1-CE1 4.12Å; F786-F837 HydrophobicContact CG-CD1 4.06Å; F786-F837 AromaticContact CG-CE1 3.82Å; F786-F837 HydrophobicContact CG-CE1 3.82Å; F786-F837 HydrophobicContact CZ-CD1 4.24Å; F786-L844 HydrophobicContact CE2-CD1 3.54Å; F786-L844 HydrophobicContact CZ-CD1 3.57Å
787L90.5Very high89.7Confident62 Ų6265.3 Ų65.333%0.32533%0.33SS..Hα-helixtrans-64.5-40.7179-67.9179.9000112.2Q783 L789 I790 N791Q783-L787 HydrophobicContact CG-CD1 3.9Å; Q783-L787 HydrophobicContact CG-CG 4.34Å; Q783-L787 WeakPolarHBondContact O-CB 3.22Å; Q783-L787 VanDerWaalsContact O-CG 3.29Å; Q783-L787 WeakPolarHBondContact O-CG 3.36Å; Q783-L787 PolarHBondContact O-N 2.96Å; L787-L789 PolarHBondContact O-N 3.31Å; L787-I790 HydrophobicContact CD2-CD1 4.04Å; L787-N791 WeakPolarHBondContact O-CB 3.21Å; L787-N791 VanDerWaalsContact O-CG 3.24Å; L787-N791 PolarHBondContact O-N 2.97Å; L787-N791 PolarHBondContact O-ND2 3.41Å
788N91Very high89.7Confident112 Ų11263.8 Ų63.860%0.59932%0.323SS*.Hα-helixtrans-66.4-24.5177.2-73.4-19.7000112.8Q784 R785 F786 Q792Q784-N788 WeakPolarHBondContact O-CB 3.41Å; Q784-N788 PolarHBondContact O-N 3.3Å; Q784-N788 PolarHBondContact O-ND2 3.3Å; Q784-N788 VanDerWaalsContact O-ND2 3.15Å; R785-N788 PolarHBondContact O-N 2.69Å; F786-N788 PolarHBondContact O-N 3.16Å; N788-Q792 WeakPolarHBondContact O-CG 3.28Å; N788-Q792 PolarHBondContact O-NE2 2.93Å; N788-Q792 VanDerWaalsContact O-NE2 3.17Å
789L90.8Very high89.5Confident19 Ų1963.6 Ų63.610%0.09932%0.322CS..Hα-helixtrans-81.6-52177-17466.4000111.1R785 F786 L787 N791 Q792 F795 V804 E807 I808R785-L789 VanDerWaalsContact O-CB 3.27Å; R785-L789 WeakPolarHBondContact O-CB 3.47Å; R785-L789 PolarHBondContact O-N 3.05Å; F786-L789 WeakPolarHBondContact O-CB 3.48Å; F786-L789 PolarHBondContact O-N 3.02Å; L787-L789 PolarHBondContact O-N 3.31Å; L789-N791 VanDerWaalsContact C-N 3.31Å; L789-N791 PolarHBondContact O-N 3.38Å; L789-Q792 WeakPolarHBondContact O-CG 3.35Å; L789-Q792 PolarHBondContact O-N 2.98Å; L789-F795 HydrophobicContact CD2-CE2 4.48Å; L789-F795 HydrophobicContact CG-CD2 4.3Å; L789-F795 HydrophobicContact CG-CE2 4.01Å; L789-F795 WeakPolarHBondContact O-CD2 3.15Å; L789-V804 HydrophobicContact CD1-CG1 3.97Å; L789-V804 HydrophobicContact CD1-CG2 4.34Å; L789-V804 HydrophobicContact CD2-CG1 4.07Å; L789-V804 HydrophobicContact CG-CG1 4.23Å; L789-E807 HydrophobicContact CD2-CB 4.06Å; L789-E807 HydrophobicContact CD2-CG 3.78Å; L789-I808 HydrophobicContact CD2-CD1 3.74Å; L789-I808 HydrophobicContact CD2-CG1 3.98Å
790I90.4Very high89.4Confident31 Ų3167.3 Ų67.316%0.15934%0.339CS..Hα-helixtrans-72-24.6-175.670.3177.8000113.1F786 L787 Q792 F795 I808 L844F786-I790 HydrophobicContact CD1-CD1 4.16Å; F786-I790 HydrophobicContact CD2-CG2 4.32Å; F786-I790 HydrophobicContact CE1-CD1 3.72Å; F786-I790 HydrophobicContact CE2-CG2 4.05Å; F786-I790 HydrophobicContact CZ-CD1 4.11Å; F786-I790 HydrophobicContact CZ-CG2 4.23Å; F786-I790 WeakPolarHBondContact O-CG1 3.4Å; F786-I790 PolarHBondContact O-N 3.25Å; L787-I790 HydrophobicContact CD2-CD1 4.04Å; I790-Q792 VanDerWaalsContact C-N 3.33Å; I790-F795 HydrophobicContact CG2-CE1 4.38Å; I790-F795 HydrophobicContact CG2-CE2 4.34Å; I790-F795 HydrophobicContact CG2-CZ 4.06Å; I790-I808 HydrophobicContact CG2-CD1 4.27Å; I790-L844 HydrophobicContact CG2-CD2 4.04Å
791N88.9Confident89.4Confident119 Ų11968.6 Ų68.664%0.63635%0.346SS*.THydrogen-bonded Turntrans-88.35.1178.7-66.1-44.7000113.6L787 L789L787-N791 WeakPolarHBondContact O-CB 3.21Å; L787-N791 VanDerWaalsContact O-CG 3.24Å; L787-N791 PolarHBondContact O-N 2.97Å; L787-N791 PolarHBondContact O-ND2 3.41Å; L789-N791 VanDerWaalsContact C-N 3.31Å; L789-N791 PolarHBondContact O-N 3.38Å
792Q89.8Confident89.2Confident79 Ų7972.3 Ų72.337%0.36936%0.36SS..  trans-68.6133.8172.9-60.6-177.512.300110N788 L789 I790 N794 F795N788-Q792 WeakPolarHBondContact O-CG 3.28Å; N788-Q792 PolarHBondContact O-NE2 2.93Å; N788-Q792 VanDerWaalsContact O-NE2 3.17Å; L789-Q792 WeakPolarHBondContact O-CG 3.35Å; L789-Q792 PolarHBondContact O-N 2.98Å; I790-Q792 VanDerWaalsContact C-N 3.33Å; Q792-N794 WeakPolarHBondContact CB-OD1 3.47Å; Q792-N794 PolarHBondContact O-N 3.42Å; Q792-N794 VanDerWaalsContact O-N 3.09Å; Q792-F795 HydrophobicContact CB-CB 4.38Å; Q792-F795 WeakPolarHBondContact O-CB 3.22Å; Q792-F795 PolarHBondContact O-N 3.34Å
793E84.4Confident89Confident210 Ų21075.7 Ų75.798%0.98139%0.389SS*.THydrogen-bonded Turntrans-59-27.7-178-64.3-174.6171.700112.9
794N87.9Confident89Confident67 Ų6773.8 Ų73.836%0.35838%0.381SS..THydrogen-bonded Turntrans-95.98.8177.165.1-33.4000113.9Q792 A796 Q797 I798Q792-N794 WeakPolarHBondContact CB-OD1 3.47Å; Q792-N794 PolarHBondContact O-N 3.42Å; Q792-N794 VanDerWaalsContact O-N 3.09Å; N794-A796 VanDerWaalsContact C-N 3.33Å; N794-A796 PolarHBondContact O-N 2.83Å; N794-Q797 WeakPolarHBondContact O-CA 3.43Å; N794-Q797 WeakPolarHBondContact O-CB 3.2Å; N794-Q797 PolarHBondContact O-N 2.75Å; N794-I798 WeakPolarHBondContact ND2-CG2 3.48Å; N794-I798 PolarHBondContact O-N 2.84Å; N794-I798 VanDerWaalsContact O-N 3.12Å
795F88.8Confident88.9Confident16 Ų1670 Ų707%0.0736%0.363CS..Hα-helixtrans-51.5-46.9-173.4177.3-110.7000113.1L789 I790 Q792 Q797 I798 S799 V804 I808 L844 V847 Y848L789-F795 HydrophobicContact CD2-CE2 4.48Å; L789-F795 HydrophobicContact CG-CD2 4.3Å; L789-F795 HydrophobicContact CG-CE2 4.01Å; L789-F795 WeakPolarHBondContact O-CD2 3.15Å; I790-F795 HydrophobicContact CG2-CE1 4.38Å; I790-F795 HydrophobicContact CG2-CE2 4.34Å; I790-F795 HydrophobicContact CG2-CZ 4.06Å; Q792-F795 HydrophobicContact CB-CB 4.38Å; Q792-F795 WeakPolarHBondContact O-CB 3.22Å; Q792-F795 PolarHBondContact O-N 3.34Å; F795-Q797 PolarHBondContact O-N 2.88Å; F795-Q797 VanDerWaalsContact O-N 3.14Å; F795-I798 WeakPolarHBondContact O-CG1 3.43Å; F795-I798 PolarHBondContact O-N 3.22Å; F795-S799 WeakPolarHBondContact O-CA 3.28Å; F795-S799 VanDerWaalsContact O-CB 3.28Å; F795-S799 WeakPolarHBondContact O-CB 3.49Å; F795-S799 PolarHBondContact O-N 3.13Å; F795-V804 HydrophobicContact CD2-CG1 4.49Å; F795-V804 HydrophobicContact CE2-CG1 3.92Å; F795-I808 HydrophobicContact CZ-CD1 4.43Å; F795-L844 HydrophobicContact CE1-CD2 3.75Å; F795-L844 HydrophobicContact CZ-CD2 3.56Å; F795-V847 HydrophobicContact CE1-CG1 4.11Å; F795-V847 HydrophobicContact CE1-CG2 4.3Å; F795-Y848 HydrophobicContact CZ-CE2 4.19Å
796A83.8Confident88.7Confident73 Ų7373.7 Ų73.760%0.60338%0.376SS*.Hα-helixtrans-58.6-31.1179.200000113.1N794 S799N794-A796 VanDerWaalsContact C-N 3.33Å; N794-A796 PolarHBondContact O-N 2.83Å; A796-S799 PolarHBondContact O-OG 2.91Å
797Q84.8Confident88.6Confident162 Ų16275.6 Ų75.676%0.75739%0.386SS*.Hα-helixtrans-79.9-39.9179.5-60.7175-800112.1N794 F795N794-Q797 WeakPolarHBondContact O-CA 3.43Å; N794-Q797 WeakPolarHBondContact O-CB 3.2Å; N794-Q797 PolarHBondContact O-N 2.75Å; F795-Q797 PolarHBondContact O-N 2.88Å; F795-Q797 VanDerWaalsContact O-N 3.14Å
798I90.1Very high88.7Confident20 Ų2072.7 Ų72.710%0.10337%0.37CS..Hα-helixtrans-87.5-11.4-179.265.4172.1000113.2N794 F795 Q800 E801 V804N794-I798 WeakPolarHBondContact ND2-CG2 3.48Å; N794-I798 PolarHBondContact O-N 2.84Å; N794-I798 VanDerWaalsContact O-N 3.12Å; F795-I798 WeakPolarHBondContact O-CG1 3.43Å; F795-I798 PolarHBondContact O-N 3.22Å; I798-Q800 PolarHBondContact O-N 2.99Å; I798-E801 HydrophobicContact CB-CG 4.48Å; I798-E801 VanDerWaalsContact O-CB 3.27Å; I798-E801 WeakPolarHBondContact O-CB 3.46Å; I798-E801 WeakPolarHBondContact O-CG 3.33Å; I798-E801 PolarHBondContact O-N 3.44Å; I798-V804 HydrophobicContact CB-CG2 4.38Å; I798-V804 HydrophobicContact CD1-CG2 4.24Å; I798-V804 HydrophobicContact CG1-CG2 4.29Å; I798-V804 WeakPolarHBondContact O-CG2 3.33Å
799S87.8Confident88.7Confident3 Ų369.2 Ų69.22%0.02135%0.353CS..THydrogen-bonded Turntrans-54.1-28.8-178.363.70000113.3F795 A796 E801 K805 V847 Y848F795-S799 WeakPolarHBondContact O-CA 3.28Å; F795-S799 VanDerWaalsContact O-CB 3.28Å; F795-S799 WeakPolarHBondContact O-CB 3.49Å; F795-S799 PolarHBondContact O-N 3.13Å; A796-S799 PolarHBondContact O-OG 2.91Å; S799-E801 VanDerWaalsContact C-N 3.34Å; S799-K805 WeakPolarHBondContact O-CG 3.46Å; S799-V847 WeakPolarHBondContact OG-CG1 3.33Å; S799-Y848 WeakPolarHBondContact O-CE1 3.4Å; S799-Y848 PolarHBondContact O-OH 2.82Å
800Q88.9Confident88.6Confident88 Ų8868.9 Ų68.941%0.41135%0.353SS..THydrogen-bonded Turntrans-85.3-6.8-179.5-61.6-57.3-46.700113.8I798 K805I798-Q800 PolarHBondContact O-N 2.99Å; Q800-K805 WeakPolarHBondContact O-CE 3.45Å
801E92.1Very high88.7Confident109 Ų10967.4 Ų67.451%0.50935%0.345SS..SBendtrans-69.5135.8174.5-63.6-178.6-169.200110.6I798 S799 A803 V804 K805I798-E801 HydrophobicContact CB-CG 4.48Å; I798-E801 VanDerWaalsContact O-CB 3.27Å; I798-E801 WeakPolarHBondContact O-CB 3.46Å; I798-E801 WeakPolarHBondContact O-CG 3.33Å; I798-E801 PolarHBondContact O-N 3.44Å; S799-E801 VanDerWaalsContact C-N 3.34Å; E801-A803 PolarHBondContact O-N 3.41Å; E801-V804 HydrophobicContact CB-CG2 4.24Å; E801-V804 PolarHBondContact O-N 3.48Å; E801-K805 PolarHBondContact O-N 2.97Å
802E88Confident89Confident106 Ų10661.8 Ų61.850%0.49532%0.315SS..Hα-helixtrans-55.6-38-175.8-176.861.6-168.600113V804 K805 R806E802-V804 PolarHBondContact O-N 2.9Å; E802-K805 PolarHBondContact O-N 3.41Å; E802-R806 WeakPolarHBondContact O-CB 3.41Å; E802-R806 VanDerWaalsContact O-CG 3.28Å; E802-R806 WeakPolarHBondContact O-CG 3.37Å; E802-R806 PolarHBondContact O-N 3.49Å; E802-R806 IonicContact OE1-CZ 3.38Å; E802-R806 VanDerWaalsContact OE1-CZ 3.29Å; E802-R806 IonicContact OE1-NE 3.8Å; E802-R806 PolarHBondContact OE1-NE 3.12Å; E802-R806 IonicContact OE1-NH2 3.97Å; E802-R806 PolarHBondContact OE1-NH2 3.44Å
803A87.1Confident89.1Confident74 Ų7458.8 Ų58.861%0.61230%0.301SS*.Hα-helixtrans-64.8-39.5177.400000112.5E801 E807E801-A803 PolarHBondContact O-N 3.41Å; A803-E807 WeakPolarHBondContact O-CB 3.4Å; A803-E807 PolarHBondContact O-N 3.47Å; A803-E807 VanDerWaalsContact O-N 3.12Å
804V90.4Very high89.6Confident12 Ų1249 Ų497%0.07326%0.257CS..Hα-helixtrans-72.5-41.4178.6-179.80000110.3L789 F795 I798 E801 E802 E807 I808L789-V804 HydrophobicContact CD1-CG1 3.97Å; L789-V804 HydrophobicContact CD1-CG2 4.34Å; L789-V804 HydrophobicContact CD2-CG1 4.07Å; L789-V804 HydrophobicContact CG-CG1 4.23Å; F795-V804 HydrophobicContact CD2-CG1 4.49Å; F795-V804 HydrophobicContact CE2-CG1 3.92Å; I798-V804 HydrophobicContact CB-CG2 4.38Å; I798-V804 HydrophobicContact CD1-CG2 4.24Å; I798-V804 HydrophobicContact CG1-CG2 4.29Å; I798-V804 WeakPolarHBondContact O-CG2 3.33Å; E801-V804 HydrophobicContact CB-CG2 4.24Å; E801-V804 PolarHBondContact O-N 3.48Å; E802-V804 PolarHBondContact O-N 2.9Å; V804-E807 PolarHBondContact O-N 3.37Å; V804-I808 WeakPolarHBondContact O-CG1 3.36Å; V804-I808 PolarHBondContact O-N 3.31Å
805K89.3Confident90Very high41 Ų4145.9 Ų45.918%0.17824%0.24CC..Hα-helixtrans-58.2-50.7174.3-72.7-170.5-177.8-169.50112S799 Q800 E801 E802 E807 I808 V809 Y848S799-K805 WeakPolarHBondContact O-CG 3.46Å; Q800-K805 WeakPolarHBondContact O-CE 3.45Å; E801-K805 PolarHBondContact O-N 2.97Å; E802-K805 PolarHBondContact O-N 3.41Å; K805-E807 VanDerWaalsContact C-N 3.27Å; K805-E807 PolarHBondContact O-N 3.42Å; K805-I808 PolarHBondContact O-N 2.89Å; K805-I808 VanDerWaalsContact O-N 3.17Å; K805-V809 WeakPolarHBondContact O-CG2 3.24Å; K805-V809 PolarHBondContact O-N 3.47Å; K805-Y848 HydrophobicContact CG-CE1 3.97Å
806R87.1Confident90.4Very high142 Ų14245.1 Ų45.154%0.53624%0.236SC..Hα-helixtrans-58.5-40.1176.7-73.5178.9-167.5-172.42.6112.1E802 I808 V809 A810E802-R806 WeakPolarHBondContact O-CB 3.41Å; E802-R806 VanDerWaalsContact O-CG 3.28Å; E802-R806 WeakPolarHBondContact O-CG 3.37Å; E802-R806 PolarHBondContact O-N 3.49Å; E802-R806 IonicContact OE1-CZ 3.38Å; E802-R806 VanDerWaalsContact OE1-CZ 3.29Å; E802-R806 IonicContact OE1-NE 3.8Å; E802-R806 PolarHBondContact OE1-NE 3.12Å; E802-R806 IonicContact OE1-NH2 3.97Å; E802-R806 PolarHBondContact OE1-NH2 3.44Å; R806-I808 VanDerWaalsContact C-N 3.35Å; R806-I808 PolarHBondContact O-N 2.9Å; R806-V809 PolarHBondContact O-N 3.24Å; R806-A810 VanDerWaalsContact O-CB 3.27Å; R806-A810 WeakPolarHBondContact O-CB 3.47Å; R806-A810 PolarHBondContact O-N 3.32Å
807E88.6Confident91Very high43 Ų4341.7 Ų41.720%0.20121%0.208CC..Hα-helixtrans-64.2-40.2178.4-173.168.5-16300111.8R739 R785 L789 A803 V804 K805 T811R739-E807 WeakPolarHBondContact CD-OE2 3.39Å; R739-E807 IonicContact CZ-OE1 3.26Å; R739-E807 IonicContact CZ-OE2 3.43Å; R739-E807 IonicContact NE-OE1 3.08Å; R739-E807 IonicContact NE-OE2 3.19Å; R739-E807 VanDerWaalsContact NH1-CA 3.34Å; R739-E807 PolarHBondContact NH1-O 2.94Å; R739-E807 IonicContact NH1-OE1 2.71Å; R739-E807 PolarHBondContact NH1-OE1 2.85Å; R739-E807 IonicContact NH1-OE2 3.38Å; R739-E807 PolarHBondContact NH1-OE2 3.14Å; R785-E807 WeakPolarHBondContact CD-OE1 3.29Å; R785-E807 IonicContact NE-OE1 3.72Å; L789-E807 HydrophobicContact CD2-CB 4.06Å; L789-E807 HydrophobicContact CD2-CG 3.78Å; A803-E807 WeakPolarHBondContact O-CB 3.4Å; A803-E807 PolarHBondContact O-N 3.47Å; A803-E807 VanDerWaalsContact O-N 3.12Å; V804-E807 PolarHBondContact O-N 3.37Å; K805-E807 VanDerWaalsContact C-N 3.27Å; K805-E807 PolarHBondContact O-N 3.42Å; E807-T811 WeakPolarHBondContact O-CB 3.36Å; E807-T811 PolarHBondContact O-N 3.29Å; E807-T811 VanDerWaalsContact O-N 3.13Å; E807-T811 PolarHBondContact O-OG1 3.49Å
808I92.1Very high91.6Very high0 Ų034 Ų340%017%0.172CC..Hα-helixtrans-67.4-51.1174.7-67.9-65.4000111F786 L789 I790 F795 V804 K805 R806 A810 T811 L812 L844 Y848 T854F786-I808 HydrophobicContact CD2-CD1 4.22Å; F786-I808 HydrophobicContact CE2-CD1 4.06Å; L789-I808 HydrophobicContact CD2-CD1 3.74Å; L789-I808 HydrophobicContact CD2-CG1 3.98Å; I790-I808 HydrophobicContact CG2-CD1 4.27Å; F795-I808 HydrophobicContact CZ-CD1 4.43Å; V804-I808 WeakPolarHBondContact O-CG1 3.36Å; V804-I808 PolarHBondContact O-N 3.31Å; K805-I808 PolarHBondContact O-N 2.89Å; K805-I808 VanDerWaalsContact O-N 3.17Å; R806-I808 VanDerWaalsContact C-N 3.35Å; R806-I808 PolarHBondContact O-N 2.9Å; I808-A810 PolarHBondContact O-N 3.28Å; I808-T811 CarbonylContact O-C 3.55Å; I808-T811 WeakPolarHBondContact O-CA 3.27Å; I808-T811 WeakPolarHBondContact O-CB 3.32Å; I808-T811 PolarHBondContact O-N 3.44Å; I808-L812 HydrophobicContact CG2-CD1 3.93Å; I808-L812 HydrophobicContact CG2-CG 4.28Å; I808-L812 WeakPolarHBondContact O-CG 3.39Å; I808-L812 PolarHBondContact O-N 2.96Å; I808-L844 HydrophobicContact CD1-CD1 4.34Å; I808-L844 HydrophobicContact CD1-CD2 4.04Å; I808-Y848 HydrophobicContact CG1-CE2 4.28Å; I808-Y848 HydrophobicContact CG2-CE2 4.33Å; I808-T854 HydrophobicContact CG2-CG2 4.18Å
809V90.8Very high91.9Very high40 Ų4033 Ų3324%0.24217%0.167CC..Hα-helixtrans-55.5-51.5178.8168.30000110.5K805 R806 T811 L812 E813 L857K805-V809 WeakPolarHBondContact O-CG2 3.24Å; K805-V809 PolarHBondContact O-N 3.47Å; R806-V809 PolarHBondContact O-N 3.24Å; V809-T811 PolarHBondContact O-N 3.45Å; V809-T811 VanDerWaalsContact O-N 3.16Å; V809-L812 PolarHBondContact O-N 3.34Å; V809-E813 HydrophobicContact CG1-CG 4.41Å; V809-E813 WeakPolarHBondContact O-CG 3.39Å; V809-E813 PolarHBondContact O-N 3.14Å; V809-L857 HydrophobicContact CB-CD2 4.29Å; V809-L857 HydrophobicContact CG1-CD2 3.82Å; V809-L857 HydrophobicContact CG2-CD2 4.43Å
810A88.6Confident92.3Very high11 Ų1135 Ų359%0.09118%0.176CC..Hα-helixtrans-63.1-25.1177.400000113.3R806 I808 A814R806-A810 VanDerWaalsContact O-CB 3.27Å; R806-A810 WeakPolarHBondContact O-CB 3.47Å; R806-A810 PolarHBondContact O-N 3.32Å; I808-A810 PolarHBondContact O-N 3.28Å; A810-A814 WeakPolarHBondContact O-CB 3.4Å; A810-A814 PolarHBondContact O-N 3.03Å
811T93.1Very high92.6Very high1 Ų130.8 Ų30.81%0.00616%0.156CC..Hα-helixtrans-74.1-44172.1-58.20000111.4R739 L782 F786 E807 I808 V809 A814 L815 F837R739-T811 PolarHBondContact NH2-OG1 3.07Å; R739-T811 VanDerWaalsContact NH2-OG1 3.1Å; L782-T811 HydrophobicContact CD1-CG2 3.92Å; L782-T811 HydrophobicContact CG-CG2 4.25Å; F786-T811 HydrophobicContact CB-CG2 4.14Å; F786-T811 HydrophobicContact CD2-CG2 3.66Å; F786-T811 HydrophobicContact CE2-CG2 4.3Å; F786-T811 HydrophobicContact CG-CG2 4.08Å; E807-T811 WeakPolarHBondContact O-CB 3.36Å; E807-T811 PolarHBondContact O-N 3.29Å; E807-T811 VanDerWaalsContact O-N 3.13Å; E807-T811 PolarHBondContact O-OG1 3.49Å; I808-T811 CarbonylContact O-C 3.55Å; I808-T811 WeakPolarHBondContact O-CA 3.27Å; I808-T811 WeakPolarHBondContact O-CB 3.32Å; I808-T811 PolarHBondContact O-N 3.44Å; V809-T811 PolarHBondContact O-N 3.45Å; V809-T811 VanDerWaalsContact O-N 3.16Å; T811-A814 WeakPolarHBondContact O-CB 3.37Å; T811-A814 PolarHBondContact O-N 2.93Å; T811-L815 WeakPolarHBondContact O-CG 3.44Å; T811-L815 PolarHBondContact O-N 3.25Å; T811-F837 HydrophobicContact CG2-CE1 4.42Å
812L94.9Very high92.7Very high0 Ų026.7 Ų26.70%014%0.139CC..Hα-helixtrans-63.9-42.3177.7-62.6170.9000111.3I808 V809 A814 L815 C816 T854 L857 I858 V861I808-L812 HydrophobicContact CG2-CD1 3.93Å; I808-L812 HydrophobicContact CG2-CG 4.28Å; I808-L812 WeakPolarHBondContact O-CG 3.39Å; I808-L812 PolarHBondContact O-N 2.96Å; V809-L812 PolarHBondContact O-N 3.34Å; L812-A814 VanDerWaalsContact C-N 3.3Å; L812-A814 PolarHBondContact O-N 3.15Å; L812-L815 HydrophobicContact CD2-CD1 4.33Å; L812-L815 WeakPolarHBondContact O-CA 3.14Å; L812-L815 WeakPolarHBondContact O-CB 3.48Å; L812-L815 PolarHBondContact O-N 2.94Å; L812-C816 PolarHBondContact O-N 2.93Å; L812-T854 HydrophobicContact CD1-CG2 4.26Å; L812-L857 HydrophobicContact CB-CD1 4.46Å; L812-L857 HydrophobicContact CB-CD2 3.63Å; L812-L857 HydrophobicContact CB-CG 3.67Å; L812-L857 HydrophobicContact CD1-CB 4.33Å; L812-L857 HydrophobicContact CD1-CD2 3.98Å; L812-L857 HydrophobicContact CD1-CG 4Å; L812-L857 HydrophobicContact CG-CD2 4.45Å; L812-L857 HydrophobicContact CG-CG 4.49Å; L812-I858 HydrophobicContact CD1-CG1 3.68Å; L812-I858 HydrophobicContact CD2-CG1 4.07Å; L812-V861 HydrophobicContact CB-CG2 4.02Å; L812-V861 HydrophobicContact CD2-CG2 4.18Å; L812-V861 WeakPolarHBondContact O-CG2 3.4Å
813E93.6Very high92.8Very high17 Ų1724.7 Ų24.78%0.07913%0.129CC..Hα-helixtrans-58.8-41173.3-68.9-65.8-17900112.5S748 R752 V809 L815 C816 G817 L857S748-E813 VanDerWaalsContact CB-OE1 3.31Å; S748-E813 WeakPolarHBondContact CB-OE1 3.47Å; S748-E813 PolarHBondContact OG-OE1 3.12Å; R752-E813 IonicContact CZ-OE2 3.2Å; R752-E813 VanDerWaalsContact CZ-OE2 3.27Å; R752-E813 IonicContact NE-OE2 2.73Å; R752-E813 PolarHBondContact NE-OE2 3.35Å; R752-E813 IonicContact NH2-OE1 2.65Å; R752-E813 IonicContact NH2-OE2 3.52Å; R752-E813 PolarHBondContact NH2-OE2 2.87Å; V809-E813 HydrophobicContact CG1-CG 4.41Å; V809-E813 WeakPolarHBondContact O-CG 3.39Å; V809-E813 PolarHBondContact O-N 3.14Å; E813-L815 VanDerWaalsContact C-N 3.31Å; E813-L815 PolarHBondContact O-N 3.46Å; E813-C816 WeakPolarHBondContact O-CB 3.31Å; E813-C816 PolarHBondContact O-N 3.16Å; E813-G817 PolarHBondContact O-N 3.43Å; E813-L857 HydrophobicContact CG-CD2 4.17Å
814A94.2Very high92.8Very high5 Ų527.4 Ų27.44%0.04113%0.132CC..Hα-helixtrans-63.7-36.2173.900000112.1M755 L782 A810 T811 L812 G817 I818M755-A814 HydrophobicContact CE-CB 3.66Å; M755-A814 HydrophobicContact CG-CB 4.17Å; M755-A814 WeakPolarHBondContact CG-O 3.32Å; L782-A814 HydrophobicContact CD1-CB 4.02Å; L782-A814 HydrophobicContact CD2-CB 3.96Å; A810-A814 WeakPolarHBondContact O-CB 3.4Å; A810-A814 PolarHBondContact O-N 3.03Å; T811-A814 WeakPolarHBondContact O-CB 3.37Å; T811-A814 PolarHBondContact O-N 2.93Å; L812-A814 VanDerWaalsContact C-N 3.3Å; L812-A814 PolarHBondContact O-N 3.15Å; A814-G817 PolarHBondContact O-N 3.3Å; A814-I818 WeakPolarHBondContact O-CD1 3.45Å; A814-I818 WeakPolarHBondContact O-CG1 3.12Å; A814-I818 PolarHBondContact O-N 3.08Å
815L96.4Very high92.6Very high1 Ų130.2 Ų30.21%0.00515%0.147CC..Hα-helixtrans-66.5-39.7174.6-63.1174.4000111.9L782 T811 L812 E813 G817 I818 A819 L834 F837 V861L782-L815 HydrophobicContact CD2-CD2 4.49Å; T811-L815 WeakPolarHBondContact O-CG 3.44Å; T811-L815 PolarHBondContact O-N 3.25Å; L812-L815 HydrophobicContact CD2-CD1 4.33Å; L812-L815 WeakPolarHBondContact O-CA 3.14Å; L812-L815 WeakPolarHBondContact O-CB 3.48Å; L812-L815 PolarHBondContact O-N 2.94Å; E813-L815 VanDerWaalsContact C-N 3.31Å; E813-L815 PolarHBondContact O-N 3.46Å; L815-G817 VanDerWaalsContact C-N 3.34Å; L815-I818 HydrophobicContact CD2-CD1 4.22Å; L815-I818 PolarHBondContact O-N 3.02Å; L815-A819 PolarHBondContact O-N 3.47Å; L815-L834 HydrophobicContact CB-CD2 4.26Å; L815-L834 HydrophobicContact CD2-CD2 3.66Å; L815-F837 HydrophobicContact CD1-CB 3.69Å; L815-F837 HydrophobicContact CD1-CD1 3.91Å; L815-F837 HydrophobicContact CD1-CG 3.97Å; L815-F837 HydrophobicContact CD2-CB 3.99Å; L815-F837 HydrophobicContact CD2-CD1 3.83Å; L815-F837 HydrophobicContact CD2-CD2 3.86Å; L815-F837 HydrophobicContact CD2-CE1 4.21Å; L815-F837 HydrophobicContact CD2-CE2 4.27Å; L815-F837 HydrophobicContact CD2-CG 3.63Å; L815-F837 HydrophobicContact CD2-CZ 4.41Å; L815-F837 HydrophobicContact CG-CD1 4.41Å; L815-F837 HydrophobicContact CG-CG 4.46Å; L815-V861 HydrophobicContact CB-CG1 3.9Å; L815-V861 HydrophobicContact CB-CG2 4.19Å; L815-V861 HydrophobicContact CD1-CG1 4.28Å
816C97.1Very high92.6Very high0 Ų028.3 Ų28.30%014%0.138CC..Hα-helixtrans-57.6-47.8170.6-64.90000110.7R752 L812 E813 I818 A819 E820 V861 E864R752-C816 HydrophobicContact CG-CB 4.05Å; L812-C816 PolarHBondContact O-N 2.93Å; E813-C816 WeakPolarHBondContact O-CB 3.31Å; E813-C816 PolarHBondContact O-N 3.16Å; C816-I818 VanDerWaalsContact C-N 3.33Å; C816-I818 PolarHBondContact O-N 3.44Å; C816-A819 WeakPolarHBondContact O-CB 3.48Å; C816-A819 PolarHBondContact O-N 3.17Å; C816-A819 VanDerWaalsContact O-N 3.07Å; C816-E820 PolarHBondContact O-N 2.59Å; C816-V861 VanDerWaalsContact SG-CG2 3.51Å; C816-E864 HydrophobicContact CB-CG 4.37Å
817G96.3Very high92.8Very high0 Ų022 Ų220%012%0.116CC..Hα-helixtrans-61.5-37177.700000113.6R752 K756 E813 A814 L815 E820 A821R752-G817 WeakPolarHBondContact O-CA 3.39Å; K756-G817 WeakPolarHBondContact CA-O 3.42Å; K756-G817 WeakPolarHBondContact CB-O 3.42Å; E813-G817 PolarHBondContact O-N 3.43Å; A814-G817 PolarHBondContact O-N 3.3Å; L815-G817 VanDerWaalsContact C-N 3.34Å; G817-E820 PolarHBondContact O-N 2.94Å; G817-A821 PolarHBondContact O-N 3.42Å; G817-A821 VanDerWaalsContact O-N 3.16Å
818I97.1Very high92.9Very high0 Ų022.2 Ų22.20%013%0.125CC..Hα-helixtrans-66.3-39.9173.7-65.5158.2000110.9M755 V759 L779 L782 A814 L815 C816 A821 L830 F833 L834M755-I818 HydrophobicContact CG-CD1 4.41Å; M755-I818 HydrophobicContact CG-CG1 3.79Å; M755-I818 HydrophobicContact SD-CG1 4.22Å; V759-I818 HydrophobicContact CG2-CB 4.38Å; V759-I818 HydrophobicContact CG2-CG1 3.69Å; L779-I818 HydrophobicContact CD2-CD1 3.64Å; L779-I818 HydrophobicContact CD2-CG1 4.05Å; L782-I818 HydrophobicContact CD2-CD1 3.93Å; A814-I818 WeakPolarHBondContact O-CD1 3.45Å; A814-I818 WeakPolarHBondContact O-CG1 3.12Å; A814-I818 PolarHBondContact O-N 3.08Å; L815-I818 HydrophobicContact CD2-CD1 4.22Å; L815-I818 PolarHBondContact O-N 3.02Å; C816-I818 VanDerWaalsContact C-N 3.33Å; C816-I818 PolarHBondContact O-N 3.44Å; I818-A821 PolarHBondContact O-N 3.48Å; I818-L830 HydrophobicContact CG2-CD2 4.01Å; I818-F833 HydrophobicContact CD1-CD1 4.41Å; I818-F833 HydrophobicContact CD1-CE1 3.79Å; I818-L834 HydrophobicContact CB-CD2 4.05Å; I818-L834 HydrophobicContact CG2-CD1 4.09Å; I818-L834 HydrophobicContact CG2-CD2 3.78Å; I818-L834 HydrophobicContact CG2-CG 4.04Å
819A96.8Very high92.8Very high0 Ų025.8 Ų25.80%015%0.15CC..Hα-helixtrans-65.6-42.1175.900000111.7L815 C816 A821 T822 L834 E864 V865 K868L815-A819 PolarHBondContact O-N 3.47Å; C816-A819 WeakPolarHBondContact O-CB 3.48Å; C816-A819 PolarHBondContact O-N 3.17Å; C816-A819 VanDerWaalsContact O-N 3.07Å; A819-A821 PolarHBondContact O-N 3.43Å; A819-T822 VanDerWaalsContact O-CB 3.26Å; A819-T822 WeakPolarHBondContact O-CB 3.24Å; A819-T822 PolarHBondContact O-N 2.96Å; A819-T822 VanDerWaalsContact O-N 3.11Å; A819-T822 PolarHBondContact O-OG1 3.39Å; A819-L834 HydrophobicContact CB-CD1 4.14Å; A819-E864 HydrophobicContact CB-CB 3.91Å; A819-V865 HydrophobicContact CB-CG2 3.96Å; A819-K868 WeakPolarHBondContact O-CB 3.47Å
820E95.9Very high93Very high44 Ų4424 Ų2421%0.20614%0.139CC..Hα-helixtrans-64-24.2175.6-74.1-175.7-159.600114.1R752 K756 C816 G817 T822R752-E820 WeakPolarHBondContact CD-OE1 3.18Å; R752-E820 IonicContact NH1-OE1 3.63Å; K756-E820 HydrophobicContact CD-CB 3.95Å; K756-E820 HydrophobicContact CG-CB 4.23Å; K756-E820 IonicContact NZ-OE2 3.41Å; C816-E820 PolarHBondContact O-N 2.59Å; G817-E820 PolarHBondContact O-N 2.94Å; E820-T822 PolarHBondContact O-N 2.89Å
821A95.8Very high93.3Very high1 Ų123.7 Ų23.71%0.00814%0.135CC..THydrogen-bonded Turntrans-77.53.9175.200000113.8K756 V759 L760 G817 I818 A819 Q823 N826K756-A821 HydrophobicContact CB-CB 4.49Å; K756-A821 HydrophobicContact CG-CB 4.07Å; V759-A821 HydrophobicContact CB-CB 3.72Å; V759-A821 HydrophobicContact CG1-CB 3.56Å; L760-A821 HydrophobicContact CD2-CB 4.18Å; L760-A821 WeakPolarHBondContact CD2-O 3.36Å; L760-A821 HydrophobicContact CG-CB 4.01Å; G817-A821 PolarHBondContact O-N 3.42Å; G817-A821 VanDerWaalsContact O-N 3.16Å; I818-A821 PolarHBondContact O-N 3.48Å; A819-A821 PolarHBondContact O-N 3.43Å; A821-Q823 PolarHBondContact O-N 2.86Å; A821-N826 PolarHBondContact O-ND2 3.01Å
822T94.4Very high93.3Very high22 Ų2226.7 Ų26.714%0.13516%0.157CC..  trans-64.2127.3-179.1-57.40000111.3A819 E820 N826 V827 Q869A819-T822 VanDerWaalsContact O-CB 3.26Å; A819-T822 WeakPolarHBondContact O-CB 3.24Å; A819-T822 PolarHBondContact O-N 2.96Å; A819-T822 VanDerWaalsContact O-N 3.11Å; A819-T822 PolarHBondContact O-OG1 3.39Å; E820-T822 PolarHBondContact O-N 2.89Å; T822-N826 WeakPolarHBondContact CA-OD1 3.41Å; T822-V827 HydrophobicContact CG2-CB 3.72Å; T822-V827 HydrophobicContact CG2-CG2 3.71Å; T822-Q869 HydrophobicContact CG2-CG 3.87Å; T822-Q869 WeakPolarHBondContact OG1-CG 3.35Å; T822-Q869 PolarHBondContact OG1-NE2 2.91Å
823Q89.8Confident93.2Very high64 Ų6428.1 Ų28.130%0.29916%0.163SC..  trans-128.4164.2169.6-65.3-176.6-25.600108.9L760 A821 D825 N826 V827L760-Q823 HydrophobicContact CD2-CG 4.06Å; A821-Q823 PolarHBondContact O-N 2.86Å; Q823-D825 WeakPolarHBondContact CB-OD1 3.47Å; Q823-D825 PolarHBondContact O-N 3.23Å; Q823-D825 VanDerWaalsContact O-N 3.15Å; Q823-N826 PolarHBondContact N-ND2 3.39Å; Q823-N826 PolarHBondContact N-OD1 3.42Å; Q823-N826 PolarHBondContact O-N 3.3Å; Q823-N826 VanDerWaalsContact O-N 3.12Å; Q823-N826 PolarHBondContact O-OD1 3.02Å; Q823-N826 VanDerWaalsContact O-OD1 3.06Å; Q823-V827 PolarHBondContact O-N 2.93Å
824I87.9Confident93.4Very high132 Ų13227.4 Ų27.468%0.67716%0.16SC*.THydrogen-bonded Turntrans-54.8-37.3-176.8-61.7170.8000111.8Y872I824-Y872 HydrophobicContact CD1-CE1 4.43Å; I824-Y872 HydrophobicContact CG1-CD1 4.23Å; I824-Y872 HydrophobicContact CG1-CE1 3.76Å
825D85Confident93.4Very high71 Ų7128.2 Ų28.238%0.3816%0.163SC..THydrogen-bonded Turntrans-81.7-20-176.763.5-31.1000114.5R717 Q823R717-D825 IonicContact CZ-OD2 3.83Å; R717-D825 IonicContact NE-OD2 2.75Å; R717-D825 VanDerWaalsContact NH2-CG 3.26Å; R717-D825 IonicContact NH2-OD2 2.71Å; R717-D825 PolarHBondContact NH2-OD2 2.91Å; Q823-D825 WeakPolarHBondContact CB-OD1 3.47Å; Q823-D825 PolarHBondContact O-N 3.23Å; Q823-D825 VanDerWaalsContact O-N 3.15Å
826N90.2Very high93Very high0 Ų032.7 Ų32.70%019%0.187CC..THydrogen-bonded Turntrans-110.9-15-173.175.323.9000114.4F763 A821 T822 Q823 A828 S829 L830F763-N826 HydrophobicContact CD1-CB 3.61Å; F763-N826 HydrophobicContact CD2-CB 3.87Å; F763-N826 HydrophobicContact CE1-CB 3.43Å; F763-N826 VanDerWaalsContact CE1-CB 3.43Å; F763-N826 HydrophobicContact CE2-CB 3.71Å; F763-N826 HydrophobicContact CG-CB 3.85Å; F763-N826 HydrophobicContact CZ-CB 3.51Å; A821-N826 PolarHBondContact O-ND2 3.01Å; T822-N826 WeakPolarHBondContact CA-OD1 3.41Å; Q823-N826 PolarHBondContact N-ND2 3.39Å; Q823-N826 PolarHBondContact N-OD1 3.42Å; Q823-N826 PolarHBondContact O-N 3.3Å; Q823-N826 VanDerWaalsContact O-N 3.12Å; Q823-N826 PolarHBondContact O-OD1 3.02Å; Q823-N826 VanDerWaalsContact O-OD1 3.06Å; N826-A828 PolarHBondContact O-N 3.41Å; N826-A828 VanDerWaalsContact O-N 3.1Å; N826-S829 PolarHBondContact O-N 2.92Å; N826-L830 HydrophobicContact CB-CD1 4.39Å; N826-L830 HydrophobicContact CB-CG 4.48Å; N826-L830 PolarHBondContact O-N 3.44Å; N826-L830 WeakPolarHBondContact OD1-CD1 3.49Å
827V91.4Very high92.9Very high10 Ų1032.9 Ų32.96%0.06119%0.188CC..Hα-helixtrans-53.3-38.3-173.966.30000113.3T822 Q823 S829 F831 Q869 L873T822-V827 HydrophobicContact CG2-CB 3.72Å; T822-V827 HydrophobicContact CG2-CG2 3.71Å; Q823-V827 PolarHBondContact O-N 2.93Å; V827-S829 VanDerWaalsContact C-N 3.34Å; V827-S829 PolarHBondContact O-N 3.4Å; V827-F831 WeakPolarHBondContact O-CB 3.49Å; V827-F831 PolarHBondContact O-N 2.84Å; V827-Q869 HydrophobicContact CG2-CB 3.86Å; V827-Q869 HydrophobicContact CG2-CG 4.17Å; V827-L873 HydrophobicContact CG2-CD2 3.97Å
828A89.1Confident92.8Very high48 Ų4833 Ų3340%0.39719%0.188SC..Hα-helixtrans-64.9-38.9-177.600000112.6N826 S832 K877N826-A828 PolarHBondContact O-N 3.41Å; N826-A828 VanDerWaalsContact O-N 3.1Å; A828-S832 PolarHBondContact O-OG 3.03Å; A828-K877 VanDerWaalsContact CA-NZ 3.31Å; A828-K877 PolarHBondContact O-NZ 2.86Å
829S90.5Very high92.5Very high74 Ų7436.1 Ų36.152%0.51721%0.21SC..Hα-helixtrans-78.2-45.2179.5-63.30000111.4N826 V827 S832 F833N826-S829 PolarHBondContact O-N 2.92Å; V827-S829 VanDerWaalsContact C-N 3.34Å; V827-S829 PolarHBondContact O-N 3.4Å; S829-S832 PolarHBondContact O-N 2.95Å; S829-F833 PolarHBondContact O-N 3.47Å; S829-F833 VanDerWaalsContact O-N 3.14Å
830L94.3Very high92.3Very high3 Ų337.7 Ų37.72%0.01622%0.221CC..Hα-helixtrans-66-42.6179.9-66.4-173.3000112V759 F763 I818 N826 S832 F833 L834V759-L830 HydrophobicContact CG1-CD1 3.9Å; V759-L830 HydrophobicContact CG1-CD2 3.8Å; F763-L830 HydrophobicContact CE2-CD1 4.31Å; F763-L830 HydrophobicContact CE2-CD2 3.88Å; F763-L830 HydrophobicContact CE2-CG 4.12Å; F763-L830 HydrophobicContact CZ-CD2 3.99Å; F763-L830 HydrophobicContact CZ-CG 4.11Å; I818-L830 HydrophobicContact CG2-CD2 4.01Å; N826-L830 HydrophobicContact CB-CD1 4.39Å; N826-L830 HydrophobicContact CB-CG 4.48Å; N826-L830 PolarHBondContact O-N 3.44Å; N826-L830 WeakPolarHBondContact OD1-CD1 3.49Å; L830-S832 VanDerWaalsContact C-N 3.3Å; L830-S832 PolarHBondContact O-N 3.36Å; L830-F833 WeakPolarHBondContact O-CB 3.47Å; L830-F833 PolarHBondContact O-N 2.79Å; L830-F833 VanDerWaalsContact O-N 3.15Å; L830-L834 WeakPolarHBondContact O-CG 3.45Å; L830-L834 PolarHBondContact O-N 3.02Å
831F95.1Very high92.1Very high4 Ų435.6 Ų35.62%0.01821%0.211CC..Hα-helixtrans-58.5-43.8175.6179.6-97000111.8V827 F833 L834 M835 V865 Q869 L873 K877 L881V827-F831 WeakPolarHBondContact O-CB 3.49Å; V827-F831 PolarHBondContact O-N 2.84Å; F831-F833 VanDerWaalsContact C-N 3.3Å; F831-F833 PolarHBondContact O-N 3.48Å; F831-L834 PolarHBondContact O-N 2.58Å; F831-M835 HydrophobicContact CE1-SD 4.4Å; F831-M835 HydrophobicContact CE2-SD 4.49Å; F831-M835 HydrophobicContact CZ-SD 3.88Å; F831-M835 VanDerWaalsContact O-CB 3.32Å; F831-M835 WeakPolarHBondContact O-CB 3.27Å; F831-M835 PolarHBondContact O-N 3.14Å; F831-V865 HydrophobicContact CD2-CG1 4.39Å; F831-V865 HydrophobicContact CE2-CG1 4.49Å; F831-Q869 VanDerWaalsContact CD2-OE1 3.29Å; F831-L873 HydrophobicContact CB-CD2 3.86Å; F831-L873 HydrophobicContact CD1-CD2 4.13Å; F831-L873 HydrophobicContact CD2-CD1 3.53Å; F831-L873 HydrophobicContact CD2-CD2 3.8Å; F831-L873 HydrophobicContact CD2-CG 4.3Å; F831-L873 HydrophobicContact CE2-CD1 3.4Å; F831-L873 HydrophobicContact CE2-CD2 4.4Å; F831-L873 HydrophobicContact CG-CD1 4.17Å; F831-L873 HydrophobicContact CG-CD2 3.63Å; F831-L873 HydrophobicContact CZ-CD1 3.94Å; F831-K877 HydrophobicContact CD1-CB 4.01Å; F831-K877 HydrophobicContact CD1-CD 3.75Å; F831-K877 HydrophobicContact CD1-CG 3.98Å; F831-K877 HydrophobicContact CE1-CB 3.61Å; F831-K877 HydrophobicContact CE1-CD 4.17Å; F831-K877 HydrophobicContact CE1-CG 3.87Å; F831-K877 HydrophobicContact CZ-CB 4.2Å; F831-K877 VanDerWaalsContact CZ-O 3.3Å; F831-K877 WeakPolarHBondContact CZ-O 3.44Å; F831-L881 HydrophobicContact CE2-CB 4.06Å; F831-L881 HydrophobicContact CE2-CD1 4.39Å; F831-L881 HydrophobicContact CE2-CD2 4.35Å; F831-L881 HydrophobicContact CZ-CB 4.1Å
832S93.6Very high91.9Very high65 Ų6536.9 Ų36.946%0.45522%0.218SC..Hα-helixtrans-61.9-38.4177.8-77.40000112.4A828 S829 L830A828-S832 PolarHBondContact O-OG 3.03Å; S829-S832 PolarHBondContact O-N 2.95Å; L830-S832 VanDerWaalsContact C-N 3.3Å; L830-S832 PolarHBondContact O-N 3.36Å
833F93.9Very high91.6Very high29 Ų2937.6 Ų37.613%0.12723%0.229CC..Hα-helixtrans-66.4-49.1174.2-179.9-95.3000111.8L779 Q783 I818 S829 L830 F831 M835 D836 F837L779-F833 HydrophobicContact CB-CE2 3.87Å; L779-F833 HydrophobicContact CB-CZ 3.83Å; L779-F833 HydrophobicContact CD1-CD1 4.37Å; L779-F833 HydrophobicContact CD1-CD2 4.23Å; L779-F833 HydrophobicContact CD1-CE1 4.31Å; L779-F833 HydrophobicContact CD1-CE2 4.15Å; L779-F833 HydrophobicContact CD1-CG 4.33Å; L779-F833 HydrophobicContact CD1-CZ 4.18Å; L779-F833 HydrophobicContact CD2-CE1 4.01Å; L779-F833 HydrophobicContact CD2-CZ 3.99Å; L779-F833 HydrophobicContact CG-CE2 4.47Å; L779-F833 HydrophobicContact CG-CZ 4.21Å; Q783-F833 HydrophobicContact CB-CE2 4.49Å; I818-F833 HydrophobicContact CD1-CD1 4.41Å; I818-F833 HydrophobicContact CD1-CE1 3.79Å; S829-F833 PolarHBondContact O-N 3.47Å; S829-F833 VanDerWaalsContact O-N 3.14Å; L830-F833 WeakPolarHBondContact O-CB 3.47Å; L830-F833 PolarHBondContact O-N 2.79Å; L830-F833 VanDerWaalsContact O-N 3.15Å; F831-F833 VanDerWaalsContact C-N 3.3Å; F831-F833 PolarHBondContact O-N 3.48Å; F833-M835 PolarHBondContact O-N 3.26Å; F833-D836 PolarHBondContact O-N 2.9Å; F833-F837 HydrophobicContact CD1-CD2 4.36Å; F833-F837 AromaticContact CD1-CE2 4Å; F833-F837 HydrophobicContact CD1-CE2 4Å; F833-F837 HydrophobicContact CD2-CE2 4.41Å; F833-F837 HydrophobicContact CE1-CD2 4.07Å; F833-F837 AromaticContact CE1-CE2 3.39Å; F833-F837 HydrophobicContact CE1-CE2 3.39Å; F833-F837 HydrophobicContact CE1-CZ 4.05Å; F833-F837 AromaticContact CE2-CE2 3.89Å; F833-F837 HydrophobicContact CE2-CE2 3.89Å; F833-F837 HydrophobicContact CE2-CZ 4.47Å; F833-F837 HydrophobicContact CG-CE2 4.47Å; F833-F837 HydrophobicContact CZ-CD2 4.42Å; F833-F837 AromaticContact CZ-CE2 3.35Å; F833-F837 HydrophobicContact CZ-CE2 3.35Å; F833-F837 AromaticContact CZ-CZ 3.76Å; F833-F837 HydrophobicContact CZ-CZ 3.76Å; F833-F837 WeakPolarHBondContact O-CD2 3.44Å
834L96.1Very high91.7Very high2 Ų234.8 Ų34.81%0.0122%0.216CC..Hα-helixtrans-67.2-32.5-176.9-67.6173.1000113.1L815 I818 A819 L830 F831 D836 F837 L838 V865L815-L834 HydrophobicContact CB-CD2 4.26Å; L815-L834 HydrophobicContact CD2-CD2 3.66Å; I818-L834 HydrophobicContact CB-CD2 4.05Å; I818-L834 HydrophobicContact CG2-CD1 4.09Å; I818-L834 HydrophobicContact CG2-CD2 3.78Å; I818-L834 HydrophobicContact CG2-CG 4.04Å; A819-L834 HydrophobicContact CB-CD1 4.14Å; L830-L834 WeakPolarHBondContact O-CG 3.45Å; L830-L834 PolarHBondContact O-N 3.02Å; F831-L834 PolarHBondContact O-N 2.58Å; L834-D836 VanDerWaalsContact C-N 3.26Å; L834-D836 PolarHBondContact O-N 2.74Å; L834-F837 WeakPolarHBondContact O-CB 3.35Å; L834-F837 PolarHBondContact O-N 2.97Å; L834-L838 WeakPolarHBondContact O-CG 3.41Å; L834-L838 PolarHBondContact O-N 2.96Å; L834-V865 HydrophobicContact CB-CG2 4.43Å; L834-V865 HydrophobicContact CD1-CG2 3.78Å
835M94.3Very high91.8Very high22 Ų2228.5 Ų28.511%0.10818%0.184CC..Hα-helixtrans-59.3-35.8-179.7-16766.5-115.900112.9F831 F833 F837 L838 S839 K880 A884F831-M835 HydrophobicContact CE1-SD 4.4Å; F831-M835 HydrophobicContact CE2-SD 4.49Å; F831-M835 HydrophobicContact CZ-SD 3.88Å; F831-M835 VanDerWaalsContact O-CB 3.32Å; F831-M835 WeakPolarHBondContact O-CB 3.27Å; F831-M835 PolarHBondContact O-N 3.14Å; F833-M835 PolarHBondContact O-N 3.26Å; M835-F837 VanDerWaalsContact C-N 3.32Å; M835-F837 PolarHBondContact O-N 3.33Å; M835-L838 HydrophobicContact CE-CB 4.01Å; M835-L838 HydrophobicContact CE-CD1 4.45Å; M835-L838 PolarHBondContact O-N 3.45Å; M835-L838 HydrophobicContact SD-CD1 4.31Å; M835-S839 PolarHBondContact O-N 3.03Å; M835-S839 VanDerWaalsContact O-N 3.16Å; M835-S839 PolarHBondContact O-OG 3.25Å; M835-K880 HydrophobicContact SD-CB 4.2Å; M835-A884 HydrophobicContact CE-CB 3.46Å; M835-A884 VanDerWaalsContact CE-CB 3.46Å
836D89.8Confident91.9Very high96 Ų9629.3 Ų29.351%0.51319%0.186SC..Hα-helixtrans-65.1-38.8176.6-70.5-17.4000111F833 L834 S840F833-D836 PolarHBondContact O-N 2.9Å; L834-D836 VanDerWaalsContact C-N 3.26Å; L834-D836 PolarHBondContact O-N 2.74Å; D836-S840 PolarHBondContact O-N 3.37Å
837F94.1Very high91.8Very high4 Ų431.5 Ų31.52%0.01820%0.199CC..Hα-helixtrans-71.8-43.1175.9-70.7-94.6000112.6Q783 F786 T811 L815 F833 L834 M835 S839 S840 C841Q783-F837 HydrophobicContact CB-CE2 4.47Å; Q783-F837 HydrophobicContact CB-CZ 3.84Å; Q783-F837 HydrophobicContact CG-CE2 4.31Å; Q783-F837 HydrophobicContact CG-CZ 3.93Å; F786-F837 HydrophobicContact CB-CE1 3.98Å; F786-F837 AromaticContact CD1-CD1 3.51Å; F786-F837 HydrophobicContact CD1-CD1 3.51Å; F786-F837 AromaticContact CD1-CE1 3.51Å; F786-F837 HydrophobicContact CD1-CE1 3.51Å; F786-F837 AromaticContact CE1-CD1 3.62Å; F786-F837 HydrophobicContact CE1-CD1 3.62Å; F786-F837 HydrophobicContact CE1-CE1 4.12Å; F786-F837 HydrophobicContact CG-CD1 4.06Å; F786-F837 AromaticContact CG-CE1 3.82Å; F786-F837 HydrophobicContact CG-CE1 3.82Å; F786-F837 HydrophobicContact CZ-CD1 4.24Å; T811-F837 HydrophobicContact CG2-CE1 4.42Å; L815-F837 HydrophobicContact CD1-CB 3.69Å; L815-F837 HydrophobicContact CD1-CD1 3.91Å; L815-F837 HydrophobicContact CD1-CG 3.97Å; L815-F837 HydrophobicContact CD2-CB 3.99Å; L815-F837 HydrophobicContact CD2-CD1 3.83Å; L815-F837 HydrophobicContact CD2-CD2 3.86Å; L815-F837 HydrophobicContact CD2-CE1 4.21Å; L815-F837 HydrophobicContact CD2-CE2 4.27Å; L815-F837 HydrophobicContact CD2-CG 3.63Å; L815-F837 HydrophobicContact CD2-CZ 4.41Å; L815-F837 HydrophobicContact CG-CD1 4.41Å; L815-F837 HydrophobicContact CG-CG 4.46Å; F833-F837 HydrophobicContact CD1-CD2 4.36Å; F833-F837 AromaticContact CD1-CE2 4Å; F833-F837 HydrophobicContact CD1-CE2 4Å; F833-F837 HydrophobicContact CD2-CE2 4.41Å; F833-F837 HydrophobicContact CE1-CD2 4.07Å; F833-F837 AromaticContact CE1-CE2 3.39Å; F833-F837 HydrophobicContact CE1-CE2 3.39Å; F833-F837 HydrophobicContact CE1-CZ 4.05Å; F833-F837 AromaticContact CE2-CE2 3.89Å; F833-F837 HydrophobicContact CE2-CE2 3.89Å; F833-F837 HydrophobicContact CE2-CZ 4.47Å; F833-F837 HydrophobicContact CG-CE2 4.47Å; F833-F837 HydrophobicContact CZ-CD2 4.42Å; F833-F837 AromaticContact CZ-CE2 3.35Å; F833-F837 HydrophobicContact CZ-CE2 3.35Å; F833-F837 AromaticContact CZ-CZ 3.76Å; F833-F837 HydrophobicContact CZ-CZ 3.76Å; F833-F837 WeakPolarHBondContact O-CD2 3.44Å; L834-F837 WeakPolarHBondContact O-CB 3.35Å; L834-F837 PolarHBondContact O-N 2.97Å; M835-F837 VanDerWaalsContact C-N 3.32Å; M835-F837 PolarHBondContact O-N 3.33Å; F837-S839 PolarHBondContact O-N 3.44Å; F837-S840 CarbonylContact O-C 3.28Å; F837-S840 WeakPolarHBondContact O-CA 3.48Å; F837-S840 PolarHBondContact O-N 3.28Å; F837-C841 PolarHBondContact O-N 3Å; F837-C841 PolarHBondContact O-SG 3.11Å
838L94.3Very high91.8Very high2 Ų231 Ų311%0.0120%0.196CC..Hα-helixtrans-54.8-40.8177.4-72165.1000110.7L834 M835 S840 C841 I842 V861 F862 V865 L881L834-L838 WeakPolarHBondContact O-CG 3.41Å; L834-L838 PolarHBondContact O-N 2.96Å; M835-L838 HydrophobicContact CE-CB 4.01Å; M835-L838 HydrophobicContact CE-CD1 4.45Å; M835-L838 PolarHBondContact O-N 3.45Å; M835-L838 HydrophobicContact SD-CD1 4.31Å; L838-S840 PolarHBondContact O-N 3.06Å; L838-C841 PolarHBondContact O-N 2.76Å; L838-I842 PolarHBondContact O-N 3.44Å; L838-V861 HydrophobicContact CD2-CG1 4.23Å; L838-F862 HydrophobicContact CB-CE1 4.25Å; L838-F862 HydrophobicContact CB-CE2 4.37Å; L838-F862 HydrophobicContact CB-CZ 3.89Å; L838-F862 HydrophobicContact CD2-CB 4.49Å; L838-F862 HydrophobicContact CD2-CD1 3.69Å; L838-F862 HydrophobicContact CD2-CD2 3.38Å; L838-F862 HydrophobicContact CD2-CE1 3.66Å; L838-F862 HydrophobicContact CD2-CE2 3.36Å; L838-F862 HydrophobicContact CD2-CG 3.57Å; L838-F862 HydrophobicContact CD2-CZ 3.51Å; L838-F862 HydrophobicContact CG-CE1 4.47Å; L838-F862 HydrophobicContact CG-CE2 4.47Å; L838-F862 HydrophobicContact CG-CZ 4.31Å; L838-V865 HydrophobicContact CD1-CG1 4.12Å; L838-V865 HydrophobicContact CD1-CG2 4.42Å; L838-L881 HydrophobicContact CD1-CD1 4.23Å
839S90.3Very high91.6Very high65 Ų6530 Ų3046%0.45519%0.186SC..Hα-helixtrans-62.3-41.8176.4-54.70000112.3M835 F837M835-S839 PolarHBondContact O-N 3.03Å; M835-S839 VanDerWaalsContact O-N 3.16Å; M835-S839 PolarHBondContact O-OG 3.25Å; F837-S839 PolarHBondContact O-N 3.44Å
840S91.9Very high91.2Very high34 Ų3431.3 Ų31.324%0.23819%0.187CC..Hα-helixtrans-72.6-31.5174.6-630000113.5D836 F837 L838 I842 G843 L844D836-S840 PolarHBondContact O-N 3.37Å; F837-S840 CarbonylContact O-C 3.28Å; F837-S840 WeakPolarHBondContact O-CA 3.48Å; F837-S840 PolarHBondContact O-N 3.28Å; L838-S840 PolarHBondContact O-N 3.06Å; S840-I842 PolarHBondContact O-N 3.2Å; S840-G843 PolarHBondContact O-N 3.32Å; S840-G843 VanDerWaalsContact O-N 3.07Å; S840-L844 PolarHBondContact O-N 3.11Å; S840-L844 VanDerWaalsContact O-N 3.1Å
841C93.4Very high90.9Very high0 Ų031.8 Ų31.80%019%0.191CC..Hα-helixtrans-62.7-31.2178.7-70.80000112.6F837 L838 G843 L844 M845 I858 F862F837-C841 PolarHBondContact O-N 3Å; F837-C841 PolarHBondContact O-SG 3.11Å; L838-C841 PolarHBondContact O-N 2.76Å; C841-G843 VanDerWaalsContact C-N 3.31Å; C841-G843 PolarHBondContact O-N 3.2Å; C841-L844 WeakPolarHBondContact O-CB 3.46Å; C841-L844 PolarHBondContact O-N 2.94Å; C841-M845 PolarHBondContact O-N 3.17Å; C841-I858 HydrophobicContact CB-CG2 3.95Å; C841-F862 HydrophobicContact CB-CE2 4.01Å
842I90.9Very high90.5Very high27 Ų2733.1 Ų33.114%0.13820%0.199CC..Hα-helixtrans-58.6-44.4172.5-64.5165.6000110.7L838 S840 M845 F862 T887 L888 V891L838-I842 PolarHBondContact O-N 3.44Å; S840-I842 PolarHBondContact O-N 3.2Å; I842-M845 PolarHBondContact O-N 3.44Å; I842-F862 HydrophobicContact CG1-CZ 4.24Å; I842-T887 HydrophobicContact CD1-CG2 4Å; I842-T887 HydrophobicContact CG2-CG2 3.84Å; I842-L888 HydrophobicContact CG1-CB 4.47Å; I842-L888 HydrophobicContact CG1-CD1 4.34Å; I842-V891 HydrophobicContact CG2-CG2 3.85Å
843G89.1Confident90.2Very high37 Ų3737.7 Ų37.738%0.38121%0.213SC..Hα-helixtrans-67.4-37175.500000112.8S840 C841 M845 E846 V847S840-G843 PolarHBondContact O-N 3.32Å; S840-G843 VanDerWaalsContact O-N 3.07Å; C841-G843 VanDerWaalsContact C-N 3.31Å; C841-G843 PolarHBondContact O-N 3.2Å; G843-M845 VanDerWaalsContact C-N 3.31Å; G843-M845 PolarHBondContact O-N 3.29Å; G843-E846 PolarHBondContact O-N 3.05Å; G843-V847 PolarHBondContact O-N 3.31Å
844L91.1Very high90.1Very high5 Ų536.4 Ų36.43%0.02621%0.208CC..Hα-helixtrans-63.1-36.6175.5-72.3167.4000112.4F786 I790 F795 I808 S840 C841 E846 V847 Y848 I858F786-L844 HydrophobicContact CE2-CD1 3.54Å; F786-L844 HydrophobicContact CZ-CD1 3.57Å; I790-L844 HydrophobicContact CG2-CD2 4.04Å; F795-L844 HydrophobicContact CE1-CD2 3.75Å; F795-L844 HydrophobicContact CZ-CD2 3.56Å; I808-L844 HydrophobicContact CD1-CD1 4.34Å; I808-L844 HydrophobicContact CD1-CD2 4.04Å; S840-L844 PolarHBondContact O-N 3.11Å; S840-L844 VanDerWaalsContact O-N 3.1Å; C841-L844 WeakPolarHBondContact O-CB 3.46Å; C841-L844 PolarHBondContact O-N 2.94Å; L844-E846 VanDerWaalsContact C-N 3.25Å; L844-E846 PolarHBondContact O-N 2.98Å; L844-V847 PolarHBondContact O-N 3.46Å; L844-V847 VanDerWaalsContact O-N 3.12Å; L844-Y848 HydrophobicContact CB-CD2 4.38Å; L844-Y848 HydrophobicContact CD2-CD2 4.17Å; L844-Y848 HydrophobicContact CD2-CE2 3.81Å; L844-Y848 WeakPolarHBondContact O-CD2 2.96Å; L844-Y848 PolarHBondContact O-N 3.08Å; L844-I858 HydrophobicContact CB-CD1 3.96Å
845M89.4Confident89.9Confident1 Ų136.5 Ų36.51%0.00521%0.208CC..Hα-helixtrans-63.5-30.2177.3-170.7174.5-83.800112.6C841 I842 G843 S849 I855 I858 I859 L888 V891 Y892C841-M845 PolarHBondContact O-N 3.17Å; I842-M845 PolarHBondContact O-N 3.44Å; G843-M845 VanDerWaalsContact C-N 3.31Å; G843-M845 PolarHBondContact O-N 3.29Å; M845-S849 PolarHBondContact O-N 3.38Å; M845-I855 HydrophobicContact CE-CG2 4.2Å; M845-I858 HydrophobicContact CB-CD1 4.35Å; M845-I858 HydrophobicContact CE-CB 4.18Å; M845-I858 HydrophobicContact CE-CG2 3.73Å; M845-I859 HydrophobicContact CE-CD1 4.36Å; M845-I859 HydrophobicContact CE-CG1 3.7Å; M845-L888 HydrophobicContact CE-CD1 3.39Å; M845-L888 HydrophobicContact CE-CD2 4.37Å; M845-L888 HydrophobicContact CE-CG 3.87Å; M845-L888 HydrophobicContact SD-CD1 3.69Å; M845-L888 HydrophobicContact SD-CG 4.1Å; M845-V891 HydrophobicContact CB-CG1 4.09Å; M845-V891 HydrophobicContact CG-CG1 4.02Å; M845-V891 HydrophobicContact SD-CG1 4.26Å; M845-Y892 HydrophobicContact SD-CD2 4.36Å
846E86.7Confident89.9Confident88 Ų8837.1 Ų37.141%0.41121%0.212SC..Hα-helixtrans-69.6-43.4171.2-68.8-161.7143.600111.8G843 L844 S849 V891 K894G843-E846 PolarHBondContact O-N 3.05Å; L844-E846 VanDerWaalsContact C-N 3.25Å; L844-E846 PolarHBondContact O-N 2.98Å; E846-S849 WeakPolarHBondContact O-CB 3.47Å; E846-S849 PolarHBondContact O-OG 3.36Å; E846-V891 HydrophobicContact CG-CG1 3.51Å; E846-V891 HydrophobicContact CG-CG2 4.4Å; E846-K894 IonicContact OE1-NZ 2.9Å; E846-K894 PolarHBondContact OE1-NZ 2.97Å
847V89.6Confident90.1Very high46 Ų4633 Ų3328%0.27919%0.191SC..Hα-helixtrans-67.2-43.7-179.3177.50000111.8F795 S799 G843 L844 S849F795-V847 HydrophobicContact CE1-CG1 4.11Å; F795-V847 HydrophobicContact CE1-CG2 4.3Å; S799-V847 WeakPolarHBondContact OG-CG1 3.33Å; G843-V847 PolarHBondContact O-N 3.31Å; L844-V847 PolarHBondContact O-N 3.46Å; L844-V847 VanDerWaalsContact O-N 3.12Å; V847-S849 VanDerWaalsContact C-N 3.33Å; V847-S849 PolarHBondContact O-N 3.48Å
848Y89.9Confident90.3Very high0 Ų032.9 Ų32.90%019%0.19CC..THydrogen-bonded Turntrans-92.819.4-177.5-71.5-76.3000113.9F795 S799 K805 I808 L844 N850 T851 T854 I855F795-Y848 HydrophobicContact CZ-CE2 4.19Å; S799-Y848 WeakPolarHBondContact O-CE1 3.4Å; S799-Y848 PolarHBondContact O-OH 2.82Å; K805-Y848 HydrophobicContact CG-CE1 3.97Å; I808-Y848 HydrophobicContact CG1-CE2 4.28Å; I808-Y848 HydrophobicContact CG2-CE2 4.33Å; L844-Y848 HydrophobicContact CB-CD2 4.38Å; L844-Y848 HydrophobicContact CD2-CD2 4.17Å; L844-Y848 HydrophobicContact CD2-CE2 3.81Å; L844-Y848 WeakPolarHBondContact O-CD2 2.96Å; L844-Y848 PolarHBondContact O-N 3.08Å; Y848-N850 PolarHBondContact O-N 3.37Å; Y848-T851 PolarHBondContact O-N 2.79Å; Y848-T854 HydrophobicContact CD1-CG2 4.21Å; Y848-T854 HydrophobicContact CD2-CG2 4.04Å; Y848-T854 HydrophobicContact CG-CG2 3.83Å; Y848-I855 WeakPolarHBondContact O-CD1 3.19Å
849S86.2Confident90.3Very high26 Ų2632.9 Ų32.918%0.18219%0.19CC..THydrogen-bonded Turntrans-51-19.5-179.8550000115M845 E846 V847 R899M845-S849 PolarHBondContact O-N 3.38Å; E846-S849 WeakPolarHBondContact O-CB 3.47Å; E846-S849 PolarHBondContact O-OG 3.36Å; V847-S849 VanDerWaalsContact C-N 3.33Å; V847-S849 PolarHBondContact O-N 3.48Å; S849-R899 PolarHBondContact O-NH1 2.96Å
850N82.4Confident90.6Very high101 Ų10131.8 Ų31.854%0.5418%0.177SC..THydrogen-bonded Turntrans-104.66.4177.7-60.6-45.5000115Y848 R899Y848-N850 PolarHBondContact O-N 3.37Å; N850-R899 PolarHBondContact OD1-NH1 2.97Å; N850-R899 VanDerWaalsContact OD1-NH1 3.1Å; N850-R899 PolarHBondContact OD1-NH2 3Å
851T87.3Confident90.9Very high14 Ų1430.2 Ų30.29%0.08617%0.167CC..  trans-117.995.7-178.7-53.40000109.1Y848 E853 T854 I855Y848-T851 PolarHBondContact O-N 2.79Å; T851-E853 PolarHBondContact O-N 3.5Å; T851-T854 VanDerWaalsContact CG2-OG1 3.29Å; T851-T854 WeakPolarHBondContact CG2-OG1 3.43Å; T851-T854 PolarHBondContact O-N 3.38Å; T851-I855 WeakPolarHBondContact O-CG1 3.5Å; T851-I855 PolarHBondContact O-N 2.94Å
852P86.5Confident91.1Very high31 Ų3130.2 Ų30.220%0.20117%0.167CC..Hα-helixtrans-57.8-48.9-171.7-23.233.8000112.9T854 I855 N856 D909P852-T854 VanDerWaalsContact C-N 3.29Å; P852-T854 PolarHBondContact O-N 3.29Å; P852-I855 WeakPolarHBondContact O-CB 3.39Å; P852-I855 PolarHBondContact O-N 3.07Å; P852-N856 WeakPolarHBondContact O-CB 3.49Å; P852-N856 PolarHBondContact O-N 3.21Å; P852-D909 HydrophobicContact CB-CB 4.1Å; P852-D909 WeakPolarHBondContact CG-OD2 3.36Å
853E88Confident91.4Very high161 Ų16129.1 Ų29.175%0.75216%0.161SC*.Hα-helixtrans-54.7-41.6-179.9-62.3169.3-171.200112.8T851 L857T851-E853 PolarHBondContact O-N 3.5Å; E853-L857 WeakPolarHBondContact O-CB 3.47Å; E853-L857 PolarHBondContact O-N 2.83Å
854T91.7Very high91.7Very high3 Ų328.7 Ų28.72%0.01815%0.149CC..Hα-helixtrans-72.7-35.8178.5-49.80000112.2I808 L812 Y848 T851 P852 I858I808-T854 HydrophobicContact CG2-CG2 4.18Å; L812-T854 HydrophobicContact CD1-CG2 4.26Å; Y848-T854 HydrophobicContact CD1-CG2 4.21Å; Y848-T854 HydrophobicContact CD2-CG2 4.04Å; Y848-T854 HydrophobicContact CG-CG2 3.83Å; T851-T854 VanDerWaalsContact CG2-OG1 3.29Å; T851-T854 WeakPolarHBondContact CG2-OG1 3.43Å; T851-T854 PolarHBondContact O-N 3.38Å; P852-T854 VanDerWaalsContact C-N 3.29Å; P852-T854 PolarHBondContact O-N 3.29Å; T854-I858 HydrophobicContact CG2-CD1 4.25Å; T854-I858 WeakPolarHBondContact O-CD1 3.44Å; T854-I858 WeakPolarHBondContact O-CG1 3.25Å; T854-I858 PolarHBondContact O-N 3.19Å
855I92.1Very high92Very high3 Ų328.5 Ų28.52%0.01515%0.148CC..Hα-helixtrans-64.1-47.6174.8-67.6171.1000109.6M845 Y848 T851 P852 L857 I858 I859 Y892M845-I855 HydrophobicContact CE-CG2 4.2Å; Y848-I855 WeakPolarHBondContact O-CD1 3.19Å; T851-I855 WeakPolarHBondContact O-CG1 3.5Å; T851-I855 PolarHBondContact O-N 2.94Å; P852-I855 WeakPolarHBondContact O-CB 3.39Å; P852-I855 PolarHBondContact O-N 3.07Å; I855-L857 PolarHBondContact O-N 3.44Å; I855-I858 PolarHBondContact O-N 2.79Å; I855-I859 HydrophobicContact CG2-CD1 4.01Å; I855-I859 WeakPolarHBondContact O-CG1 3.46Å; I855-I859 PolarHBondContact O-N 3.35Å; I855-Y892 HydrophobicContact CG2-CD2 3.9Å; I855-Y892 HydrophobicContact CG2-CE2 3.78Å
856N93.7Very high92.2Very high36 Ų3628.4 Ų28.419%0.19315%0.148CC..Hα-helixtrans-57.1-50.5179.7-166.9-98.4000111.1P852 I858 I859 E860 D913 L916P852-N856 WeakPolarHBondContact O-CB 3.49Å; P852-N856 PolarHBondContact O-N 3.21Å; N856-I858 VanDerWaalsContact C-N 3.34Å; N856-I858 PolarHBondContact O-N 3.01Å; N856-I859 WeakPolarHBondContact O-CA 3.48Å; N856-I859 WeakPolarHBondContact O-CB 3.5Å; N856-I859 PolarHBondContact O-N 3.23Å; N856-E860 PolarHBondContact O-N 3.32Å; N856-D913 WeakPolarHBondContact CB-OD1 3.48Å; N856-D913 PolarHBondContact ND2-N 3.02Å; N856-D913 PolarHBondContact ND2-OD1 3.21Å; N856-L916 WeakPolarHBondContact ND2-CD1 3.1Å; N856-L916 WeakPolarHBondContact O-CD1 3.41Å; N856-L916 WeakPolarHBondContact OD1-CD1 3.45Å
857L94.8Very high92.6Very high10 Ų1028 Ų285%0.05215%0.146CC..Hα-helixtrans-64.5-33.3177.7-175.660000113.3V809 L812 E813 E853 I855 I859 E860 V861V809-L857 HydrophobicContact CB-CD2 4.29Å; V809-L857 HydrophobicContact CG1-CD2 3.82Å; V809-L857 HydrophobicContact CG2-CD2 4.43Å; L812-L857 HydrophobicContact CB-CD1 4.46Å; L812-L857 HydrophobicContact CB-CD2 3.63Å; L812-L857 HydrophobicContact CB-CG 3.67Å; L812-L857 HydrophobicContact CD1-CB 4.33Å; L812-L857 HydrophobicContact CD1-CD2 3.98Å; L812-L857 HydrophobicContact CD1-CG 4Å; L812-L857 HydrophobicContact CG-CD2 4.45Å; L812-L857 HydrophobicContact CG-CG 4.49Å; E813-L857 HydrophobicContact CG-CD2 4.17Å; E853-L857 WeakPolarHBondContact O-CB 3.47Å; E853-L857 PolarHBondContact O-N 2.83Å; I855-L857 PolarHBondContact O-N 3.44Å; L857-I859 VanDerWaalsContact C-N 3.35Å; L857-E860 HydrophobicContact CD1-CB 4.47Å; L857-E860 VanDerWaalsContact CD1-OE2 3.29Å; L857-E860 WeakPolarHBondContact CD1-OE2 3.35Å; L857-E860 PolarHBondContact O-N 2.98Å; L857-V861 WeakPolarHBondContact O-CG2 3.48Å; L857-V861 PolarHBondContact O-N 2.98Å
858I96.4Very high92.8Very high0 Ų029.3 Ų29.30%015%0.147CC..Hα-helixtrans-62.7-44.2171.4-70.5164.5000110.2L812 C841 L844 M845 T854 I855 N856 E860 V861 F862 L888L812-I858 HydrophobicContact CD1-CG1 3.68Å; L812-I858 HydrophobicContact CD2-CG1 4.07Å; C841-I858 HydrophobicContact CB-CG2 3.95Å; L844-I858 HydrophobicContact CB-CD1 3.96Å; M845-I858 HydrophobicContact CB-CD1 4.35Å; M845-I858 HydrophobicContact CE-CB 4.18Å; M845-I858 HydrophobicContact CE-CG2 3.73Å; T854-I858 HydrophobicContact CG2-CD1 4.25Å; T854-I858 WeakPolarHBondContact O-CD1 3.44Å; T854-I858 WeakPolarHBondContact O-CG1 3.25Å; T854-I858 PolarHBondContact O-N 3.19Å; I855-I858 PolarHBondContact O-N 2.79Å; N856-I858 VanDerWaalsContact C-N 3.34Å; N856-I858 PolarHBondContact O-N 3.01Å; I858-E860 VanDerWaalsContact C-N 3.32Å; I858-V861 PolarHBondContact O-N 2.77Å; I858-F862 HydrophobicContact CG2-CD2 4.47Å; I858-F862 HydrophobicContact CG2-CE2 4.29Å; I858-F862 VanDerWaalsContact O-CD2 3.32Å; I858-F862 WeakPolarHBondContact O-CD2 3.46Å; I858-F862 PolarHBondContact O-N 3.38Å; I858-L888 HydrophobicContact CG2-CD1 3.94Å
859I95.8Very high93Very high2 Ų229.3 Ų29.31%0.0115%0.147CC..Hα-helixtrans-64.2-41.7177.8-59.8164.4000109.7M845 I855 N856 L857 V861 F862 V863 Y892 D913 L916 I917M845-I859 HydrophobicContact CE-CD1 4.36Å; M845-I859 HydrophobicContact CE-CG1 3.7Å; I855-I859 HydrophobicContact CG2-CD1 4.01Å; I855-I859 WeakPolarHBondContact O-CG1 3.46Å; I855-I859 PolarHBondContact O-N 3.35Å; N856-I859 WeakPolarHBondContact O-CA 3.48Å; N856-I859 WeakPolarHBondContact O-CB 3.5Å; N856-I859 PolarHBondContact O-N 3.23Å; L857-I859 VanDerWaalsContact C-N 3.35Å; I859-V861 VanDerWaalsContact C-N 3.34Å; I859-V861 PolarHBondContact O-N 3.01Å; I859-F862 WeakPolarHBondContact O-CA 3.25Å; I859-F862 WeakPolarHBondContact O-CB 3.32Å; I859-F862 PolarHBondContact O-N 3.44Å; I859-V863 HydrophobicContact CG2-CG2 4.36Å; I859-V863 WeakPolarHBondContact O-CG2 3.48Å; I859-V863 PolarHBondContact O-N 3.26Å; I859-Y892 HydrophobicContact CD1-CD2 4.05Å; I859-Y892 HydrophobicContact CD1-CE2 4.01Å; I859-D913 HydrophobicContact CD1-CB 4.24Å; I859-L916 HydrophobicContact CB-CB 4.38Å; I859-L916 HydrophobicContact CB-CD1 4.38Å; I859-L916 HydrophobicContact CG2-CB 3.62Å; I859-L916 HydrophobicContact CG2-CD1 4.46Å; I859-I917 HydrophobicContact CD1-CD1 4.28Å; I859-I917 HydrophobicContact CD1-CG1 4.19Å; I859-I917 HydrophobicContact CG2-CG1 4.09Å
860E96.6Very high93.2Very high42 Ų4228 Ų2820%0.19614%0.139CC..Hα-helixtrans-57.5-42.7177.3-164-174.3168.300112.3R752 N856 L857 I858 F862 V863 E864 L916R752-E860 IonicContact CZ-OE1 3.82Å; R752-E860 IonicContact NH1-OE1 3.77Å; R752-E860 PolarHBondContact NH1-OE1 3.33Å; R752-E860 VanDerWaalsContact NH2-CD 3.33Å; R752-E860 IonicContact NH2-OE1 2.99Å; R752-E860 PolarHBondContact NH2-OE1 3.19Å; R752-E860 IonicContact NH2-OE2 2.67Å; R752-E860 PolarHBondContact NH2-OE2 2.96Å; N856-E860 PolarHBondContact O-N 3.32Å; L857-E860 HydrophobicContact CD1-CB 4.47Å; L857-E860 VanDerWaalsContact CD1-OE2 3.29Å; L857-E860 WeakPolarHBondContact CD1-OE2 3.35Å; L857-E860 PolarHBondContact O-N 2.98Å; I858-E860 VanDerWaalsContact C-N 3.32Å; E860-F862 VanDerWaalsContact C-N 3.27Å; E860-F862 PolarHBondContact O-N 3.44Å; E860-V863 WeakPolarHBondContact O-CA 3.42Å; E860-V863 WeakPolarHBondContact O-CB 3.48Å; E860-V863 PolarHBondContact O-N 3.18Å; E860-E864 PolarHBondContact O-N 3.39Å; E860-L916 HydrophobicContact CB-CD1 4.03Å
861V97.1Very high93.5Very high2 Ų224 Ų241%0.01212%0.118CC..Hα-helixtrans-57.6-41.1174.1172.80000111.6L812 L815 C816 L838 L857 I858 I859 V865L812-V861 HydrophobicContact CB-CG2 4.02Å; L812-V861 HydrophobicContact CD2-CG2 4.18Å; L812-V861 WeakPolarHBondContact O-CG2 3.4Å; L815-V861 HydrophobicContact CB-CG1 3.9Å; L815-V861 HydrophobicContact CB-CG2 4.19Å; L815-V861 HydrophobicContact CD1-CG1 4.28Å; C816-V861 VanDerWaalsContact SG-CG2 3.51Å; L838-V861 HydrophobicContact CD2-CG1 4.23Å; L857-V861 WeakPolarHBondContact O-CG2 3.48Å; L857-V861 PolarHBondContact O-N 2.98Å; I858-V861 PolarHBondContact O-N 2.77Å; I859-V861 VanDerWaalsContact C-N 3.34Å; I859-V861 PolarHBondContact O-N 3.01Å; V861-V865 VanDerWaalsContact O-CG2 3.31Å; V861-V865 WeakPolarHBondContact O-CG2 3.32Å; V861-V865 PolarHBondContact O-N 3.39Å; V861-V865 VanDerWaalsContact O-N 3.09Å
862F97.6Very high93.5Very high0 Ų026.8 Ų26.80%013%0.128CC..Hα-helixtrans-68.6-38.3176.2-82.3-108.7000111.8L838 C841 I842 I858 I859 E860 A866 A884 L888 L920L838-F862 HydrophobicContact CB-CE1 4.25Å; L838-F862 HydrophobicContact CB-CE2 4.37Å; L838-F862 HydrophobicContact CB-CZ 3.89Å; L838-F862 HydrophobicContact CD2-CB 4.49Å; L838-F862 HydrophobicContact CD2-CD1 3.69Å; L838-F862 HydrophobicContact CD2-CD2 3.38Å; L838-F862 HydrophobicContact CD2-CE1 3.66Å; L838-F862 HydrophobicContact CD2-CE2 3.36Å; L838-F862 HydrophobicContact CD2-CG 3.57Å; L838-F862 HydrophobicContact CD2-CZ 3.51Å; L838-F862 HydrophobicContact CG-CE1 4.47Å; L838-F862 HydrophobicContact CG-CE2 4.47Å; L838-F862 HydrophobicContact CG-CZ 4.31Å; C841-F862 HydrophobicContact CB-CE2 4.01Å; I842-F862 HydrophobicContact CG1-CZ 4.24Å; I858-F862 HydrophobicContact CG2-CD2 4.47Å; I858-F862 HydrophobicContact CG2-CE2 4.29Å; I858-F862 VanDerWaalsContact O-CD2 3.32Å; I858-F862 WeakPolarHBondContact O-CD2 3.46Å; I858-F862 PolarHBondContact O-N 3.38Å; I859-F862 WeakPolarHBondContact O-CA 3.25Å; I859-F862 WeakPolarHBondContact O-CB 3.32Å; I859-F862 PolarHBondContact O-N 3.44Å; E860-F862 VanDerWaalsContact C-N 3.27Å; E860-F862 PolarHBondContact O-N 3.44Å; F862-A866 VanDerWaalsContact O-CB 3.3Å; F862-A866 WeakPolarHBondContact O-CB 3.39Å; F862-A866 PolarHBondContact O-N 3.05Å; F862-A884 HydrophobicContact CE1-CB 4.07Å; F862-L888 HydrophobicContact CB-CD2 4.09Å; F862-L888 HydrophobicContact CD1-CD2 3.81Å; F862-L888 HydrophobicContact CD2-CD1 4.26Å; F862-L888 HydrophobicContact CD2-CD2 3.65Å; F862-L888 HydrophobicContact CE1-CB 4.12Å; F862-L888 HydrophobicContact CE1-CD2 4.06Å; F862-L888 HydrophobicContact CE1-CG 4.49Å; F862-L888 HydrophobicContact CE2-CD1 3.72Å; F862-L888 HydrophobicContact CE2-CD2 3.9Å; F862-L888 HydrophobicContact CE2-CG 4.31Å; F862-L888 HydrophobicContact CG-CD2 3.59Å; F862-L888 HydrophobicContact CZ-CB 4.18Å; F862-L888 HydrophobicContact CZ-CD1 3.9Å; F862-L888 HydrophobicContact CZ-CD2 4.1Å; F862-L888 HydrophobicContact CZ-CG 4.29Å; F862-L920 HydrophobicContact CB-CD1 4.26Å; F862-L920 HydrophobicContact CB-CD2 4.21Å
863V96.9Very high93.6Very high3 Ų325.4 Ų25.42%0.01812%0.118CC..Hα-helixtrans-59.6-51.6174.7172.30000110I859 E860 V865 A866 H867 L916 E919 L920I859-V863 HydrophobicContact CG2-CG2 4.36Å; I859-V863 WeakPolarHBondContact O-CG2 3.48Å; I859-V863 PolarHBondContact O-N 3.26Å; E860-V863 WeakPolarHBondContact O-CA 3.42Å; E860-V863 WeakPolarHBondContact O-CB 3.48Å; E860-V863 PolarHBondContact O-N 3.18Å; V863-V865 PolarHBondContact O-N 3.44Å; V863-A866 PolarHBondContact O-N 3.17Å; V863-H867 WeakPolarHBondContact O-CB 3.25Å; V863-H867 PolarHBondContact O-N 2.93Å; V863-L916 HydrophobicContact CG2-CB 4.19Å; V863-L916 HydrophobicContact CG2-CD2 4.36Å; V863-L916 VanDerWaalsContact CG2-O 3.25Å; V863-L916 WeakPolarHBondContact CG2-O 3.43Å; V863-E919 HydrophobicContact CG1-CB 4.48Å; V863-E919 HydrophobicContact CG1-CG 3.86Å; V863-L920 HydrophobicContact CG2-CB 3.8Å
864E96.3Very high93.6Very high29 Ų2919.2 Ų19.214%0.13610%0.098CC..Hα-helixtrans-60.6-44.5-179.7-76.3-59.7155.300112.2C816 A819 E860 A866 H867 K868C816-E864 HydrophobicContact CB-CG 4.37Å; A819-E864 HydrophobicContact CB-CB 3.91Å; E860-E864 PolarHBondContact O-N 3.39Å; E864-A866 PolarHBondContact O-N 2.99Å; E864-H867 PolarHBondContact O-N 3.22Å; E864-K868 WeakPolarHBondContact O-CB 3.11Å; E864-K868 VanDerWaalsContact O-CG 3.29Å; E864-K868 WeakPolarHBondContact O-CG 3.39Å; E864-K868 PolarHBondContact O-N 2.75Å; E864-K868 WeakPolarHBondContact OE2-CE 3.29Å
865V96.7Very high93.2Very high0 Ų025.9 Ų25.90%013%0.129CC..Hα-helixtrans-62.7-45.8176.3173.60000111.3A819 F831 L834 L838 V861 V863 Q869 L881A819-V865 HydrophobicContact CB-CG2 3.96Å; F831-V865 HydrophobicContact CD2-CG1 4.39Å; F831-V865 HydrophobicContact CE2-CG1 4.49Å; L834-V865 HydrophobicContact CB-CG2 4.43Å; L834-V865 HydrophobicContact CD1-CG2 3.78Å; L838-V865 HydrophobicContact CD1-CG1 4.12Å; L838-V865 HydrophobicContact CD1-CG2 4.42Å; V861-V865 VanDerWaalsContact O-CG2 3.31Å; V861-V865 WeakPolarHBondContact O-CG2 3.32Å; V861-V865 PolarHBondContact O-N 3.39Å; V861-V865 VanDerWaalsContact O-N 3.09Å; V863-V865 PolarHBondContact O-N 3.44Å; V865-Q869 WeakPolarHBondContact O-CB 3.44Å; V865-Q869 WeakPolarHBondContact O-CG 3.45Å; V865-Q869 PolarHBondContact O-N 2.83Å; V865-L881 HydrophobicContact CG1-CD1 4.11Å; V865-L881 HydrophobicContact CG1-CD2 4.5Å
866A95.1Very high93Very high0 Ų031 Ų310%016%0.16CC..Hα-helixtrans-62.8-50.6178.200000110.9F862 V863 E864 K868 I870 L881 L920 N923 L924F862-A866 VanDerWaalsContact O-CB 3.3Å; F862-A866 WeakPolarHBondContact O-CB 3.39Å; F862-A866 PolarHBondContact O-N 3.05Å; V863-A866 PolarHBondContact O-N 3.17Å; E864-A866 PolarHBondContact O-N 2.99Å; A866-K868 PolarHBondContact O-N 2.77Å; A866-I870 WeakPolarHBondContact O-CB 3.24Å; A866-I870 WeakPolarHBondContact O-CG2 3.35Å; A866-I870 PolarHBondContact O-N 3.46Å; A866-I870 VanDerWaalsContact O-N 3.13Å; A866-L881 HydrophobicContact CB-CD2 4.49Å; A866-L920 HydrophobicContact CB-CD1 3.62Å; A866-N923 HydrophobicContact CB-CB 4.09Å; A866-L924 HydrophobicContact CB-CD2 4.05Å
867H93.8Very high92.8Very high79 Ų7932 Ų3237%0.36616%0.163SC..Hα-helixtrans-60.2-47.9-177.8-17958000112.7V863 E864 N923V863-H867 WeakPolarHBondContact O-CB 3.25Å; V863-H867 PolarHBondContact O-N 2.93Å; E864-H867 PolarHBondContact O-N 3.22Å; H867-N923 PolarHBondContact ND1-OD1 3.05Å
868K93.5Very high92.6Very high73 Ų7331.6 Ų31.632%0.31716%0.161SC..Hα-helixtrans-84-27.8-173.9-57.7-59.1-177.6-159.90114A819 E864 A866A819-K868 WeakPolarHBondContact O-CB 3.47Å; E864-K868 WeakPolarHBondContact O-CB 3.11Å; E864-K868 VanDerWaalsContact O-CG 3.29Å; E864-K868 WeakPolarHBondContact O-CG 3.39Å; E864-K868 PolarHBondContact O-N 2.75Å; E864-K868 WeakPolarHBondContact OE2-CE 3.29Å; A866-K868 PolarHBondContact O-N 2.77Å
869Q94.2Very high92.2Very high0 Ų034 Ų340%017%0.173CC..Hα-helixtrans-110.7-33.9-168.8-50.8-164.5-23.100114.1T822 V827 F831 V865 C871 Y872 L873T822-Q869 HydrophobicContact CG2-CG 3.87Å; T822-Q869 WeakPolarHBondContact OG1-CG 3.35Å; T822-Q869 PolarHBondContact OG1-NE2 2.91Å; V827-Q869 HydrophobicContact CG2-CB 3.86Å; V827-Q869 HydrophobicContact CG2-CG 4.17Å; F831-Q869 VanDerWaalsContact CD2-OE1 3.29Å; V865-Q869 WeakPolarHBondContact O-CB 3.44Å; V865-Q869 WeakPolarHBondContact O-CG 3.45Å; V865-Q869 PolarHBondContact O-N 2.83Å; Q869-C871 VanDerWaalsContact C-N 3.29Å; Q869-C871 PolarHBondContact O-N 3.36Å; Q869-C871 VanDerWaalsContact O-N 3.11Å; Q869-Y872 PolarHBondContact O-N 2.96Å; Q869-L873 HydrophobicContact CB-CD1 4.47Å; Q869-L873 HydrophobicContact CB-CG 4.41Å; Q869-L873 WeakPolarHBondContact O-CG 3.4Å; Q869-L873 PolarHBondContact O-N 2.9Å
870I91.6Very high92Very high0 Ų039.8 Ų39.80%020%0.198CC..G310 helixtrans-57.2-38.4-162.1-163.6166.7000114.4A866 Y872 L873 L881 Y882 L924 S926 K927A866-I870 WeakPolarHBondContact O-CB 3.24Å; A866-I870 WeakPolarHBondContact O-CG2 3.35Å; A866-I870 PolarHBondContact O-N 3.46Å; A866-I870 VanDerWaalsContact O-N 3.13Å; I870-Y872 PolarHBondContact O-N 3.24Å; I870-L873 PolarHBondContact O-N 3.31Å; I870-L881 HydrophobicContact CB-CD2 4.45Å; I870-L881 HydrophobicContact CD1-CD2 4.31Å; I870-L881 HydrophobicContact CG1-CD2 4.35Å; I870-Y882 HydrophobicContact CD1-CE1 3.6Å; I870-L924 HydrophobicContact CD1-CB 4.47Å; I870-L924 HydrophobicContact CD1-CD2 3.59Å; I870-S926 WeakPolarHBondContact CG2-OG 3.47Å; I870-K927 HydrophobicContact CD1-CB 4.38Å; I870-K927 HydrophobicContact CG1-CB 4.15Å; I870-K927 HydrophobicContact CG1-CD 4.13Å
871C87.9Confident91.8Very high15 Ų1537.8 Ų37.810%0.10119%0.188CC..G310 helixtrans-67.6-20-178.856.90000113.3Q869 I930 F932 S933Q869-C871 VanDerWaalsContact C-N 3.29Å; Q869-C871 PolarHBondContact O-N 3.36Å; Q869-C871 VanDerWaalsContact O-N 3.11Å; C871-I930 HydrophobicContact CB-CG2 4.12Å; C871-I930 WeakPolarHBondContact CB-O 3.3Å; C871-F932 HydrophobicContact CB-CD2 4.13Å; C871-F932 CarbonylContact O-C 3.55Å; C871-F932 WeakPolarHBondContact O-CA 3.39Å; C871-F932 PolarHBondContact O-N 3.38Å; C871-S933 PolarHBondContact O-N 3.47Å
872Y87.4Confident91.6Very high74 Ų7438.2 Ų38.229%0.2919%0.19SC..G310 helixtrans-100.9-10.1177-52.1-70.8000113.3I824 Q869 I870 F932I824-Y872 HydrophobicContact CD1-CE1 4.43Å; I824-Y872 HydrophobicContact CG1-CD1 4.23Å; I824-Y872 HydrophobicContact CG1-CE1 3.76Å; Q869-Y872 PolarHBondContact O-N 2.96Å; I870-Y872 PolarHBondContact O-N 3.24Å; Y872-F932 HydrophobicContact CD1-CB 3.75Å; Y872-F932 HydrophobicContact CD1-CD2 4.24Å; Y872-F932 HydrophobicContact CD1-CG 4.42Å; Y872-F932 HydrophobicContact CE1-CB 3.97Å; Y872-F932 AromaticContact CE1-CD2 3.74Å; Y872-F932 HydrophobicContact CE1-CD2 3.74Å; Y872-F932 HydrophobicContact CE1-CG 4.16Å
873L89.3Confident91.3Very high2 Ų242.1 Ų42.11%0.0121%0.208CC..  trans-76.7137.8-178.8-63.4-180000110.5V827 F831 Q869 I870 K877 L881 K927 S933V827-L873 HydrophobicContact CG2-CD2 3.97Å; F831-L873 HydrophobicContact CB-CD2 3.86Å; F831-L873 HydrophobicContact CD1-CD2 4.13Å; F831-L873 HydrophobicContact CD2-CD1 3.53Å; F831-L873 HydrophobicContact CD2-CD2 3.8Å; F831-L873 HydrophobicContact CD2-CG 4.3Å; F831-L873 HydrophobicContact CE2-CD1 3.4Å; F831-L873 HydrophobicContact CE2-CD2 4.4Å; F831-L873 HydrophobicContact CG-CD1 4.17Å; F831-L873 HydrophobicContact CG-CD2 3.63Å; F831-L873 HydrophobicContact CZ-CD1 3.94Å; Q869-L873 HydrophobicContact CB-CD1 4.47Å; Q869-L873 HydrophobicContact CB-CG 4.41Å; Q869-L873 WeakPolarHBondContact O-CG 3.4Å; Q869-L873 PolarHBondContact O-N 2.9Å; I870-L873 PolarHBondContact O-N 3.31Å; L873-K877 HydrophobicContact CB-CB 4.11Å; L873-K877 HydrophobicContact CD1-CB 4.43Å; L873-K877 HydrophobicContact CD2-CB 4.17Å; L873-K877 HydrophobicContact CD2-CD 4.16Å; L873-K877 HydrophobicContact CG-CB 4.45Å; L873-L881 HydrophobicContact CD1-CD2 4.18Å; L873-K927 PolarHBondContact O-NZ 2.9Å; L873-S933 WeakPolarHBondContact O-CB 3.4Å
874G86.4Confident91.1Very high31 Ų3142.3 Ų42.332%0.3221%0.21SC..  trans-71.4168.6167.100000112.8T876 K877 S878G874-T876 PolarHBondContact O-N 3.34Å; G874-K877 PolarHBondContact O-N 3.48Å; G874-K877 VanDerWaalsContact O-N 3.14Å; G874-S878 PolarHBondContact O-N 2.91Å; G874-S878 PolarHBondContact O-OG 2.9Å
875E83.9Confident91Very high142 Ų14240.9 Ų40.966%0.66420%0.204SC*.Hα-helixtrans-48.7-50.1-173.7-66.1-170.8170.100113.7K877 S878 M879E875-K877 VanDerWaalsContact C-N 3.35Å; E875-K877 PolarHBondContact O-N 3.01Å; E875-S878 PolarHBondContact O-N 3.26Å; E875-M879 WeakPolarHBondContact O-CG 3.31Å; E875-M879 PolarHBondContact O-N 3.08Å
876T87.3Confident90.7Very high111 Ų11142.1 Ų42.168%0.68121%0.21SC*.Hα-helixtrans-63.8-36.6-175.656.20000113.5G874 K880G874-T876 PolarHBondContact O-N 3.34Å; T876-K880 PolarHBondContact O-N 3.24Å
877K89.9Confident90.6Very high56 Ų5644.8 Ų44.824%0.24323%0.226CC..Hα-helixtrans-74.9-40.3177.7-72.5-174.7177.8-171.60110.9A828 F831 L873 G874 E875 M879 K880 L881A828-K877 VanDerWaalsContact CA-NZ 3.31Å; A828-K877 PolarHBondContact O-NZ 2.86Å; F831-K877 HydrophobicContact CD1-CB 4.01Å; F831-K877 HydrophobicContact CD1-CD 3.75Å; F831-K877 HydrophobicContact CD1-CG 3.98Å; F831-K877 HydrophobicContact CE1-CB 3.61Å; F831-K877 HydrophobicContact CE1-CD 4.17Å; F831-K877 HydrophobicContact CE1-CG 3.87Å; F831-K877 HydrophobicContact CZ-CB 4.2Å; F831-K877 VanDerWaalsContact CZ-O 3.3Å; F831-K877 WeakPolarHBondContact CZ-O 3.44Å; L873-K877 HydrophobicContact CB-CB 4.11Å; L873-K877 HydrophobicContact CD1-CB 4.43Å; L873-K877 HydrophobicContact CD2-CB 4.17Å; L873-K877 HydrophobicContact CD2-CD 4.16Å; L873-K877 HydrophobicContact CG-CB 4.45Å; G874-K877 PolarHBondContact O-N 3.48Å; G874-K877 VanDerWaalsContact O-N 3.14Å; E875-K877 VanDerWaalsContact C-N 3.35Å; E875-K877 PolarHBondContact O-N 3.01Å; K877-M879 VanDerWaalsContact C-N 3.32Å; K877-M879 PolarHBondContact O-N 3.07Å; K877-K880 PolarHBondContact O-N 3.36Å; K877-L881 PolarHBondContact O-N 3.33Å; K877-L881 VanDerWaalsContact O-N 3.12Å
878S90.4Very high90.5Very high2 Ų241.1 Ų41.11%0.01421%0.21CC..Hα-helixtrans-59.6-41.9173-57.50000112G874 E875 K880 L881 Y882 K927G874-S878 PolarHBondContact O-N 2.91Å; G874-S878 PolarHBondContact O-OG 2.9Å; E875-S878 PolarHBondContact O-N 3.26Å; S878-K880 VanDerWaalsContact C-N 3.33Å; S878-K880 PolarHBondContact O-N 3.02Å; S878-L881 PolarHBondContact O-N 3.39Å; S878-L881 VanDerWaalsContact O-N 3.16Å; S878-Y882 VanDerWaalsContact O-CD2 3.26Å; S878-Y882 WeakPolarHBondContact O-CD2 3.46Å; S878-Y882 PolarHBondContact O-N 3.14Å; S878-K927 PolarHBondContact OG-NZ 3.47Å
879M88.9Confident90.4Very high50 Ų5037.8 Ų37.825%0.24620%0.195CC..Hα-helixtrans-58.5-42.7176.2-67.6-69.6-69.100112.4E875 K877 L881 Y882 E883 V953E875-M879 WeakPolarHBondContact O-CG 3.31Å; E875-M879 PolarHBondContact O-N 3.08Å; K877-M879 VanDerWaalsContact C-N 3.32Å; K877-M879 PolarHBondContact O-N 3.07Å; M879-L881 VanDerWaalsContact C-N 3.34Å; M879-L881 PolarHBondContact O-N 3.41Å; M879-Y882 WeakPolarHBondContact O-CB 3.47Å; M879-Y882 PolarHBondContact O-N 2.96Å; M879-Y882 HydrophobicContact SD-CD2 4.37Å; M879-E883 WeakPolarHBondContact O-CG 3.42Å; M879-E883 PolarHBondContact O-N 3.04Å; M879-V953 WeakPolarHBondContact CE-O 3.29Å
880K91Very high90.2Very high124 Ų12441.4 Ų41.454%0.53921%0.212SC..Hα-helixtrans-63.3-40.6176.4-71-177.7176.6-173.40112.3M835 T876 K877 S878 E883 A884M835-K880 HydrophobicContact SD-CB 4.2Å; T876-K880 PolarHBondContact O-N 3.24Å; K877-K880 PolarHBondContact O-N 3.36Å; S878-K880 VanDerWaalsContact C-N 3.33Å; S878-K880 PolarHBondContact O-N 3.02Å; K880-E883 PolarHBondContact O-N 3.5Å; K880-A884 WeakPolarHBondContact O-CB 3.23Å; K880-A884 PolarHBondContact O-N 3.03Å
881L93.6Very high90.1Very high0 Ų042 Ų420%022%0.216CC..Hα-helixtrans-64.6-44.8176-17659.5000110.8F831 L838 V865 A866 I870 L873 K877 S878 M879 E883 A884 C885 L924F831-L881 HydrophobicContact CE2-CB 4.06Å; F831-L881 HydrophobicContact CE2-CD1 4.39Å; F831-L881 HydrophobicContact CE2-CD2 4.35Å; F831-L881 HydrophobicContact CZ-CB 4.1Å; L838-L881 HydrophobicContact CD1-CD1 4.23Å; V865-L881 HydrophobicContact CG1-CD1 4.11Å; V865-L881 HydrophobicContact CG1-CD2 4.5Å; A866-L881 HydrophobicContact CB-CD2 4.49Å; I870-L881 HydrophobicContact CB-CD2 4.45Å; I870-L881 HydrophobicContact CD1-CD2 4.31Å; I870-L881 HydrophobicContact CG1-CD2 4.35Å; L873-L881 HydrophobicContact CD1-CD2 4.18Å; K877-L881 PolarHBondContact O-N 3.33Å; K877-L881 VanDerWaalsContact O-N 3.12Å; S878-L881 PolarHBondContact O-N 3.39Å; S878-L881 VanDerWaalsContact O-N 3.16Å; M879-L881 VanDerWaalsContact C-N 3.34Å; M879-L881 PolarHBondContact O-N 3.41Å; L881-E883 PolarHBondContact O-N 3.03Å; L881-A884 PolarHBondContact O-N 2.95Å; L881-C885 WeakPolarHBondContact O-CB 3.39Å; L881-C885 PolarHBondContact O-N 2.92Å; L881-C885 PolarHBondContact O-SG 2.7Å; L881-L924 HydrophobicContact CD2-CD2 4.47Å
882Y91.9Very high90.1Very high11 Ų1141.5 Ų41.54%0.04321%0.212CC..Hα-helixtrans-56.3-47.3175-66.4-26.9000112.4I870 S878 M879 A884 L886 L924 A955 V958I870-Y882 HydrophobicContact CD1-CE1 3.6Å; S878-Y882 VanDerWaalsContact O-CD2 3.26Å; S878-Y882 WeakPolarHBondContact O-CD2 3.46Å; S878-Y882 PolarHBondContact O-N 3.14Å; M879-Y882 WeakPolarHBondContact O-CB 3.47Å; M879-Y882 PolarHBondContact O-N 2.96Å; M879-Y882 HydrophobicContact SD-CD2 4.37Å; Y882-A884 PolarHBondContact O-N 2.92Å; Y882-L886 VanDerWaalsContact O-CB 3.23Å; Y882-L886 WeakPolarHBondContact O-CB 3.45Å; Y882-L886 PolarHBondContact O-N 3Å; Y882-L924 HydrophobicContact CD1-CD2 3.95Å; Y882-L924 HydrophobicContact CE1-CB 4.35Å; Y882-L924 HydrophobicContact CE1-CD2 3.94Å; Y882-A955 HydrophobicContact CE1-CB 3.92Å; Y882-A955 HydrophobicContact CE2-CB 4.06Å; Y882-V958 HydrophobicContact CD1-CG2 4.47Å; Y882-V958 HydrophobicContact CG-CG2 4.22Å; Y882-V958 WeakPolarHBondContact O-CG2 3.19Å
883E91.3Very high90.1Very high82 Ų8238.1 Ų38.138%0.38320%0.199SC..Hα-helixtrans-63.1-39.7177.2-72.9175.617500112.5M879 K880 L881 T887 V953M879-E883 WeakPolarHBondContact O-CG 3.42Å; M879-E883 PolarHBondContact O-N 3.04Å; K880-E883 PolarHBondContact O-N 3.5Å; L881-E883 PolarHBondContact O-N 3.03Å; E883-T887 WeakPolarHBondContact O-CB 3.3Å; E883-T887 PolarHBondContact O-N 3.46Å; E883-T887 PolarHBondContact O-OG1 3.33Å; E883-V953 HydrophobicContact CG-CB 4.35Å; E883-V953 HydrophobicContact CG-CG2 4.09Å
884A93.3Very high90Very high7 Ų744.7 Ų44.76%0.05823%0.227CC..Hα-helixtrans-68.6-46.8177.300000112.6M835 F862 K880 L881 Y882 L886 T887 L888M835-A884 HydrophobicContact CE-CB 3.46Å; M835-A884 VanDerWaalsContact CE-CB 3.46Å; F862-A884 HydrophobicContact CE1-CB 4.07Å; K880-A884 WeakPolarHBondContact O-CB 3.23Å; K880-A884 PolarHBondContact O-N 3.03Å; L881-A884 PolarHBondContact O-N 2.95Å; Y882-A884 PolarHBondContact O-N 2.92Å; A884-L886 VanDerWaalsContact C-N 3.31Å; A884-L886 PolarHBondContact O-N 2.65Å; A884-T887 PolarHBondContact O-N 2.83Å; A884-L888 WeakPolarHBondContact O-CB 3.06Å; A884-L888 PolarHBondContact O-N 3.04Å
885C93.7Very high89.9Confident0 Ų045.3 Ų45.30%022%0.223CC..Hα-helixtrans-58.9-43.9173.9-67.20000111L881 T887 L888 L889 L920 L924 V958L881-C885 WeakPolarHBondContact O-CB 3.39Å; L881-C885 PolarHBondContact O-N 2.92Å; L881-C885 PolarHBondContact O-SG 2.7Å; C885-T887 VanDerWaalsContact C-N 3.34Å; C885-T887 PolarHBondContact O-N 3.19Å; C885-L888 WeakPolarHBondContact O-CB 3.42Å; C885-L888 PolarHBondContact O-N 2.84Å; C885-L889 WeakPolarHBondContact O-CB 3.41Å; C885-L889 VanDerWaalsContact O-CG 3.23Å; C885-L889 WeakPolarHBondContact O-CG 3.41Å; C885-L889 PolarHBondContact O-N 3.15Å; C885-L920 HydrophobicContact CB-CD2 4.46Å; C885-L924 HydrophobicContact CB-CD1 3.89Å; C885-V958 HydrophobicContact CB-CG1 4.25Å
886L90.8Very high89.7Confident26 Ų2639.6 Ų39.614%0.13620%0.198CC..Hα-helixtrans-59-46176.9-179.364.9000111.6Y882 A884 L889 Q890 V953 V958 Y961Y882-L886 VanDerWaalsContact O-CB 3.23Å; Y882-L886 WeakPolarHBondContact O-CB 3.45Å; Y882-L886 PolarHBondContact O-N 3Å; A884-L886 VanDerWaalsContact C-N 3.31Å; A884-L886 PolarHBondContact O-N 2.65Å; L886-L889 PolarHBondContact O-N 3Å; L886-Q890 VanDerWaalsContact O-CG 3.25Å; L886-Q890 WeakPolarHBondContact O-CG 3.47Å; L886-Q890 PolarHBondContact O-N 3.16Å; L886-V953 HydrophobicContact CD2-CG1 4.21Å; L886-V953 HydrophobicContact CD2-CG2 4.4Å; L886-V958 HydrophobicContact CB-CG1 4.26Å; L886-V958 HydrophobicContact CB-CG2 4.29Å; L886-Y961 HydrophobicContact CD1-CD1 3.2Å; L886-Y961 HydrophobicContact CD1-CD2 4.14Å; L886-Y961 HydrophobicContact CD1-CE1 3.94Å; L886-Y961 HydrophobicContact CD1-CG 3.33Å; L886-Y961 HydrophobicContact CG-CD1 4.47Å
887T91.9Very high88.9Confident56 Ų5639.9 Ų39.934%0.34419%0.191SC..Hα-helixtrans-67.4-38.9179.9-52.90000111.8I842 E883 A884 C885 Q890 V891I842-T887 HydrophobicContact CD1-CG2 4Å; I842-T887 HydrophobicContact CG2-CG2 3.84Å; E883-T887 WeakPolarHBondContact O-CB 3.3Å; E883-T887 PolarHBondContact O-N 3.46Å; E883-T887 PolarHBondContact O-OG1 3.33Å; A884-T887 PolarHBondContact O-N 2.83Å; C885-T887 VanDerWaalsContact C-N 3.34Å; C885-T887 PolarHBondContact O-N 3.19Å; T887-Q890 WeakPolarHBondContact O-CB 3.38Å; T887-Q890 PolarHBondContact O-N 3.42Å; T887-V891 WeakPolarHBondContact O-CG2 3.44Å; T887-V891 PolarHBondContact O-N 2.88Å
888L92.9Very high87.6Confident2 Ų243 Ų431%0.0122%0.22CC..Hα-helixtrans-57.5-50.9173.5-175.578.3000111I842 M845 I858 F862 A884 C885 Q890 V891 Y892I842-L888 HydrophobicContact CG1-CB 4.47Å; I842-L888 HydrophobicContact CG1-CD1 4.34Å; M845-L888 HydrophobicContact CE-CD1 3.39Å; M845-L888 HydrophobicContact CE-CD2 4.37Å; M845-L888 HydrophobicContact CE-CG 3.87Å; M845-L888 HydrophobicContact SD-CD1 3.69Å; M845-L888 HydrophobicContact SD-CG 4.1Å; I858-L888 HydrophobicContact CG2-CD1 3.94Å; F862-L888 HydrophobicContact CB-CD2 4.09Å; F862-L888 HydrophobicContact CD1-CD2 3.81Å; F862-L888 HydrophobicContact CD2-CD1 4.26Å; F862-L888 HydrophobicContact CD2-CD2 3.65Å; F862-L888 HydrophobicContact CE1-CB 4.12Å; F862-L888 HydrophobicContact CE1-CD2 4.06Å; F862-L888 HydrophobicContact CE1-CG 4.49Å; F862-L888 HydrophobicContact CE2-CD1 3.72Å; F862-L888 HydrophobicContact CE2-CD2 3.9Å; F862-L888 HydrophobicContact CE2-CG 4.31Å; F862-L888 HydrophobicContact CG-CD2 3.59Å; F862-L888 HydrophobicContact CZ-CB 4.18Å; F862-L888 HydrophobicContact CZ-CD1 3.9Å; F862-L888 HydrophobicContact CZ-CD2 4.1Å; F862-L888 HydrophobicContact CZ-CG 4.29Å; A884-L888 WeakPolarHBondContact O-CB 3.06Å; A884-L888 PolarHBondContact O-N 3.04Å; C885-L888 WeakPolarHBondContact O-CB 3.42Å; C885-L888 PolarHBondContact O-N 2.84Å; L888-Q890 VanDerWaalsContact C-N 3.31Å; L888-Q890 PolarHBondContact O-N 3.23Å; L888-V891 PolarHBondContact O-N 3.03Å; L888-V891 VanDerWaalsContact O-N 3.15Å; L888-Y892 PolarHBondContact O-N 3.45Å
889L90.8Very high86.6Confident2 Ų247 Ų471%0.0123%0.234CC..Hα-helixtrans-62-39.2179.6-67.5174.8000111.2C885 L886 V891 Y892 S893 I917 L921 I965C885-L889 WeakPolarHBondContact O-CB 3.41Å; C885-L889 VanDerWaalsContact O-CG 3.23Å; C885-L889 WeakPolarHBondContact O-CG 3.41Å; C885-L889 PolarHBondContact O-N 3.15Å; L886-L889 PolarHBondContact O-N 3Å; L889-V891 PolarHBondContact O-N 3.41Å; L889-Y892 PolarHBondContact O-N 3.24Å; L889-S893 WeakPolarHBondContact O-CB 3.33Å; L889-S893 PolarHBondContact O-N 2.99Å; L889-I917 HydrophobicContact CD2-CB 4.41Å; L889-I917 HydrophobicContact CD2-CD1 4.19Å; L889-I917 HydrophobicContact CD2-CG1 3.94Å; L889-I917 HydrophobicContact CD2-CG2 3.68Å; L889-L921 HydrophobicContact CD1-CD2 3.8Å; L889-I965 HydrophobicContact CB-CD1 3.55Å; L889-I965 WeakPolarHBondContact O-CD1 3.44Å
890Q89.1Confident85.4Confident76 Ų7654.5 Ų54.536%0.35527%0.266SS..Hα-helixtrans-57.4-46173.2-75173.52.400112.5L886 T887 L888 K894 Y961L886-Q890 VanDerWaalsContact O-CG 3.25Å; L886-Q890 WeakPolarHBondContact O-CG 3.47Å; L886-Q890 PolarHBondContact O-N 3.16Å; T887-Q890 WeakPolarHBondContact O-CB 3.38Å; T887-Q890 PolarHBondContact O-N 3.42Å; L888-Q890 VanDerWaalsContact C-N 3.31Å; L888-Q890 PolarHBondContact O-N 3.23Å; Q890-K894 WeakPolarHBondContact O-CB 3.29Å; Q890-K894 PolarHBondContact O-N 3.15Å; Q890-Y961 HydrophobicContact CB-CE1 4.46Å; Q890-Y961 HydrophobicContact CG-CD1 4.41Å; Q890-Y961 HydrophobicContact CG-CE1 3.35Å; Q890-Y961 WeakPolarHBondContact CG-OH 3.27Å
891V90.1Very high84.2Confident13 Ų1351.7 Ų51.78%0.07925%0.252CS..Hα-helixtrans-66.3-46.9178.2170.40000111.1I842 M845 E846 T887 L888 L889 S893 K894 N895I842-V891 HydrophobicContact CG2-CG2 3.85Å; M845-V891 HydrophobicContact CB-CG1 4.09Å; M845-V891 HydrophobicContact CG-CG1 4.02Å; M845-V891 HydrophobicContact SD-CG1 4.26Å; E846-V891 HydrophobicContact CG-CG1 3.51Å; E846-V891 HydrophobicContact CG-CG2 4.4Å; T887-V891 WeakPolarHBondContact O-CG2 3.44Å; T887-V891 PolarHBondContact O-N 2.88Å; L888-V891 PolarHBondContact O-N 3.03Å; L888-V891 VanDerWaalsContact O-N 3.15Å; L889-V891 PolarHBondContact O-N 3.41Å; V891-S893 VanDerWaalsContact C-N 3.32Å; V891-S893 PolarHBondContact O-N 3.17Å; V891-K894 PolarHBondContact O-N 3.05Å; V891-N895 VanDerWaalsContact O-CG 3.26Å; V891-N895 PolarHBondContact O-N 2.97Å; V891-N895 VanDerWaalsContact O-N 3.12Å; V891-N895 PolarHBondContact O-ND2 3.19Å
892Y89.3Confident82.7Confident4 Ų457.5 Ų57.52%0.01629%0.292CS..Hα-helixtrans-56-48.7176.3-177.9-92000111.4M845 I855 I859 L888 L889 N895 N896 D913 I917 L969M845-Y892 HydrophobicContact SD-CD2 4.36Å; I855-Y892 HydrophobicContact CG2-CD2 3.9Å; I855-Y892 HydrophobicContact CG2-CE2 3.78Å; I859-Y892 HydrophobicContact CD1-CD2 4.05Å; I859-Y892 HydrophobicContact CD1-CE2 4.01Å; L888-Y892 PolarHBondContact O-N 3.45Å; L889-Y892 PolarHBondContact O-N 3.24Å; Y892-N895 PolarHBondContact O-N 2.78Å; Y892-N896 WeakPolarHBondContact CD2-ND2 3.33Å; Y892-N896 HydrophobicContact CE1-CB 4.37Å; Y892-N896 VanDerWaalsContact CE2-ND2 3.29Å; Y892-N896 WeakPolarHBondContact CE2-ND2 3.31Å; Y892-N896 WeakPolarHBondContact O-CB 3.36Å; Y892-N896 PolarHBondContact O-N 2.94Å; Y892-N896 VanDerWaalsContact O-N 3.09Å; Y892-N896 PolarHBondContact O-ND2 3.49Å; Y892-D913 HydrophobicContact CE2-CB 4.03Å; Y892-D913 WeakPolarHBondContact CE2-OD2 3.31Å; Y892-D913 WeakPolarHBondContact OH-CB 3.47Å; Y892-D913 PolarHBondContact OH-OD2 2.96Å; Y892-I917 HydrophobicContact CD1-CD1 3.72Å; Y892-I917 HydrophobicContact CD2-CD1 4.47Å; Y892-I917 HydrophobicContact CE1-CD1 3.66Å; Y892-I917 HydrophobicContact CE2-CD1 4.41Å; Y892-I917 HydrophobicContact CG-CD1 4.15Å; Y892-L969 HydrophobicContact CE1-CD1 3.98Å
893S86.8Confident81.5Confident4 Ų461.9 Ų61.93%0.02832%0.317CS..Hα-helixtrans-60.1-48.9179.5-172.30000112.1L889 V891 N895 N896 Q897L889-S893 WeakPolarHBondContact O-CB 3.33Å; L889-S893 PolarHBondContact O-N 2.99Å; V891-S893 VanDerWaalsContact C-N 3.32Å; V891-S893 PolarHBondContact O-N 3.17Å; S893-N895 PolarHBondContact O-N 3.22Å; S893-N896 PolarHBondContact O-N 3.19Å; S893-Q897 VanDerWaalsContact O-CB 3.29Å; S893-Q897 WeakPolarHBondContact O-CB 3.44Å; S893-Q897 WeakPolarHBondContact O-CG 3.46Å; S893-Q897 PolarHBondContact O-N 3.46Å; S893-Q897 PolarHBondContact OG-NE2 3.33Å
894K86.3Confident80.2Confident139 Ų13963.3 Ų63.360%0.60434%0.342SS*.Hα-helixtrans-56.3-37.1178175.8-173.3164.3-160.40112E846 Q890 V891E846-K894 IonicContact OE1-NZ 2.9Å; E846-K894 PolarHBondContact OE1-NZ 2.97Å; Q890-K894 WeakPolarHBondContact O-CB 3.29Å; Q890-K894 PolarHBondContact O-N 3.15Å; V891-K894 PolarHBondContact O-N 3.05Å
895N84.1Confident79.3Confident44 Ų4467 Ų6724%0.23536%0.364CS..Hα-helixtrans-81.3-25.8-177.1-65.7-17.1000113.4V891 Y892 S893V891-N895 VanDerWaalsContact O-CG 3.26Å; V891-N895 PolarHBondContact O-N 2.97Å; V891-N895 VanDerWaalsContact O-N 3.12Å; V891-N895 PolarHBondContact O-ND2 3.19Å; Y892-N895 PolarHBondContact O-N 2.78Å; S893-N895 PolarHBondContact O-N 3.22Å
896N80.3Confident78.6Confident23 Ų2367.6 Ų67.612%0.12337%0.369CS..Hα-helixtrans-110-20.6-172.3-70-59.8000115.3Y892 S893 S898 R899Y892-N896 WeakPolarHBondContact CD2-ND2 3.33Å; Y892-N896 HydrophobicContact CE1-CB 4.37Å; Y892-N896 VanDerWaalsContact CE2-ND2 3.29Å; Y892-N896 WeakPolarHBondContact CE2-ND2 3.31Å; Y892-N896 WeakPolarHBondContact O-CB 3.36Å; Y892-N896 PolarHBondContact O-N 2.94Å; Y892-N896 VanDerWaalsContact O-N 3.09Å; Y892-N896 PolarHBondContact O-ND2 3.49Å; S893-N896 PolarHBondContact O-N 3.19Å; N896-S898 PolarHBondContact O-N 3.36Å; N896-R899 PolarHBondContact O-N 3.31Å; N896-R899 VanDerWaalsContact O-N 3.16Å
897Q70.3Confident78.1Confident116 Ų11670.4 Ų70.454%0.54238%0.382SS..THydrogen-bonded Turntrans-55.7-24.1-175.6-90.1179.11.100116.2S893S893-Q897 VanDerWaalsContact O-CB 3.29Å; S893-Q897 WeakPolarHBondContact O-CB 3.44Å; S893-Q897 WeakPolarHBondContact O-CG 3.46Å; S893-Q897 PolarHBondContact O-N 3.46Å; S893-Q897 PolarHBondContact OG-NE2 3.33Å
898S63.5Low77.6Confident121 Ų12171.6 Ų71.685%0.84638%0.383SS*.THydrogen-bonded Turntrans-122.310.1-178-63.30000113.6N896N896-S898 PolarHBondContact O-N 3.36Å
899R69.3Low77.1Confident86 Ų8673.7 Ų73.733%0.32539%0.394SS..  trans-94.1109.3-170.9-166.1179.6-176.1163.14110.9S849 N850 N896 R901S849-R899 PolarHBondContact O-NH1 2.96Å; N850-R899 PolarHBondContact OD1-NH1 2.97Å; N850-R899 VanDerWaalsContact OD1-NH1 3.1Å; N850-R899 PolarHBondContact OD1-NH2 3Å; N896-R899 PolarHBondContact O-N 3.31Å; N896-R899 VanDerWaalsContact O-N 3.16Å; R899-R901 HydrophobicContact CG-CG 4.21Å; R899-R901 VanDerWaalsContact CZ-NE 3.33Å; R899-R901 VanDerWaalsContact NH1-NH2 3.1Å
900K64.2Low76.8Confident209 Ų20976.4 Ų76.491%0.90941%0.407SS*.  trans-94.5107.6166.4-65.3-174.1179-1740108.4
901R65.8Low76.6Confident65 Ų6574 Ų7425%0.24540%0.395CS..  trans-87.2140.6169.9-70.9-177.6177.2172.91.7108.9R899 A906 D909R899-R901 HydrophobicContact CG-CG 4.21Å; R899-R901 VanDerWaalsContact CZ-NE 3.33Å; R899-R901 VanDerWaalsContact NH1-NH2 3.1Å; R901-A906 HydrophobicContact CB-CB 3.45Å; R901-A906 VanDerWaalsContact CB-CB 3.45Å; R901-A906 HydrophobicContact CG-CB 4.36Å; R901-D909 IonicContact NH1-OD2 2.91Å
902S61.2Low76.6Confident121 Ų12177 Ų7785%0.84641%0.408SS*.  trans-99.92.617945.40000113
903D67.3Low76.6Confident104 Ų10477.1 Ų77.156%0.55641%0.409SS*.SBendtrans-81.2144.9-174.1-52.6-40.6000110.7T905 A906D903-T905 PolarHBondContact O-N 3.03Å; D903-A906 HydrophobicContact CB-CB 4.46Å; D903-A906 WeakPolarHBondContact O-CB 3.47Å; D903-A906 PolarHBondContact O-N 3.36Å; D903-A906 VanDerWaalsContact O-N 3.15Å
904A64Low76.7Confident111 Ų11176.9 Ų76.992%0.91741%0.408SS*.THydrogen-bonded Turntrans-63.5-23.7-175.200000113.8
905T74.9Confident76.9Confident84 Ų8472.1 Ų72.152%0.51539%0.388SS..THydrogen-bonded Turntrans-97.6-0.7179.8590000113.3D903 E907 E908 D909D903-T905 PolarHBondContact O-N 3.03Å; T905-E907 VanDerWaalsContact C-N 3.26Å; T905-E907 PolarHBondContact O-N 3.38Å; T905-E908 WeakPolarHBondContact O-CB 3.18Å; T905-E908 PolarHBondContact O-N 3.5Å; T905-E908 VanDerWaalsContact O-N 3.09Å; T905-D909 PolarHBondContact O-N 2.96Å
906A78.9Confident77.3Confident13 Ų1371.1 Ų71.111%0.10738%0.383CS..Hα-helixtrans-64.7-30.6-173.200000113.6R901 D903 Q910R901-A906 HydrophobicContact CB-CB 3.45Å; R901-A906 VanDerWaalsContact CB-CB 3.45Å; R901-A906 HydrophobicContact CG-CB 4.36Å; D903-A906 HydrophobicContact CB-CB 4.46Å; D903-A906 WeakPolarHBondContact O-CB 3.47Å; D903-A906 PolarHBondContact O-N 3.36Å; D903-A906 VanDerWaalsContact O-N 3.15Å; A906-Q910 VanDerWaalsContact O-CB 3.32Å; A906-Q910 WeakPolarHBondContact O-CB 3.4Å; A906-Q910 PolarHBondContact O-N 3.38Å; A906-Q910 VanDerWaalsContact O-N 3.14Å
907E78.9Confident77.9Confident86 Ų8670.1 Ų70.140%0.40238%0.377SS..Hα-helixtrans-70.1-39.5174.6-173.7170.5-153.300111.5T905 Q910 Y911 D973 L974 F977T905-E907 VanDerWaalsContact C-N 3.26Å; T905-E907 PolarHBondContact O-N 3.38Å; E907-Q910 PolarHBondContact O-N 3.41Å; E907-Y911 VanDerWaalsContact O-CB 3.29Å; E907-Y911 WeakPolarHBondContact O-CB 3.37Å; E907-Y911 PolarHBondContact O-N 2.88Å; E907-D973 WeakPolarHBondContact OE1-CB 3.37Å; E907-L974 HydrophobicContact CG-CD2 3.92Å; E907-F977 HydrophobicContact CG-CE2 4.07Å; E907-F977 HydrophobicContact CG-CZ 4.36Å
908E81.5Confident78.8Confident80 Ų8064.6 Ų64.637%0.37435%0.352SS..Hα-helixtrans-66.2-47.3176.2-174.261.1-145.900111.2T905 Q910 Y911 Q912T905-E908 WeakPolarHBondContact O-CB 3.18Å; T905-E908 PolarHBondContact O-N 3.5Å; T905-E908 VanDerWaalsContact O-N 3.09Å; E908-Q910 VanDerWaalsContact C-N 3.29Å; E908-Q910 PolarHBondContact O-N 2.81Å; E908-Y911 WeakPolarHBondContact O-CB 3.4Å; E908-Y911 PolarHBondContact O-N 2.78Å; E908-Y911 VanDerWaalsContact O-N 3.12Å; E908-Y911 WeakPolarHBondContact OE1-CD1 3.44Å; E908-Q912 WeakPolarHBondContact O-CG 3.43Å; E908-Q912 PolarHBondContact O-N 3.08Å; E908-Q912 PolarHBondContact OE1-NE2 3.25Å
909D82.3Confident80.1Confident46 Ų4662.5 Ų62.525%0.24633%0.328CS..Hα-helixtrans-57.7-44.2176.3-64.7-16.5000111.3P852 R901 T905 Y911 Q912 D913P852-D909 HydrophobicContact CB-CB 4.1Å; P852-D909 WeakPolarHBondContact CG-OD2 3.36Å; R901-D909 IonicContact NH1-OD2 2.91Å; T905-D909 PolarHBondContact O-N 2.96Å; D909-Y911 VanDerWaalsContact C-N 3.35Å; D909-Q912 PolarHBondContact O-N 3.12Å; D909-D913 PolarHBondContact O-N 3.31Å; D909-D913 VanDerWaalsContact O-N 3.16Å
910Q83.9Confident81.2Confident60 Ų6058.4 Ų58.428%0.2831%0.313SS..Hα-helixtrans-68.1-36.6178.5-173.2177.27.300111.5A906 E907 E908 L914 L974A906-Q910 VanDerWaalsContact O-CB 3.32Å; A906-Q910 WeakPolarHBondContact O-CB 3.4Å; A906-Q910 PolarHBondContact O-N 3.38Å; A906-Q910 VanDerWaalsContact O-N 3.14Å; E907-Q910 PolarHBondContact O-N 3.41Å; E908-Q910 VanDerWaalsContact C-N 3.29Å; E908-Q910 PolarHBondContact O-N 2.81Å; Q910-L914 HydrophobicContact CG-CD1 4.08Å; Q910-L914 HydrophobicContact CG-CG 4.4Å; Q910-L914 WeakPolarHBondContact O-CB 3.32Å; Q910-L914 VanDerWaalsContact O-CG 3.23Å; Q910-L914 WeakPolarHBondContact O-CG 3.4Å; Q910-L914 PolarHBondContact O-N 3.37Å; Q910-L974 HydrophobicContact CG-CD1 4.4Å
911Y86.8Confident82.5Confident26 Ų2648.4 Ų48.410%0.10227%0.27CS..Hα-helixtrans-59.9-48.9174.1156.9-97.9000111.3E907 E908 D909 D913 L914 L915 F977 L980E907-Y911 VanDerWaalsContact O-CB 3.29Å; E907-Y911 WeakPolarHBondContact O-CB 3.37Å; E907-Y911 PolarHBondContact O-N 2.88Å; E908-Y911 WeakPolarHBondContact O-CB 3.4Å; E908-Y911 PolarHBondContact O-N 2.78Å; E908-Y911 VanDerWaalsContact O-N 3.12Å; E908-Y911 WeakPolarHBondContact OE1-CD1 3.44Å; D909-Y911 VanDerWaalsContact C-N 3.35Å; Y911-D913 PolarHBondContact O-N 3.18Å; Y911-L914 PolarHBondContact O-N 3.29Å; Y911-L915 WeakPolarHBondContact O-CB 3.33Å; Y911-L915 PolarHBondContact O-N 3.23Å; Y911-F977 HydrophobicContact CD2-CB 3.74Å; Y911-F977 AromaticContact CD2-CD1 3.96Å; Y911-F977 HydrophobicContact CD2-CD1 3.96Å; Y911-F977 HydrophobicContact CD2-CD2 4.37Å; Y911-F977 AromaticContact CD2-CG 3.78Å; Y911-F977 HydrophobicContact CD2-CG 3.78Å; Y911-F977 HydrophobicContact CE2-CB 3.64Å; Y911-F977 HydrophobicContact CE2-CD1 4.07Å; Y911-F977 HydrophobicContact CE2-CG 4.03Å; Y911-F977 HydrophobicContact CG-CD1 4.23Å; Y911-F977 HydrophobicContact CG-CG 4.37Å; Y911-L980 HydrophobicContact CD2-CB 3.69Å; Y911-L980 HydrophobicContact CD2-CD2 3.86Å; Y911-L980 HydrophobicContact CD2-CG 4.32Å; Y911-L980 HydrophobicContact CE2-CB 3.56Å
912Q88.6Confident83.5Confident74 Ų7448 Ų4835%0.34627%0.274SS..Hα-helixtrans-62.2-44.5-179.8-64.7-66.2-1800111.9E908 D909 L914 L915 L916E908-Q912 WeakPolarHBondContact O-CG 3.43Å; E908-Q912 PolarHBondContact O-N 3.08Å; E908-Q912 PolarHBondContact OE1-NE2 3.25Å; D909-Q912 PolarHBondContact O-N 3.12Å; Q912-L914 PolarHBondContact O-N 3.29Å; Q912-L915 PolarHBondContact O-N 2.87Å; Q912-L916 PolarHBondContact O-N 3.05Å; Q912-L916 VanDerWaalsContact O-N 3.14Å
913D89.7Confident84.8Confident7 Ų743.1 Ų43.14%0.03724%0.239CC..Hα-helixtrans-61.1-46.2176.4-73.3-10.5000112N856 I859 Y892 D909 Y911 L915 L916 I917N856-D913 WeakPolarHBondContact CB-OD1 3.48Å; N856-D913 PolarHBondContact ND2-N 3.02Å; N856-D913 PolarHBondContact ND2-OD1 3.21Å; I859-D913 HydrophobicContact CD1-CB 4.24Å; Y892-D913 HydrophobicContact CE2-CB 4.03Å; Y892-D913 WeakPolarHBondContact CE2-OD2 3.31Å; Y892-D913 WeakPolarHBondContact OH-CB 3.47Å; Y892-D913 PolarHBondContact OH-OD2 2.96Å; D909-D913 PolarHBondContact O-N 3.31Å; D909-D913 VanDerWaalsContact O-N 3.16Å; Y911-D913 PolarHBondContact O-N 3.18Å; D913-L915 VanDerWaalsContact C-N 3.31Å; D913-L915 PolarHBondContact O-N 3.26Å; D913-L916 PolarHBondContact O-N 2.85Å; D913-I917 VanDerWaalsContact O-CG1 3.3Å; D913-I917 WeakPolarHBondContact O-CG1 3.49Å; D913-I917 PolarHBondContact O-N 3.11Å
914L89.1Confident85.9Confident0 Ų038.1 Ų38.10%021%0.212CC..Hα-helixtrans-65.5-36.8179.3-72.3176.3000111.2Q910 Y911 Q912 I917 M918 V966 L969 M970 L974 L980Q910-L914 HydrophobicContact CG-CD1 4.08Å; Q910-L914 HydrophobicContact CG-CG 4.4Å; Q910-L914 WeakPolarHBondContact O-CB 3.32Å; Q910-L914 VanDerWaalsContact O-CG 3.23Å; Q910-L914 WeakPolarHBondContact O-CG 3.4Å; Q910-L914 PolarHBondContact O-N 3.37Å; Y911-L914 PolarHBondContact O-N 3.29Å; Q912-L914 PolarHBondContact O-N 3.29Å; L914-I917 PolarHBondContact O-N 2.94Å; L914-M918 WeakPolarHBondContact O-CB 3.5Å; L914-M918 WeakPolarHBondContact O-CG 3.49Å; L914-M918 PolarHBondContact O-N 3.42Å; L914-V966 HydrophobicContact CD2-CG1 4.29Å; L914-V966 HydrophobicContact CD2-CG2 4.2Å; L914-L969 HydrophobicContact CD1-CB 4.31Å; L914-L969 HydrophobicContact CD2-CB 4.21Å; L914-L969 HydrophobicContact CD2-CD1 4.07Å; L914-M970 HydrophobicContact CD1-CE 4.41Å; L914-M970 HydrophobicContact CD1-SD 4.41Å; L914-L974 HydrophobicContact CD1-CD1 3.86Å; L914-L980 HydrophobicContact CB-CD1 3.92Å; L914-L980 HydrophobicContact CB-CD2 4.4Å; L914-L980 HydrophobicContact CD1-CD2 4.41Å
915L90.3Very high86.8Confident38 Ų3833 Ų3320%0.19917%0.169CC..Hα-helixtrans-60.5-48176.8-170.266.9000111.2Y911 Q912 D913 M918 E919 Q983Y911-L915 WeakPolarHBondContact O-CB 3.33Å; Y911-L915 PolarHBondContact O-N 3.23Å; Q912-L915 PolarHBondContact O-N 2.87Å; D913-L915 VanDerWaalsContact C-N 3.31Å; D913-L915 PolarHBondContact O-N 3.26Å; L915-M918 WeakPolarHBondContact O-CB 3.41Å; L915-M918 PolarHBondContact O-N 3.4Å; L915-E919 PolarHBondContact O-N 3.29Å; L915-Q983 HydrophobicContact CD1-CB 4.46Å; L915-Q983 HydrophobicContact CD1-CG 4.03Å
916L92.3Very high87.2Confident24 Ų2429.8 Ų29.813%0.12615%0.15CC..Hα-helixtrans-65.2-38.6176.2-69.7179000112.7N856 I859 E860 V863 Q912 D913 M918 E919 L920N856-L916 WeakPolarHBondContact ND2-CD1 3.1Å; N856-L916 WeakPolarHBondContact O-CD1 3.41Å; N856-L916 WeakPolarHBondContact OD1-CD1 3.45Å; I859-L916 HydrophobicContact CB-CB 4.38Å; I859-L916 HydrophobicContact CB-CD1 4.38Å; I859-L916 HydrophobicContact CG2-CB 3.62Å; I859-L916 HydrophobicContact CG2-CD1 4.46Å; E860-L916 HydrophobicContact CB-CD1 4.03Å; V863-L916 HydrophobicContact CG2-CB 4.19Å; V863-L916 HydrophobicContact CG2-CD2 4.36Å; V863-L916 VanDerWaalsContact CG2-O 3.25Å; V863-L916 WeakPolarHBondContact CG2-O 3.43Å; Q912-L916 PolarHBondContact O-N 3.05Å; Q912-L916 VanDerWaalsContact O-N 3.14Å; D913-L916 PolarHBondContact O-N 2.85Å; L916-M918 VanDerWaalsContact C-N 3.31Å; L916-M918 PolarHBondContact O-N 2.89Å; L916-E919 PolarHBondContact O-N 3.2Å; L916-L920 WeakPolarHBondContact O-CB 3.31Å; L916-L920 PolarHBondContact O-N 3.14Å
917I92.8Very high87.3Confident1 Ų129.9 Ų29.91%0.00515%0.148CC..Hα-helixtrans-61.4-43.3174.4-71.6168.1000110.3I859 L889 Y892 D913 L914 L920 L921 V966I859-I917 HydrophobicContact CD1-CD1 4.28Å; I859-I917 HydrophobicContact CD1-CG1 4.19Å; I859-I917 HydrophobicContact CG2-CG1 4.09Å; L889-I917 HydrophobicContact CD2-CB 4.41Å; L889-I917 HydrophobicContact CD2-CD1 4.19Å; L889-I917 HydrophobicContact CD2-CG1 3.94Å; L889-I917 HydrophobicContact CD2-CG2 3.68Å; Y892-I917 HydrophobicContact CD1-CD1 3.72Å; Y892-I917 HydrophobicContact CD2-CD1 4.47Å; Y892-I917 HydrophobicContact CE1-CD1 3.66Å; Y892-I917 HydrophobicContact CE2-CD1 4.41Å; Y892-I917 HydrophobicContact CG-CD1 4.15Å; D913-I917 VanDerWaalsContact O-CG1 3.3Å; D913-I917 WeakPolarHBondContact O-CG1 3.49Å; D913-I917 PolarHBondContact O-N 3.11Å; L914-I917 PolarHBondContact O-N 2.94Å; I917-L920 WeakPolarHBondContact O-CB 3.38Å; I917-L920 PolarHBondContact O-N 3.32Å; I917-L921 HydrophobicContact CG2-CD1 4.28Å; I917-L921 HydrophobicContact CG2-CG 4.43Å; I917-L921 VanDerWaalsContact O-CG 3.29Å; I917-L921 WeakPolarHBondContact O-CG 3.45Å; I917-L921 PolarHBondContact O-N 3.31Å; I917-V966 HydrophobicContact CG2-CG2 3.62Å
918M89.1Confident87.1Confident0 Ų030.8 Ų30.80%015%0.153CC..Hα-helixtrans-64-41.4178.5-71.2-61.1-57.300112L914 L915 L916 L921 T922 V966 M970 L980 Q983 Y984 L987L914-M918 WeakPolarHBondContact O-CB 3.5Å; L914-M918 WeakPolarHBondContact O-CG 3.49Å; L914-M918 PolarHBondContact O-N 3.42Å; L915-M918 WeakPolarHBondContact O-CB 3.41Å; L915-M918 PolarHBondContact O-N 3.4Å; L916-M918 VanDerWaalsContact C-N 3.31Å; L916-M918 PolarHBondContact O-N 2.89Å; M918-L921 PolarHBondContact O-N 2.99Å; M918-T922 WeakPolarHBondContact O-CB 3.34Å; M918-T922 PolarHBondContact O-N 2.91Å; M918-T922 PolarHBondContact O-OG1 3.09Å; M918-V966 HydrophobicContact SD-CB 4.43Å; M918-V966 HydrophobicContact SD-CG1 3.83Å; M918-V966 HydrophobicContact SD-CG2 4.14Å; M918-M970 HydrophobicContact CG-CE 4.38Å; M918-M970 HydrophobicContact SD-CE 4.46Å; M918-L980 HydrophobicContact CG-CD1 4.37Å; M918-Q983 HydrophobicContact CB-CB 4.33Å; M918-Q983 WeakPolarHBondContact CE-O 3.49Å; M918-Y984 HydrophobicContact CE-CD2 4.38Å; M918-L987 HydrophobicContact CE-CB 3.3Å; M918-L987 HydrophobicContact CE-CD2 3.23Å; M918-L987 HydrophobicContact CE-CG 3.86Å; M918-L987 HydrophobicContact SD-CD2 3.64Å
919E90.8Very high86.5Confident77 Ų7732.7 Ų32.736%0.3616%0.16SC..Hα-helixtrans-63.7-44.1173.5-175.9172.9177.600111.8V863 L915 L916 L921 T922 N923V863-E919 HydrophobicContact CG1-CB 4.48Å; V863-E919 HydrophobicContact CG1-CG 3.86Å; L915-E919 PolarHBondContact O-N 3.29Å; L916-E919 PolarHBondContact O-N 3.2Å; E919-L921 PolarHBondContact O-N 3.08Å; E919-T922 WeakPolarHBondContact O-CB 3.48Å; E919-T922 PolarHBondContact O-N 3.27Å; E919-N923 WeakPolarHBondContact CG-ND2 3.42Å; E919-N923 WeakPolarHBondContact O-CB 3.42Å; E919-N923 PolarHBondContact O-N 3.39Å; E919-N923 PolarHBondContact O-ND2 2.86Å
920L93.2Very high85.9Confident0 Ų033.8 Ų33.80%017%0.165CC..Hα-helixtrans-55.4-51.8174.4177.660.1000110.8F862 V863 A866 C885 L916 I917 T922 N923 L924F862-L920 HydrophobicContact CB-CD1 4.26Å; F862-L920 HydrophobicContact CB-CD2 4.21Å; V863-L920 HydrophobicContact CG2-CB 3.8Å; A866-L920 HydrophobicContact CB-CD1 3.62Å; C885-L920 HydrophobicContact CB-CD2 4.46Å; L916-L920 WeakPolarHBondContact O-CB 3.31Å; L916-L920 PolarHBondContact O-N 3.14Å; I917-L920 WeakPolarHBondContact O-CB 3.38Å; I917-L920 PolarHBondContact O-N 3.32Å; L920-T922 VanDerWaalsContact C-N 3.27Å; L920-T922 PolarHBondContact O-N 3.49Å; L920-N923 PolarHBondContact O-N 3.13Å; L920-L924 HydrophobicContact CD1-CG 4.3Å; L920-L924 HydrophobicContact CG-CD1 4.4Å; L920-L924 VanDerWaalsContact O-CG 3.3Å; L920-L924 WeakPolarHBondContact O-CG 3.32Å; L920-L924 PolarHBondContact O-N 3.4Å
921L90.6Very high85.6Confident0 Ų034.8 Ų34.80%017%0.172CC..Hα-helixtrans-61.1-37.6-179.9-65.8-177.3000112.1L889 I917 M918 E919 L924 L925 V959 V963 L987L889-L921 HydrophobicContact CD1-CD2 3.8Å; I917-L921 HydrophobicContact CG2-CD1 4.28Å; I917-L921 HydrophobicContact CG2-CG 4.43Å; I917-L921 VanDerWaalsContact O-CG 3.29Å; I917-L921 WeakPolarHBondContact O-CG 3.45Å; I917-L921 PolarHBondContact O-N 3.31Å; M918-L921 PolarHBondContact O-N 2.99Å; E919-L921 PolarHBondContact O-N 3.08Å; L921-L924 HydrophobicContact CD2-CD1 4.44Å; L921-L924 PolarHBondContact O-N 3.16Å; L921-L925 WeakPolarHBondContact O-CG 3.47Å; L921-L925 PolarHBondContact O-N 3.2Å; L921-V959 HydrophobicContact CB-CG2 4.45Å; L921-V959 HydrophobicContact CD2-CG2 4.35Å; L921-V963 HydrophobicContact CD1-CG2 4.48Å; L921-L987 HydrophobicContact CB-CD1 4.11Å; L921-L987 HydrophobicContact CB-CD2 3.84Å; L921-L987 HydrophobicContact CD1-CD2 3.73Å; L921-L987 HydrophobicContact CG-CD2 4.45Å
922T87.2Confident85.3Confident55 Ų5539.6 Ų39.634%0.33719%0.194SC..Hα-helixtrans-65.9-45.8175.6-56.30000111.4M918 E919 L920 L924 L925 S926M918-T922 WeakPolarHBondContact O-CB 3.34Å; M918-T922 PolarHBondContact O-N 2.91Å; M918-T922 PolarHBondContact O-OG1 3.09Å; E919-T922 WeakPolarHBondContact O-CB 3.48Å; E919-T922 PolarHBondContact O-N 3.27Å; L920-T922 VanDerWaalsContact C-N 3.27Å; L920-T922 PolarHBondContact O-N 3.49Å; T922-L924 VanDerWaalsContact C-N 3.32Å; T922-L924 PolarHBondContact O-N 2.6Å; T922-L925 WeakPolarHBondContact O-CB 3.49Å; T922-L925 PolarHBondContact O-N 3.42Å; T922-L925 VanDerWaalsContact O-N 3.16Å; T922-S926 PolarHBondContact O-N 3.07Å; T922-S926 VanDerWaalsContact O-N 3.13Å
923N89.4Confident84.6Confident19 Ų1937.7 Ų37.710%0.10219%0.189CC..Hα-helixtrans-63-36.6175.8-75.3-42.1000111.9A866 H867 E919 L920 L925 S926A866-N923 HydrophobicContact CB-CB 4.09Å; H867-N923 PolarHBondContact ND1-OD1 3.05Å; E919-N923 WeakPolarHBondContact CG-ND2 3.42Å; E919-N923 WeakPolarHBondContact O-CB 3.42Å; E919-N923 PolarHBondContact O-N 3.39Å; E919-N923 PolarHBondContact O-ND2 2.86Å; L920-N923 PolarHBondContact O-N 3.13Å; N923-L925 VanDerWaalsContact C-N 3.29Å; N923-L925 PolarHBondContact O-N 3.36Å; N923-S926 VanDerWaalsContact O-CB 3.24Å; N923-S926 WeakPolarHBondContact O-CB 3.24Å; N923-S926 PolarHBondContact O-N 3.13Å; N923-S926 VanDerWaalsContact O-N 3.09Å; N923-S926 PolarHBondContact O-OG 3.35Å
924L89.3Confident83Confident0 Ų045 Ų450%023%0.228CC..Hα-helixtrans-63.8-34.3174.9-67.7-178.9000112.9A866 I870 L881 Y882 C885 L920 L921 T922 S926 V958 V959A866-L924 HydrophobicContact CB-CD2 4.05Å; I870-L924 HydrophobicContact CD1-CB 4.47Å; I870-L924 HydrophobicContact CD1-CD2 3.59Å; L881-L924 HydrophobicContact CD2-CD2 4.47Å; Y882-L924 HydrophobicContact CD1-CD2 3.95Å; Y882-L924 HydrophobicContact CE1-CB 4.35Å; Y882-L924 HydrophobicContact CE1-CD2 3.94Å; C885-L924 HydrophobicContact CB-CD1 3.89Å; L920-L924 HydrophobicContact CD1-CG 4.3Å; L920-L924 HydrophobicContact CG-CD1 4.4Å; L920-L924 VanDerWaalsContact O-CG 3.3Å; L920-L924 WeakPolarHBondContact O-CG 3.32Å; L920-L924 PolarHBondContact O-N 3.4Å; L921-L924 HydrophobicContact CD2-CD1 4.44Å; L921-L924 PolarHBondContact O-N 3.16Å; T922-L924 VanDerWaalsContact C-N 3.32Å; T922-L924 PolarHBondContact O-N 2.6Å; L924-S926 VanDerWaalsContact C-N 3.29Å; L924-V958 HydrophobicContact CD1-CB 4.43Å; L924-V958 HydrophobicContact CD1-CG1 3.71Å; L924-V959 HydrophobicContact CB-CG2 4.47Å
925L83.6Confident81.1Confident2 Ų250.7 Ų50.71%0.0126%0.258CS..Hα-helixtrans-74.3-20.5174.2-71.6171.1000113.2L921 T922 N923 K927 E928 V959 L987 F990 I991 F995L921-L925 WeakPolarHBondContact O-CG 3.47Å; L921-L925 PolarHBondContact O-N 3.2Å; T922-L925 WeakPolarHBondContact O-CB 3.49Å; T922-L925 PolarHBondContact O-N 3.42Å; T922-L925 VanDerWaalsContact O-N 3.16Å; N923-L925 VanDerWaalsContact C-N 3.29Å; N923-L925 PolarHBondContact O-N 3.36Å; L925-K927 PolarHBondContact O-N 2.89Å; L925-K927 VanDerWaalsContact O-N 3.12Å; L925-E928 PolarHBondContact O-N 3.45Å; L925-E928 VanDerWaalsContact O-N 3.08Å; L925-V959 HydrophobicContact CD1-CB 4.46Å; L925-V959 HydrophobicContact CD1-CG1 3.77Å; L925-V959 HydrophobicContact CD1-CG2 4.04Å; L925-V959 HydrophobicContact CD2-CB 4.2Å; L925-V959 HydrophobicContact CD2-CG1 4.26Å; L925-V959 HydrophobicContact CD2-CG2 3.67Å; L925-V959 HydrophobicContact CG-CB 4.37Å; L925-V959 HydrophobicContact CG-CG1 4.21Å; L925-V959 HydrophobicContact CG-CG2 3.56Å; L925-L987 HydrophobicContact CD1-CD1 3.63Å; L925-F990 HydrophobicContact CB-CD1 4.28Å; L925-F990 HydrophobicContact CB-CE1 3.55Å; L925-F990 HydrophobicContact CB-CZ 4.2Å; L925-F990 HydrophobicContact CD1-CD1 3.38Å; L925-F990 HydrophobicContact CD1-CE1 3.53Å; L925-F990 HydrophobicContact CD2-CE1 4.19Å; L925-F990 HydrophobicContact CG-CD1 4.27Å; L925-F990 HydrophobicContact CG-CE1 3.92Å; L925-I991 HydrophobicContact CD1-CG1 4.37Å; L925-F995 HydrophobicContact CD2-CE2 3.99Å
926S82.3Confident78.6Confident18 Ų1854.5 Ų54.513%0.12628%0.279CS..Hα-helixtrans-54.8-34.5-176.774.80000113.8I870 T922 N923 L924 E928 F929 I930I870-S926 WeakPolarHBondContact CG2-OG 3.47Å; T922-S926 PolarHBondContact O-N 3.07Å; T922-S926 VanDerWaalsContact O-N 3.13Å; N923-S926 VanDerWaalsContact O-CB 3.24Å; N923-S926 WeakPolarHBondContact O-CB 3.24Å; N923-S926 PolarHBondContact O-N 3.13Å; N923-S926 VanDerWaalsContact O-N 3.09Å; N923-S926 PolarHBondContact O-OG 3.35Å; L924-S926 VanDerWaalsContact C-N 3.29Å; S926-E928 PolarHBondContact O-N 3.35Å; S926-F929 WeakPolarHBondContact O-CD1 3.45Å; S926-F929 PolarHBondContact O-N 2.9Å; S926-I930 PolarHBondContact O-N 2.95Å
927K81.9Confident76Confident15 Ų1561.1 Ų61.17%0.06531%0.309CS..THydrogen-bonded Turntrans-62.5-26.9-179.1179.8162.1177.2158.50114I870 L873 S878 L925 F929 D931I870-K927 HydrophobicContact CD1-CB 4.38Å; I870-K927 HydrophobicContact CG1-CB 4.15Å; I870-K927 HydrophobicContact CG1-CD 4.13Å; L873-K927 PolarHBondContact O-NZ 2.9Å; S878-K927 PolarHBondContact OG-NZ 3.47Å; L925-K927 PolarHBondContact O-N 2.89Å; L925-K927 VanDerWaalsContact O-N 3.12Å; K927-F929 PolarHBondContact O-N 3.33Å; K927-D931 WeakPolarHBondContact CE-OD2 3.29Å
928E74.6Confident73.4Confident105 Ų10566.6 Ų66.649%0.49134%0.343SS..THydrogen-bonded Turntrans-70.8-17.4-179.2-64.3-70.9157.400112.5L925 S926 F995L925-E928 PolarHBondContact O-N 3.45Å; L925-E928 VanDerWaalsContact O-N 3.08Å; S926-E928 PolarHBondContact O-N 3.35Å; E928-F995 HydrophobicContact CG-CZ 4.01Å
929F68.8Low71Confident119 Ų11974.3 Ų74.352%0.52238%0.376SS..THydrogen-bonded Turntrans-121.2-25.7177.860.6-91.3000114.2S926 K927 F990S926-F929 WeakPolarHBondContact O-CD1 3.45Å; S926-F929 PolarHBondContact O-N 2.9Å; K927-F929 PolarHBondContact O-N 3.33Å; F929-F990 HydrophobicContact CD1-CE2 4.49Å; F929-F990 AromaticContact CD1-CZ 3.94Å; F929-F990 HydrophobicContact CD1-CZ 3.94Å; F929-F990 HydrophobicContact CE1-CE2 4.11Å; F929-F990 AromaticContact CE1-CZ 3.68Å; F929-F990 HydrophobicContact CE1-CZ 3.68Å
930I68.9Low68.4Low70 Ų7079.5 Ų79.536%0.35939%0.393SS..  trans-119.492.5173-62.9162.9000108.6C871 S926 F932C871-I930 HydrophobicContact CB-CG2 4.12Å; C871-I930 WeakPolarHBondContact CB-O 3.3Å; S926-I930 PolarHBondContact O-N 2.95Å; I930-F932 HydrophobicContact CG2-CD2 3.69Å; I930-F932 HydrophobicContact CG2-CE1 4.42Å; I930-F932 HydrophobicContact CG2-CE2 3.19Å; I930-F932 HydrophobicContact CG2-CG 4.48Å; I930-F932 HydrophobicContact CG2-CZ 3.61Å
931D78.9Confident65.5Low81 Ų8187 Ų8743%0.43343%0.433SS..  trans-115105.8172.7-162.5-13.7000109.8K927 S933K927-D931 WeakPolarHBondContact CE-OD2 3.29Å; D931-S933 WeakPolarHBondContact OD1-CB 3.37Å; D931-S933 PolarHBondContact OD1-N 3.23Å; D931-S933 PolarHBondContact OD1-OG 2.95Å; D931-S933 PolarHBondContact OD2-OG 3.43Å
932F79.6Confident62.9Low127 Ų12795.2 Ų95.256%0.55747%0.471SS*.  trans-96.89.3173.6-62.2-58.1000111.9C871 Y872 I930 D934C871-F932 HydrophobicContact CB-CD2 4.13Å; C871-F932 CarbonylContact O-C 3.55Å; C871-F932 WeakPolarHBondContact O-CA 3.39Å; C871-F932 PolarHBondContact O-N 3.38Å; Y872-F932 HydrophobicContact CD1-CB 3.75Å; Y872-F932 HydrophobicContact CD1-CD2 4.24Å; Y872-F932 HydrophobicContact CD1-CG 4.42Å; Y872-F932 HydrophobicContact CE1-CB 3.97Å; Y872-F932 AromaticContact CE1-CD2 3.74Å; Y872-F932 HydrophobicContact CE1-CD2 3.74Å; Y872-F932 HydrophobicContact CE1-CG 4.16Å; I930-F932 HydrophobicContact CG2-CD2 3.69Å; I930-F932 HydrophobicContact CG2-CE1 4.42Å; I930-F932 HydrophobicContact CG2-CE2 3.19Å; I930-F932 HydrophobicContact CG2-CG 4.48Å; I930-F932 HydrophobicContact CG2-CZ 3.61Å; F932-D934 VanDerWaalsContact C-N 3.33Å; F932-D934 PolarHBondContact O-N 3.5Å
933S75.3Confident60.3Low34 Ų34101.2 Ų101.224%0.23850%0.495CS..  trans-71.193.1171.270.20000109C871 L873 D931 N935C871-S933 PolarHBondContact O-N 3.47Å; L873-S933 WeakPolarHBondContact O-CB 3.4Å; D931-S933 WeakPolarHBondContact OD1-CB 3.37Å; D931-S933 PolarHBondContact OD1-N 3.23Å; D931-S933 PolarHBondContact OD1-OG 2.95Å; D931-S933 PolarHBondContact OD2-OG 3.43Å; S933-N935 PolarHBondContact O-N 2.78Å
934D55.3Low57.8Low160 Ų160110 Ų11086%0.85654%0.535SS*.  trans-58.8135.3-178.9-108.1-24.8000111.2F932 D936F932-D934 VanDerWaalsContact C-N 3.33Å; F932-D934 PolarHBondContact O-N 3.5Å; D934-D936 PolarHBondContact O-N 3.42Å
935N49.8Very low55.2Low120 Ų120113.2 Ų113.264%0.64257%0.569SS**  trans-59.598.3168.7-79.2-77.1000109.1S933 E937S933-N935 PolarHBondContact O-N 2.78Å; N935-E937 VanDerWaalsContact C-N 3.28Å; N935-E937 PolarHBondContact O-N 2.89Å
936D37Very low52.6Low117 Ų117119 Ų11963%0.62661%0.605SS**  trans-64.391.7162.8-120-15000108.4D934 V938 F939D934-D936 PolarHBondContact O-N 3.42Å; D936-V938 PolarHBondContact O-N 3.22Å; D936-F939 PolarHBondContact O-N 2.95Å
937E37.1Very low50.3Low163 Ų163123.2 Ų123.276%0.76263%0.631SS**THydrogen-bonded Turntrans-58-5.9174.3-74.2-160.114500113.1N935N935-E937 VanDerWaalsContact C-N 3.28Å; N935-E937 PolarHBondContact O-N 2.89Å
938V39.2Very low48.1Very low117 Ų117127.2 Ų127.271%0.70967%0.667SS**THydrogen-bonded Turntrans-78.1-18.1179.1-173.40000113.1D936D936-V938 PolarHBondContact O-N 3.22Å
939F39.2Very low46.1Very low162 Ų162127.2 Ų127.271%0.71168%0.679SS**SBendtrans-106.8-0.4-177.6-80.5-82.6000116.3D936 N941D936-F939 PolarHBondContact O-N 2.95Å; F939-N941 PolarHBondContact O-N 2.95Å
940R35.4Very low44.6Very low186 Ų186126.5 Ų126.570%0.70269%0.689SS**THydrogen-bonded Turntrans-70-8.7177.1-89.8-171.3-178.2175.45.2115.6
941N32.2Very low43.7Very low157 Ų157132.5 Ų132.584%0.8471%0.707SS**THydrogen-bonded Turntrans-99.73.6-176.3-78-23.1000115.8F939F939-N941 PolarHBondContact O-N 2.95Å
942Q34.9Very low42.8Very low173 Ų173133.7 Ų133.781%0.80872%0.717SS**SBendtrans-14273.3171.4-70.6-1735.900111.4
943E33.1Very low42.2Very low180 Ų180128.6 Ų128.684%0.84170%0.697SS**  trans178.867.1139.1-97.5174.2-162.900109G945E943-G945 PolarHBondContact O-N 3.02Å
944Q36.4Very low42.3Very low203 Ų203128.6 Ų128.695%0.94970%0.696SS**  trans-74.1101.4155-79.2-175.7-3.700107.7
945G35.8Very low43.3Very low68 Ų68121 Ų12170%0.70166%0.656SS**  trans144.863.1159.400000117.4E943E943-G945 PolarHBondContact O-N 3.02Å
946T28.6Very low44.5Very low125 Ų125115.4 Ų115.477%0.76763%0.627SS**  trans-151.7133.7146.618.20000109.8
947P33.4Very low46.3Very low105 Ų105113 Ų11368%0.68261%0.614SS**  trans-65.8148.3176.8-8.623.3000110.4S949P947-S949 PolarHBondContact O-N 3.3Å
948A35.9Very low48.4Very low99 Ų99105.2 Ų105.282%0.81858%0.577SS**SBendtrans-66.557.6174.500000113.4
949S34Very low50.5Low105 Ų10599.7 Ų99.773%0.73454%0.544SS*.  trans-11621-179.6650000113.5P947P947-S949 PolarHBondContact O-N 3.3Å
950S36.7Very low52.5Low105 Ų10593 Ų9373%0.73452%0.515SS*.  trans-138.136.9174.575.50000113.8T952S950-T952 PolarHBondContact O-N 3.21Å
951R50.2Low54.6Low196 Ų19688 Ų8874%0.7450%0.497SS*.  trans-79.2108.6163.9-76.4-177.6174.4179.9-4.8107.7
952T59.5Low57Low106 Ų10680.5 Ų80.565%0.6546%0.457SS*.  trans-89.5-29.4-175.440.30000114.4S950S950-T952 PolarHBondContact O-N 3.21Å
953V67.4Low59.1Low20 Ų2072.7 Ų72.712%0.12142%0.421CS..  trans-149.1117.9179.5-177.10000111.1M879 E883 L886 V958M879-V953 WeakPolarHBondContact CE-O 3.29Å; E883-V953 HydrophobicContact CG-CB 4.35Å; E883-V953 HydrophobicContact CG-CG2 4.09Å; L886-V953 HydrophobicContact CD2-CG1 4.21Å; L886-V953 HydrophobicContact CD2-CG2 4.4Å; V953-V958 HydrophobicContact CG1-CG2 3.51Å
954S76.6Confident61.4Low33 Ų3366.8 Ų66.823%0.23140%0.395CS..  trans-100.7165.5172.766.70000113A956 D957 V958 K998S954-A956 VanDerWaalsContact C-N 3.27Å; S954-A956 PolarHBondContact O-N 3.46Å; S954-D957 WeakPolarHBondContact CB-OD2 3.34Å; S954-D957 PolarHBondContact N-OD2 3.19Å; S954-D957 WeakPolarHBondContact O-CA 3.29Å; S954-D957 WeakPolarHBondContact O-CB 3.08Å; S954-D957 PolarHBondContact O-N 2.71Å; S954-D957 PolarHBondContact OG-N 3.41Å; S954-D957 PolarHBondContact OG-OD1 2.86Å; S954-D957 PolarHBondContact OG-OD2 3.4Å; S954-V958 PolarHBondContact O-N 2.88Å; S954-K998 PolarHBondContact OG-NZ 3.26Å; S954-K998 VanDerWaalsContact OG-NZ 3.08Å
955A77.1Confident63.4Low1 Ų157.2 Ų57.21%0.00835%0.35CS..Hα-helixtrans-51.2-48.1175.400000111.8Y882 D957 V958 V959Y882-A955 HydrophobicContact CE1-CB 3.92Å; Y882-A955 HydrophobicContact CE2-CB 4.06Å; A955-D957 VanDerWaalsContact C-N 3.27Å; A955-D957 PolarHBondContact O-N 3.37Å; A955-V958 PolarHBondContact O-N 2.97Å; A955-V959 WeakPolarHBondContact O-CB 3.3Å; A955-V959 WeakPolarHBondContact O-CG2 3.18Å; A955-V959 PolarHBondContact O-N 3.32Å
956A74.4Confident65.4Low3 Ų354 Ų543%0.02532%0.317CS..Hα-helixtrans-60.6-33175.400000113.1S954 L960 F995 K998S954-A956 VanDerWaalsContact C-N 3.27Å; S954-A956 PolarHBondContact O-N 3.46Å; A956-L960 WeakPolarHBondContact O-CB 3.45Å; A956-L960 WeakPolarHBondContact O-CG 3.34Å; A956-L960 PolarHBondContact O-N 3.45Å; A956-F995 HydrophobicContact CB-CD1 4.04Å; A956-F995 HydrophobicContact CB-CD2 3.69Å; A956-F995 HydrophobicContact CB-CE1 3.98Å; A956-F995 HydrophobicContact CB-CE2 3.64Å; A956-F995 HydrophobicContact CB-CG 3.88Å; A956-F995 HydrophobicContact CB-CZ 3.78Å; A956-K998 HydrophobicContact CB-CD 4.03Å
957D75.9Confident67.7Low66 Ų6648.8 Ų48.835%0.35329%0.285SS..Hα-helixtrans-72.2-39.6177.2-54.4-36.4000111.6S954 A955 V959 Y961 K998S954-D957 WeakPolarHBondContact CB-OD2 3.34Å; S954-D957 PolarHBondContact N-OD2 3.19Å; S954-D957 WeakPolarHBondContact O-CA 3.29Å; S954-D957 WeakPolarHBondContact O-CB 3.08Å; S954-D957 PolarHBondContact O-N 2.71Å; S954-D957 PolarHBondContact OG-N 3.41Å; S954-D957 PolarHBondContact OG-OD1 2.86Å; S954-D957 PolarHBondContact OG-OD2 3.4Å; A955-D957 VanDerWaalsContact C-N 3.27Å; A955-D957 PolarHBondContact O-N 3.37Å; D957-V959 VanDerWaalsContact C-N 3.33Å; D957-Y961 WeakPolarHBondContact O-CB 3.35Å; D957-Y961 PolarHBondContact O-N 3.21Å; D957-K998 IonicContact OD1-NZ 3.01Å; D957-K998 PolarHBondContact OD1-NZ 2.92Å; D957-K998 IonicContact OD2-NZ 3.96Å
958V80.4Confident69.8Low0 Ų048.2 Ų48.20%028%0.281CS..Hα-helixtrans-63.2-42.5174.1-1770000110.9Y882 C885 L886 L924 V953 S954 A955 Y961 G962Y882-V958 HydrophobicContact CD1-CG2 4.47Å; Y882-V958 HydrophobicContact CG-CG2 4.22Å; Y882-V958 WeakPolarHBondContact O-CG2 3.19Å; C885-V958 HydrophobicContact CB-CG1 4.25Å; L886-V958 HydrophobicContact CB-CG1 4.26Å; L886-V958 HydrophobicContact CB-CG2 4.29Å; L924-V958 HydrophobicContact CD1-CB 4.43Å; L924-V958 HydrophobicContact CD1-CG1 3.71Å; V953-V958 HydrophobicContact CG1-CG2 3.51Å; S954-V958 PolarHBondContact O-N 2.88Å; A955-V958 PolarHBondContact O-N 2.97Å; V958-Y961 PolarHBondContact O-N 2.99Å; V958-G962 PolarHBondContact O-N 3.35Å
959V82.7Confident71.7Confident1 Ų144.3 Ų44.31%0.00625%0.246CC..Hα-helixtrans-68.1-45.2-178.9169.80000111.5L921 L924 L925 A955 D957 Y961 G962 V963 L987 I991L921-V959 HydrophobicContact CB-CG2 4.45Å; L921-V959 HydrophobicContact CD2-CG2 4.35Å; L924-V959 HydrophobicContact CB-CG2 4.47Å; L925-V959 HydrophobicContact CD1-CB 4.46Å; L925-V959 HydrophobicContact CD1-CG1 3.77Å; L925-V959 HydrophobicContact CD1-CG2 4.04Å; L925-V959 HydrophobicContact CD2-CB 4.2Å; L925-V959 HydrophobicContact CD2-CG1 4.26Å; L925-V959 HydrophobicContact CD2-CG2 3.67Å; L925-V959 HydrophobicContact CG-CB 4.37Å; L925-V959 HydrophobicContact CG-CG1 4.21Å; L925-V959 HydrophobicContact CG-CG2 3.56Å; A955-V959 WeakPolarHBondContact O-CB 3.3Å; A955-V959 WeakPolarHBondContact O-CG2 3.18Å; A955-V959 PolarHBondContact O-N 3.32Å; D957-V959 VanDerWaalsContact C-N 3.33Å; V959-Y961 VanDerWaalsContact C-N 3.26Å; V959-Y961 PolarHBondContact O-N 3.29Å; V959-G962 PolarHBondContact O-N 2.94Å; V959-G962 VanDerWaalsContact O-N 3.16Å; V959-V963 WeakPolarHBondContact O-CG2 3.46Å; V959-V963 PolarHBondContact O-N 3.41Å; V959-L987 HydrophobicContact CG1-CD1 4.24Å; V959-I991 HydrophobicContact CG1-CD1 3.41Å; V959-I991 VanDerWaalsContact CG1-CD1 3.41Å; V959-I991 HydrophobicContact CG1-CG1 3.65Å
960L81.6Confident73.9Confident21 Ų2140.4 Ų40.411%0.1122%0.217CC..Hα-helixtrans-61.5-37.9174.9-72.1173.9000111.8A956 N964 I991 K998 L1002A956-L960 WeakPolarHBondContact O-CB 3.45Å; A956-L960 WeakPolarHBondContact O-CG 3.34Å; A956-L960 PolarHBondContact O-N 3.45Å; L960-N964 WeakPolarHBondContact O-CB 3.14Å; L960-N964 PolarHBondContact O-N 3.39Å; L960-I991 HydrophobicContact CD2-CG2 3.65Å; L960-K998 HydrophobicContact CD1-CB 3.71Å; L960-K998 HydrophobicContact CD1-CD 3.72Å; L960-K998 HydrophobicContact CD1-CG 4.37Å; L960-L1002 HydrophobicContact CB-CD2 4.26Å; L960-L1002 HydrophobicContact CD1-CD2 4.01Å; L960-L1002 HydrophobicContact CD2-CD1 4.49Å; L960-L1002 HydrophobicContact CD2-CD2 3.75Å; L960-L1002 HydrophobicContact CG-CD2 4.21Å
961Y80.3Confident75.9Confident81 Ų8137.8 Ų37.832%0.31820%0.198SC..Hα-helixtrans-68-41.1173.3-168.1-89.6000112.5L886 Q890 D957 V958 V959 N964 I965L886-Y961 HydrophobicContact CD1-CD1 3.2Å; L886-Y961 HydrophobicContact CD1-CD2 4.14Å; L886-Y961 HydrophobicContact CD1-CE1 3.94Å; L886-Y961 HydrophobicContact CD1-CG 3.33Å; L886-Y961 HydrophobicContact CG-CD1 4.47Å; Q890-Y961 HydrophobicContact CB-CE1 4.46Å; Q890-Y961 HydrophobicContact CG-CD1 4.41Å; Q890-Y961 HydrophobicContact CG-CE1 3.35Å; Q890-Y961 WeakPolarHBondContact CG-OH 3.27Å; D957-Y961 WeakPolarHBondContact O-CB 3.35Å; D957-Y961 PolarHBondContact O-N 3.21Å; V958-Y961 PolarHBondContact O-N 2.99Å; V959-Y961 VanDerWaalsContact C-N 3.26Å; V959-Y961 PolarHBondContact O-N 3.29Å; Y961-N964 VanDerWaalsContact O-CB 3.28Å; Y961-N964 WeakPolarHBondContact O-CB 3.37Å; Y961-N964 PolarHBondContact O-N 3.3Å; Y961-N964 VanDerWaalsContact O-N 3.16Å; Y961-I965 HydrophobicContact CD1-CD1 3.68Å; Y961-I965 HydrophobicContact CD1-CG1 4.35Å; Y961-I965 HydrophobicContact CE1-CD1 3.33Å; Y961-I965 HydrophobicContact CE1-CG1 4.04Å; Y961-I965 PolarHBondContact O-N 2.92Å
962G82.2Confident77.3Confident0 Ų034.2 Ų34.20%019%0.19CC..Hα-helixtrans-63.2-43.9176.500000112.2V958 V959 N964 I965 V966V958-G962 PolarHBondContact O-N 3.35Å; V959-G962 PolarHBondContact O-N 2.94Å; V959-G962 VanDerWaalsContact O-N 3.16Å; G962-N964 VanDerWaalsContact C-N 3.28Å; G962-N964 PolarHBondContact O-N 3.07Å; G962-I965 WeakPolarHBondContact O-CA 3.46Å; G962-I965 WeakPolarHBondContact O-CB 3.37Å; G962-I965 PolarHBondContact O-N 2.84Å; G962-V966 WeakPolarHBondContact O-CG2 3.48Å; G962-V966 PolarHBondContact O-N 3.03Å
963V79.6Confident78.4Confident8 Ų833.1 Ų33.15%0.04818%0.18CC..Hα-helixtrans-60.4-40171.7172.70000110.7L921 V959 I965 V966 L967 L987 I991L921-V963 HydrophobicContact CD1-CG2 4.48Å; V959-V963 WeakPolarHBondContact O-CG2 3.46Å; V959-V963 PolarHBondContact O-N 3.41Å; V963-I965 PolarHBondContact O-N 3.04Å; V963-I965 VanDerWaalsContact O-N 3.15Å; V963-V966 PolarHBondContact O-N 2.81Å; V963-L967 HydrophobicContact CG1-CD1 4.28Å; V963-L967 VanDerWaalsContact O-CB 3.29Å; V963-L967 WeakPolarHBondContact O-CB 3.47Å; V963-L967 PolarHBondContact O-N 3.38Å; V963-L987 HydrophobicContact CG2-CD2 3.75Å; V963-L987 HydrophobicContact CG2-CG 4.36Å; V963-I991 HydrophobicContact CG2-CD1 3.49Å; V963-I991 VanDerWaalsContact CG2-CD1 3.49Å
964N81.5Confident79.2Confident56 Ų5632.2 Ų32.230%0.29918%0.175SC..Hα-helixtrans-59.4-25.1174.2-171.349.4000113.8L960 Y961 G962 P968 L1006L960-N964 WeakPolarHBondContact O-CB 3.14Å; L960-N964 PolarHBondContact O-N 3.39Å; Y961-N964 VanDerWaalsContact O-CB 3.28Å; Y961-N964 WeakPolarHBondContact O-CB 3.37Å; Y961-N964 PolarHBondContact O-N 3.3Å; Y961-N964 VanDerWaalsContact O-N 3.16Å; G962-N964 VanDerWaalsContact C-N 3.28Å; G962-N964 PolarHBondContact O-N 3.07Å; N964-P968 WeakPolarHBondContact O-CD 3.41Å; N964-P968 WeakPolarHBondContact O-CG 3.31Å; N964-L1006 HydrophobicContact CB-CD1 4.07Å; N964-L1006 HydrophobicContact CB-CD2 3.68Å; N964-L1006 HydrophobicContact CB-CG 4.48Å
965I76.8Confident79.7Confident2 Ų231.3 Ų31.31%0.0117%0.167CC..Hα-helixtrans-84.5-44.4174.8-67.2169.7000111.2L889 Y961 G962 V963 P968 L969L889-I965 HydrophobicContact CB-CD1 3.55Å; L889-I965 WeakPolarHBondContact O-CD1 3.44Å; Y961-I965 HydrophobicContact CD1-CD1 3.68Å; Y961-I965 HydrophobicContact CD1-CG1 4.35Å; Y961-I965 HydrophobicContact CE1-CD1 3.33Å; Y961-I965 HydrophobicContact CE1-CG1 4.04Å; Y961-I965 PolarHBondContact O-N 2.92Å; G962-I965 WeakPolarHBondContact O-CA 3.46Å; G962-I965 WeakPolarHBondContact O-CB 3.37Å; G962-I965 PolarHBondContact O-N 2.84Å; V963-I965 PolarHBondContact O-N 3.04Å; V963-I965 VanDerWaalsContact O-N 3.15Å; I965-P968 WeakPolarHBondContact O-CD 3.33Å; I965-L969 HydrophobicContact CG2-CD1 4.24Å; I965-L969 WeakPolarHBondContact O-CD1 3.49Å; I965-L969 WeakPolarHBondContact O-CG 3.39Å
966V79.3Confident80.1Confident0 Ų038.2 Ų38.20%020%0.197CC..Hα-helixtrans-68-42.3-177.2171.70000111.1L914 I917 M918 G962 V963 L969 M970 Y984L914-V966 HydrophobicContact CD2-CG1 4.29Å; L914-V966 HydrophobicContact CD2-CG2 4.2Å; I917-V966 HydrophobicContact CG2-CG2 3.62Å; M918-V966 HydrophobicContact SD-CB 4.43Å; M918-V966 HydrophobicContact SD-CG1 3.83Å; M918-V966 HydrophobicContact SD-CG2 4.14Å; G962-V966 WeakPolarHBondContact O-CG2 3.48Å; G962-V966 PolarHBondContact O-N 3.03Å; V963-V966 PolarHBondContact O-N 2.81Å; V966-L969 CarbonylContact O-C 3.44Å; V966-L969 WeakPolarHBondContact O-CA 3.41Å; V966-L969 WeakPolarHBondContact O-CB 3.49Å; V966-L969 PolarHBondContact O-N 3.16Å; V966-M970 HydrophobicContact CG1-CE 3.28Å; V966-M970 HydrophobicContact CG1-CG 3.62Å; V966-M970 HydrophobicContact CG1-SD 4.28Å; V966-M970 WeakPolarHBondContact O-CG 3.39Å; V966-M970 PolarHBondContact O-N 2.77Å; V966-Y984 HydrophobicContact CG1-CD2 4.39Å
967L76.7Confident80.7Confident17 Ų1740.7 Ų40.79%0.08921%0.207CC..Hα-helixtrans-59.3-45.7-171.4-137.4170.7000113.4V963 L969 M970 Y984 L1006 S1009 L1010V963-L967 HydrophobicContact CG1-CD1 4.28Å; V963-L967 VanDerWaalsContact O-CB 3.29Å; V963-L967 WeakPolarHBondContact O-CB 3.47Å; V963-L967 PolarHBondContact O-N 3.38Å; L967-L969 PolarHBondContact O-N 3.03Å; L967-M970 PolarHBondContact O-N 3.16Å; L967-Y984 WeakPolarHBondContact CG-OH 3.43Å; L967-L1006 HydrophobicContact CB-CD1 4.35Å; L967-L1006 HydrophobicContact CD1-CD1 3.76Å; L967-S1009 VanDerWaalsContact CD2-CB 3.45Å; L967-L1010 HydrophobicContact CD1-CB 4.42Å
968P76.6Confident81.1Confident93 Ų9342.5 Ų42.560%0.60422%0.223SC*.Hα-helixtrans-64.7-22.6173.8-23.334.9000114.4N964 I965N964-P968 WeakPolarHBondContact O-CD 3.41Å; N964-P968 WeakPolarHBondContact O-CG 3.31Å; I965-P968 WeakPolarHBondContact O-CD 3.33Å
969L76.9Confident81.4Confident17 Ų1745.7 Ų45.79%0.08925%0.245CC..Hα-helixtrans-88.3-20.2179.4-60.7176.1000112.3Y892 L914 I965 V966 L967 S971 L974Y892-L969 HydrophobicContact CE1-CD1 3.98Å; L914-L969 HydrophobicContact CD1-CB 4.31Å; L914-L969 HydrophobicContact CD2-CB 4.21Å; L914-L969 HydrophobicContact CD2-CD1 4.07Å; I965-L969 HydrophobicContact CG2-CD1 4.24Å; I965-L969 WeakPolarHBondContact O-CD1 3.49Å; I965-L969 WeakPolarHBondContact O-CG 3.39Å; V966-L969 CarbonylContact O-C 3.44Å; V966-L969 WeakPolarHBondContact O-CA 3.41Å; V966-L969 WeakPolarHBondContact O-CB 3.49Å; V966-L969 PolarHBondContact O-N 3.16Å; L967-L969 PolarHBondContact O-N 3.03Å; L969-S971 PolarHBondContact O-N 3.39Å; L969-L974 VanDerWaalsContact O-CD1 3.24Å; L969-L974 WeakPolarHBondContact O-CD1 3.5Å
970M79.8Confident81.7Confident23 Ų2345.7 Ų45.711%0.11325%0.245CC..  trans-73.190.7177.8-74.1-68.5-177.600111.5L914 M918 V966 L967 L975 L980 Y984L914-M970 HydrophobicContact CD1-CE 4.41Å; L914-M970 HydrophobicContact CD1-SD 4.41Å; M918-M970 HydrophobicContact CG-CE 4.38Å; M918-M970 HydrophobicContact SD-CE 4.46Å; V966-M970 HydrophobicContact CG1-CE 3.28Å; V966-M970 HydrophobicContact CG1-CG 3.62Å; V966-M970 HydrophobicContact CG1-SD 4.28Å; V966-M970 WeakPolarHBondContact O-CG 3.39Å; V966-M970 PolarHBondContact O-N 2.77Å; L967-M970 PolarHBondContact O-N 3.16Å; M970-L975 HydrophobicContact SD-CD2 4.27Å; M970-L980 HydrophobicContact CE-CD1 3.59Å; M970-L980 HydrophobicContact CE-CD2 4.08Å; M970-L980 HydrophobicContact CE-CG 3.81Å; M970-L980 HydrophobicContact SD-CD2 4Å; M970-L980 HydrophobicContact SD-CG 4.18Å; M970-Y984 HydrophobicContact CE-CD2 3.87Å; M970-Y984 HydrophobicContact CE-CG 4.16Å; M970-Y984 HydrophobicContact CG-CD2 4.14Å; M970-Y984 HydrophobicContact CG-CE2 4.17Å; M970-Y984 HydrophobicContact SD-CD2 4.44Å
971S79.5Confident82.1Confident49 Ų4945.1 Ų45.134%0.34324%0.242SC..  trans-76.4161.4171.779.70000111.3L969 D973 L974 L975L969-S971 PolarHBondContact O-N 3.39Å; S971-D973 PolarHBondContact O-N 3.23Å; S971-D973 PolarHBondContact OG-N 3.09Å; S971-L974 PolarHBondContact O-N 3.28Å; S971-L974 PolarHBondContact OG-N 3.33Å; S971-L975 PolarHBondContact O-N 3.28Å; S971-L975 VanDerWaalsContact O-N 3.16Å
972Q79.4Confident82.4Confident122 Ų12243 Ų4357%0.5724%0.237SC*.THydrogen-bonded Turntrans-64.4-24.2172.6-72.3-152.6-16.700113.1
973D81.9Confident82.6Confident82 Ų8246.1 Ų46.144%0.43925%0.251SS..THydrogen-bonded Turntrans-75.2-40.2176.3-64-45.2000110.9E907 S971 L975 K976E907-D973 WeakPolarHBondContact OE1-CB 3.37Å; S971-D973 PolarHBondContact O-N 3.23Å; S971-D973 PolarHBondContact OG-N 3.09Å; D973-L975 VanDerWaalsContact C-N 3.3Å; D973-L975 PolarHBondContact O-N 2.76Å; D973-K976 WeakPolarHBondContact O-CB 3.37Å; D973-K976 PolarHBondContact O-N 3.44Å; D973-K976 WeakPolarHBondContact OD1-CE 3.38Å; D973-K976 IonicContact OD1-NZ 3.46Å; D973-K976 PolarHBondContact OD1-NZ 2.87Å
974L83.9Confident83.1Confident2 Ų245.9 Ų45.91%0.0125%0.25CC..G310 helixtrans-63.6-32.8173.8-75.6170.5000113E907 Q910 L914 L969 S971 K976 F977 L980E907-L974 HydrophobicContact CG-CD2 3.92Å; Q910-L974 HydrophobicContact CG-CD1 4.4Å; L914-L974 HydrophobicContact CD1-CD1 3.86Å; L969-L974 VanDerWaalsContact O-CD1 3.24Å; L969-L974 WeakPolarHBondContact O-CD1 3.5Å; S971-L974 PolarHBondContact O-N 3.28Å; S971-L974 PolarHBondContact OG-N 3.33Å; L974-K976 PolarHBondContact O-N 3.38Å; L974-F977 HydrophobicContact CD2-CD2 4.47Å; L974-F977 HydrophobicContact CD2-CE2 4.38Å; L974-F977 WeakPolarHBondContact O-CB 3.48Å; L974-F977 WeakPolarHBondContact O-CD2 3.45Å; L974-F977 PolarHBondContact O-N 3.37Å; L974-L980 HydrophobicContact CB-CD2 4.06Å; L974-L980 HydrophobicContact CD2-CD2 4.32Å
975L86.5Confident83.5Confident14 Ų1443.2 Ų43.27%0.07324%0.235CC..G310 helixtrans-70.7-8173.7-68.3177.8000113.7M970 S971 D973 F977 C981 Y984 Y985 L1016 M1021M970-L975 HydrophobicContact SD-CD2 4.27Å; S971-L975 PolarHBondContact O-N 3.28Å; S971-L975 VanDerWaalsContact O-N 3.16Å; D973-L975 VanDerWaalsContact C-N 3.3Å; D973-L975 PolarHBondContact O-N 2.76Å; L975-F977 VanDerWaalsContact C-N 3.3Å; L975-C981 HydrophobicContact CD2-CB 4.4Å; L975-C981 WeakPolarHBondContact O-CB 3.38Å; L975-Y984 HydrophobicContact CD2-CD1 3.89Å; L975-Y984 HydrophobicContact CD2-CE1 4.47Å; L975-Y984 HydrophobicContact CD2-CG 4.41Å; L975-Y985 HydrophobicContact CD2-CE2 4.43Å; L975-L1016 HydrophobicContact CD1-CD2 4.08Å; L975-M1021 HydrophobicContact CB-CE 4.23Å; L975-M1021 HydrophobicContact CD1-CE 4.1Å
976K86.1Confident84Confident146 Ų14647.6 Ų47.664%0.63525%0.254SS*.G310 helixtrans-76-20.1170.9-62.9171.1-179.11630112.2D973 L974 P978D973-K976 WeakPolarHBondContact O-CB 3.37Å; D973-K976 PolarHBondContact O-N 3.44Å; D973-K976 WeakPolarHBondContact OD1-CE 3.38Å; D973-K976 IonicContact OD1-NZ 3.46Å; D973-K976 PolarHBondContact OD1-NZ 2.87Å; L974-K976 PolarHBondContact O-N 3.38Å; K976-P978 VanDerWaalsContact O-CD 3.23Å; K976-P978 WeakPolarHBondContact O-CD 3.37Å
977F86.5Confident84.3Confident54 Ų5447.8 Ų47.824%0.23726%0.255CS..SBendtrans-73.9111.8173-67.4-95.7000109E907 Y911 L974 L975 S979 L980 C981E907-F977 HydrophobicContact CG-CE2 4.07Å; E907-F977 HydrophobicContact CG-CZ 4.36Å; Y911-F977 HydrophobicContact CD2-CB 3.74Å; Y911-F977 AromaticContact CD2-CD1 3.96Å; Y911-F977 HydrophobicContact CD2-CD1 3.96Å; Y911-F977 HydrophobicContact CD2-CD2 4.37Å; Y911-F977 AromaticContact CD2-CG 3.78Å; Y911-F977 HydrophobicContact CD2-CG 3.78Å; Y911-F977 HydrophobicContact CE2-CB 3.64Å; Y911-F977 HydrophobicContact CE2-CD1 4.07Å; Y911-F977 HydrophobicContact CE2-CG 4.03Å; Y911-F977 HydrophobicContact CG-CD1 4.23Å; Y911-F977 HydrophobicContact CG-CG 4.37Å; L974-F977 HydrophobicContact CD2-CD2 4.47Å; L974-F977 HydrophobicContact CD2-CE2 4.38Å; L974-F977 WeakPolarHBondContact O-CB 3.48Å; L974-F977 WeakPolarHBondContact O-CD2 3.45Å; L974-F977 PolarHBondContact O-N 3.37Å; L975-F977 VanDerWaalsContact C-N 3.3Å; F977-S979 VanDerWaalsContact C-N 3.33Å; F977-S979 PolarHBondContact O-N 3.02Å; F977-L980 HydrophobicContact CB-CB 4.28Å; F977-L980 PolarHBondContact O-N 3.19Å; F977-C981 WeakPolarHBondContact O-CB 3.4Å; F977-C981 PolarHBondContact O-N 3.03Å
978P85.8Confident84.8Confident105 Ų10547 Ų4768%0.68225%0.251SS*.Hα-helixtrans-60.9-39.4-169.2-25.435.7000113.4K976 N982K976-P978 VanDerWaalsContact O-CD 3.23Å; K976-P978 WeakPolarHBondContact O-CD 3.37Å; P978-N982 VanDerWaalsContact O-CB 3.31Å; P978-N982 WeakPolarHBondContact O-CB 3.2Å; P978-N982 PolarHBondContact O-N 3.17Å
979S86.9Confident85.2Confident67 Ų6742.7 Ų42.747%0.46922%0.223SC..Hα-helixtrans-63.8-48.6-179.8-53.50000112.1F977 N982 Q983F977-S979 VanDerWaalsContact C-N 3.33Å; F977-S979 PolarHBondContact O-N 3.02Å; S979-N982 PolarHBondContact O-N 2.97Å; S979-Q983 WeakPolarHBondContact O-CG 3.19Å; S979-Q983 PolarHBondContact O-N 3.19Å
980L88.2Confident85.5Confident0 Ų044.5 Ų44.50%023%0.23CC..Hα-helixtrans-66-43.2178.2-17965.3000111.4Y911 L914 M918 M970 L974 F977 N982 Q983 Y984Y911-L980 HydrophobicContact CD2-CB 3.69Å; Y911-L980 HydrophobicContact CD2-CD2 3.86Å; Y911-L980 HydrophobicContact CD2-CG 4.32Å; Y911-L980 HydrophobicContact CE2-CB 3.56Å; L914-L980 HydrophobicContact CB-CD1 3.92Å; L914-L980 HydrophobicContact CB-CD2 4.4Å; L914-L980 HydrophobicContact CD1-CD2 4.41Å; M918-L980 HydrophobicContact CG-CD1 4.37Å; M970-L980 HydrophobicContact CE-CD1 3.59Å; M970-L980 HydrophobicContact CE-CD2 4.08Å; M970-L980 HydrophobicContact CE-CG 3.81Å; M970-L980 HydrophobicContact SD-CD2 4Å; M970-L980 HydrophobicContact SD-CG 4.18Å; L974-L980 HydrophobicContact CB-CD2 4.06Å; L974-L980 HydrophobicContact CD2-CD2 4.32Å; F977-L980 HydrophobicContact CB-CB 4.28Å; F977-L980 PolarHBondContact O-N 3.19Å; L980-N982 VanDerWaalsContact C-N 3.35Å; L980-N982 PolarHBondContact O-N 3.36Å; L980-Q983 PolarHBondContact O-N 3.06Å; L980-Y984 WeakPolarHBondContact O-CB 3.28Å; L980-Y984 PolarHBondContact O-N 3.04Å
981C89.4Confident85.8Confident9 Ų943.7 Ų43.76%0.06123%0.227CC..Hα-helixtrans-58-47.9176-171.90000110.9L975 F977 Y984 Y985L975-C981 HydrophobicContact CD2-CB 4.4Å; L975-C981 WeakPolarHBondContact O-CB 3.38Å; F977-C981 WeakPolarHBondContact O-CB 3.4Å; F977-C981 PolarHBondContact O-N 3.03Å; C981-Y984 WeakPolarHBondContact O-CB 3.47Å; C981-Y984 PolarHBondContact O-N 2.99Å; C981-Y985 VanDerWaalsContact O-CD2 3.26Å; C981-Y985 WeakPolarHBondContact O-CD2 3.49Å; C981-Y985 PolarHBondContact O-N 3.09Å
982N87.6Confident86.1Confident38 Ų3841.4 Ų41.420%0.20321%0.21CC..Hα-helixtrans-64-46.4179.6-162.65.9000111.9P978 S979 L980 Y984 Y985 K986P978-N982 VanDerWaalsContact O-CB 3.31Å; P978-N982 WeakPolarHBondContact O-CB 3.2Å; P978-N982 PolarHBondContact O-N 3.17Å; S979-N982 PolarHBondContact O-N 2.97Å; L980-N982 VanDerWaalsContact C-N 3.35Å; L980-N982 PolarHBondContact O-N 3.36Å; N982-Y984 VanDerWaalsContact C-N 3.33Å; N982-Y984 PolarHBondContact O-N 3.15Å; N982-Y985 PolarHBondContact O-N 3.03Å; N982-K986 WeakPolarHBondContact O-CB 3.29Å; N982-K986 VanDerWaalsContact O-CG 3.27Å; N982-K986 WeakPolarHBondContact O-CG 3.49Å; N982-K986 PolarHBondContact O-N 3.48Å; N982-K986 VanDerWaalsContact OD1-CE 3.26Å; N982-K986 WeakPolarHBondContact OD1-CE 3.34Å
983Q86.8Confident86.3Confident65 Ų6539.5 Ų39.530%0.30420%0.202SC..Hα-helixtrans-62.9-39.3176.6-68.5-62.2-12.100112.2L915 M918 S979 L980 L987L915-Q983 HydrophobicContact CD1-CB 4.46Å; L915-Q983 HydrophobicContact CD1-CG 4.03Å; M918-Q983 HydrophobicContact CB-CB 4.33Å; M918-Q983 WeakPolarHBondContact CE-O 3.49Å; S979-Q983 WeakPolarHBondContact O-CG 3.19Å; S979-Q983 PolarHBondContact O-N 3.19Å; L980-Q983 PolarHBondContact O-N 3.06Å; Q983-L987 WeakPolarHBondContact O-CB 3.22Å; Q983-L987 PolarHBondContact O-N 3.3Å
984Y88.8Confident86.3Confident3 Ų338.6 Ų38.61%0.01220%0.196CC..Hα-helixtrans-56.8-54.3173.2177.4-109.5000112.2M918 V966 L967 M970 L975 L980 C981 N982 L987 I988 S1013M918-Y984 HydrophobicContact CE-CD2 4.38Å; V966-Y984 HydrophobicContact CG1-CD2 4.39Å; L967-Y984 WeakPolarHBondContact CG-OH 3.43Å; M970-Y984 HydrophobicContact CE-CD2 3.87Å; M970-Y984 HydrophobicContact CE-CG 4.16Å; M970-Y984 HydrophobicContact CG-CD2 4.14Å; M970-Y984 HydrophobicContact CG-CE2 4.17Å; M970-Y984 HydrophobicContact SD-CD2 4.44Å; L975-Y984 HydrophobicContact CD2-CD1 3.89Å; L975-Y984 HydrophobicContact CD2-CE1 4.47Å; L975-Y984 HydrophobicContact CD2-CG 4.41Å; L980-Y984 WeakPolarHBondContact O-CB 3.28Å; L980-Y984 PolarHBondContact O-N 3.04Å; C981-Y984 WeakPolarHBondContact O-CB 3.47Å; C981-Y984 PolarHBondContact O-N 2.99Å; N982-Y984 VanDerWaalsContact C-N 3.33Å; N982-Y984 PolarHBondContact O-N 3.15Å; Y984-L987 PolarHBondContact O-N 2.67Å; Y984-I988 HydrophobicContact CD1-CD1 4.49Å; Y984-I988 HydrophobicContact CD2-CG2 4.22Å; Y984-I988 HydrophobicContact CE1-CD1 3.98Å; Y984-I988 HydrophobicContact CE1-CG2 4.48Å; Y984-I988 HydrophobicContact CE2-CG2 3.76Å; Y984-I988 WeakPolarHBondContact O-CG2 3.28Å; Y984-I988 PolarHBondContact O-N 2.82Å; Y984-S1013 WeakPolarHBondContact OH-CB 3.29Å; Y984-S1013 PolarHBondContact OH-OG 3.24Å
985Y89.5Confident86.2Confident0 Ų039.7 Ų39.70%020%0.201CC..Hα-helixtrans-69.2-34.9-178-80.9-79.2000112.9L975 C981 N982 I988 T989 S1013 G1017 M1021 V1025 C1029L975-Y985 HydrophobicContact CD2-CE2 4.43Å; C981-Y985 VanDerWaalsContact O-CD2 3.26Å; C981-Y985 WeakPolarHBondContact O-CD2 3.49Å; C981-Y985 PolarHBondContact O-N 3.09Å; N982-Y985 PolarHBondContact O-N 3.03Å; Y985-I988 HydrophobicContact CD1-CD1 3.47Å; Y985-I988 VanDerWaalsContact CD1-CD1 3.47Å; Y985-I988 HydrophobicContact CD1-CG1 4.22Å; Y985-I988 HydrophobicContact CE1-CD1 3.76Å; Y985-I988 HydrophobicContact CG-CD1 4.27Å; Y985-I988 WeakPolarHBondContact O-CG1 3.47Å; Y985-T989 VanDerWaalsContact O-CB 3.24Å; Y985-T989 WeakPolarHBondContact O-CB 3.43Å; Y985-T989 PolarHBondContact O-N 2.76Å; Y985-T989 PolarHBondContact O-OG1 2.7Å; Y985-T989 VanDerWaalsContact O-OG1 3.11Å; Y985-S1013 WeakPolarHBondContact CE1-O 3.29Å; Y985-S1013 PolarHBondContact OH-O 2.87Å; Y985-G1017 WeakPolarHBondContact OH-CA 3.31Å; Y985-G1017 PolarHBondContact OH-N 3.4Å; Y985-M1021 HydrophobicContact CE2-CG 4.25Å; Y985-V1025 HydrophobicContact CD1-CG1 3.58Å; Y985-V1025 HydrophobicContact CD2-CB 4.27Å; Y985-V1025 HydrophobicContact CD2-CG1 3.38Å; Y985-V1025 HydrophobicContact CD2-CG2 3.86Å; Y985-V1025 HydrophobicContact CE1-CG1 3.79Å; Y985-V1025 HydrophobicContact CE2-CG1 3.61Å; Y985-V1025 HydrophobicContact CG-CB 4.3Å; Y985-V1025 HydrophobicContact CG-CG1 3.38Å; Y985-V1025 HydrophobicContact CG-CG2 4.12Å; Y985-C1029 WeakPolarHBondContact CD1-SG 3.45Å; Y985-C1029 WeakPolarHBondContact CE1-SG 3.47Å
986K87.1Confident86.2Confident94 Ų9439.6 Ų39.641%0.40920%0.201SC..Hα-helixtrans-59-48.8171.5-77.6175.6178175.10111.5N982 F990 L1028N982-K986 WeakPolarHBondContact O-CB 3.29Å; N982-K986 VanDerWaalsContact O-CG 3.27Å; N982-K986 WeakPolarHBondContact O-CG 3.49Å; N982-K986 PolarHBondContact O-N 3.48Å; N982-K986 VanDerWaalsContact OD1-CE 3.26Å; N982-K986 WeakPolarHBondContact OD1-CE 3.34Å; K986-F990 WeakPolarHBondContact O-CB 3.41Å; K986-F990 PolarHBondContact O-N 2.78Å; K986-L1028 HydrophobicContact CG-CD1 3.8Å
987L86.9Confident86.1Confident3 Ų336.3 Ų36.32%0.01619%0.188CC..Hα-helixtrans-63.4-48.2-179.7-177.167.6000112M918 L921 L925 V959 V963 Q983 Y984 T989 F990 I991M918-L987 HydrophobicContact CE-CB 3.3Å; M918-L987 HydrophobicContact CE-CD2 3.23Å; M918-L987 HydrophobicContact CE-CG 3.86Å; M918-L987 HydrophobicContact SD-CD2 3.64Å; L921-L987 HydrophobicContact CB-CD1 4.11Å; L921-L987 HydrophobicContact CB-CD2 3.84Å; L921-L987 HydrophobicContact CD1-CD2 3.73Å; L921-L987 HydrophobicContact CG-CD2 4.45Å; L925-L987 HydrophobicContact CD1-CD1 3.63Å; V959-L987 HydrophobicContact CG1-CD1 4.24Å; V963-L987 HydrophobicContact CG2-CD2 3.75Å; V963-L987 HydrophobicContact CG2-CG 4.36Å; Q983-L987 WeakPolarHBondContact O-CB 3.22Å; Q983-L987 PolarHBondContact O-N 3.3Å; Y984-L987 PolarHBondContact O-N 2.67Å; L987-T989 VanDerWaalsContact C-N 3.34Å; L987-T989 PolarHBondContact O-N 2.92Å; L987-F990 PolarHBondContact O-N 3.1Å; L987-I991 HydrophobicContact CD1-CD1 4.37Å; L987-I991 HydrophobicContact CG-CD1 4.01Å; L987-I991 VanDerWaalsContact O-CG1 3.25Å; L987-I991 WeakPolarHBondContact O-CG1 3.46Å; L987-I991 PolarHBondContact O-N 2.89Å
988I86.8Confident86Confident1 Ų135.3 Ų35.31%0.00518%0.184CC..Hα-helixtrans-65.3-40-17871.4-177.9000111.5Y984 Y985 I991 C992 L1010 L1014Y984-I988 HydrophobicContact CD1-CD1 4.49Å; Y984-I988 HydrophobicContact CD2-CG2 4.22Å; Y984-I988 HydrophobicContact CE1-CD1 3.98Å; Y984-I988 HydrophobicContact CE1-CG2 4.48Å; Y984-I988 HydrophobicContact CE2-CG2 3.76Å; Y984-I988 WeakPolarHBondContact O-CG2 3.28Å; Y984-I988 PolarHBondContact O-N 2.82Å; Y985-I988 HydrophobicContact CD1-CD1 3.47Å; Y985-I988 VanDerWaalsContact CD1-CD1 3.47Å; Y985-I988 HydrophobicContact CD1-CG1 4.22Å; Y985-I988 HydrophobicContact CE1-CD1 3.76Å; Y985-I988 HydrophobicContact CG-CD1 4.27Å; Y985-I988 WeakPolarHBondContact O-CG1 3.47Å; I988-I991 PolarHBondContact O-N 3.4Å; I988-C992 PolarHBondContact O-N 3.19Å; I988-C992 PolarHBondContact O-SG 2.83Å; I988-L1010 HydrophobicContact CB-CD1 3.85Å; I988-L1010 HydrophobicContact CD1-CD1 4.47Å; I988-L1010 HydrophobicContact CG2-CD1 4.04Å; I988-L1014 HydrophobicContact CD1-CD2 4.14Å; I988-L1014 HydrophobicContact CG1-CD2 4.48Å
989T85.1Confident86.1Confident3 Ų330.3 Ų30.32%0.01815%0.151CC..Hα-helixtrans-63-45.7176.3-72.20000110.3Y985 L987 I991 C992 E993 L1028 A1032Y985-T989 VanDerWaalsContact O-CB 3.24Å; Y985-T989 WeakPolarHBondContact O-CB 3.43Å; Y985-T989 PolarHBondContact O-N 2.76Å; Y985-T989 PolarHBondContact O-OG1 2.7Å; Y985-T989 VanDerWaalsContact O-OG1 3.11Å; L987-T989 VanDerWaalsContact C-N 3.34Å; L987-T989 PolarHBondContact O-N 2.92Å; T989-I991 VanDerWaalsContact C-N 3.32Å; T989-I991 PolarHBondContact O-N 3.22Å; T989-C992 WeakPolarHBondContact O-CB 3.49Å; T989-C992 PolarHBondContact O-N 3.24Å; T989-C992 VanDerWaalsContact O-N 3.07Å; T989-E993 HydrophobicContact CG2-CG 4.39Å; T989-E993 WeakPolarHBondContact CG2-OE1 3.2Å; T989-E993 WeakPolarHBondContact O-CG 3.16Å; T989-E993 PolarHBondContact O-N 2.91Å; T989-L1028 HydrophobicContact CG2-CB 4.29Å; T989-L1028 HydrophobicContact CG2-CD2 4.22Å; T989-L1028 WeakPolarHBondContact CG2-O 3.23Å; T989-L1028 VanDerWaalsContact OG1-C 3.22Å; T989-L1028 PolarHBondContact OG1-O 3.01Å; T989-A1032 HydrophobicContact CG2-CB 4.06Å
990F83.3Confident86Confident54 Ų5429.2 Ų29.224%0.23714%0.142CC..Hα-helixtrans-59.3-41.2177.9-172.6-85000112.5L925 F929 K986 L987 E993 I994L925-F990 HydrophobicContact CB-CD1 4.28Å; L925-F990 HydrophobicContact CB-CE1 3.55Å; L925-F990 HydrophobicContact CB-CZ 4.2Å; L925-F990 HydrophobicContact CD1-CD1 3.38Å; L925-F990 HydrophobicContact CD1-CE1 3.53Å; L925-F990 HydrophobicContact CD2-CE1 4.19Å; L925-F990 HydrophobicContact CG-CD1 4.27Å; L925-F990 HydrophobicContact CG-CE1 3.92Å; F929-F990 HydrophobicContact CD1-CE2 4.49Å; F929-F990 AromaticContact CD1-CZ 3.94Å; F929-F990 HydrophobicContact CD1-CZ 3.94Å; F929-F990 HydrophobicContact CE1-CE2 4.11Å; F929-F990 AromaticContact CE1-CZ 3.68Å; F929-F990 HydrophobicContact CE1-CZ 3.68Å; K986-F990 WeakPolarHBondContact O-CB 3.41Å; K986-F990 PolarHBondContact O-N 2.78Å; L987-F990 PolarHBondContact O-N 3.1Å; F990-E993 PolarHBondContact O-N 3.14Å; F990-I994 HydrophobicContact CD1-CD1 4.08Å; F990-I994 HydrophobicContact CD1-CG1 4.25Å; F990-I994 HydrophobicContact CD2-CD1 4.33Å; F990-I994 HydrophobicContact CE1-CD1 3.31Å; F990-I994 HydrophobicContact CE1-CG1 3.95Å; F990-I994 HydrophobicContact CE2-CD1 3.64Å; F990-I994 HydrophobicContact CE2-CG1 4.39Å; F990-I994 HydrophobicContact CZ-CD1 3.09Å; F990-I994 HydrophobicContact CZ-CG1 4.07Å; F990-I994 WeakPolarHBondContact O-CG1 3.28Å; F990-I994 PolarHBondContact O-N 3.09Å
991I85Confident85.8Confident7 Ų736.1 Ų36.14%0.03618%0.175CC..Hα-helixtrans-63.9-42.5174.8-64.3162.4000111L925 V959 L960 V963 L987 I988 T989 E993 F995 I999L925-I991 HydrophobicContact CD1-CG1 4.37Å; V959-I991 HydrophobicContact CG1-CD1 3.41Å; V959-I991 VanDerWaalsContact CG1-CD1 3.41Å; V959-I991 HydrophobicContact CG1-CG1 3.65Å; L960-I991 HydrophobicContact CD2-CG2 3.65Å; V963-I991 HydrophobicContact CG2-CD1 3.49Å; V963-I991 VanDerWaalsContact CG2-CD1 3.49Å; L987-I991 HydrophobicContact CD1-CD1 4.37Å; L987-I991 HydrophobicContact CG-CD1 4.01Å; L987-I991 VanDerWaalsContact O-CG1 3.25Å; L987-I991 WeakPolarHBondContact O-CG1 3.46Å; L987-I991 PolarHBondContact O-N 2.89Å; I988-I991 PolarHBondContact O-N 3.4Å; T989-I991 VanDerWaalsContact C-N 3.32Å; T989-I991 PolarHBondContact O-N 3.22Å; I991-E993 VanDerWaalsContact C-N 3.27Å; I991-E993 PolarHBondContact O-N 2.83Å; I991-F995 CarbonylContact O-C 3.12Å; I991-F995 PolarHBondContact O-N 3.29Å; I991-I999 HydrophobicContact CG2-CD1 3.88Å
992C87.5Confident85.5Confident0 Ų036.9 Ų36.90%018%0.178CC..Hα-helixtrans-64.4-32.3177.3-70.10000112.6I988 T989 P996 A1032 P1035 L1036I988-C992 PolarHBondContact O-N 3.19Å; I988-C992 PolarHBondContact O-SG 2.83Å; T989-C992 WeakPolarHBondContact O-CB 3.49Å; T989-C992 PolarHBondContact O-N 3.24Å; T989-C992 VanDerWaalsContact O-N 3.07Å; C992-P996 WeakPolarHBondContact O-CB 3.35Å; C992-A1032 HydrophobicContact CB-CB 3.81Å; C992-P1035 WeakPolarHBondContact O-CB 3.42Å; C992-L1036 HydrophobicContact CB-CD1 4.34Å; C992-L1036 HydrophobicContact CB-CD2 4.28Å; C992-L1036 HydrophobicContact CB-CG 4.24Å
993E83.8Confident85.4Confident83 Ų8339 Ų3939%0.38819%0.193SC..Hα-helixtrans-77.2-46.3178.6-74.2176.1179.300113T989 F990 I991 P1035T989-E993 HydrophobicContact CG2-CG 4.39Å; T989-E993 WeakPolarHBondContact CG2-OE1 3.2Å; T989-E993 WeakPolarHBondContact O-CG 3.16Å; T989-E993 PolarHBondContact O-N 2.91Å; F990-E993 PolarHBondContact O-N 3.14Å; I991-E993 VanDerWaalsContact C-N 3.27Å; I991-E993 PolarHBondContact O-N 2.83Å; E993-P1035 HydrophobicContact CB-CG 4.47Å; E993-P1035 HydrophobicContact CG-CG 4Å
994I81.1Confident85.4Confident63 Ų6342.2 Ų42.232%0.32321%0.209SC..Hα-helixtrans-85.3-38.6-173.2-57-155.2000112.6F990 P996F990-I994 HydrophobicContact CD1-CD1 4.08Å; F990-I994 HydrophobicContact CD1-CG1 4.25Å; F990-I994 HydrophobicContact CD2-CD1 4.33Å; F990-I994 HydrophobicContact CE1-CD1 3.31Å; F990-I994 HydrophobicContact CE1-CG1 3.95Å; F990-I994 HydrophobicContact CE2-CD1 3.64Å; F990-I994 HydrophobicContact CE2-CG1 4.39Å; F990-I994 HydrophobicContact CZ-CD1 3.09Å; F990-I994 HydrophobicContact CZ-CG1 4.07Å; F990-I994 WeakPolarHBondContact O-CG1 3.28Å; F990-I994 PolarHBondContact O-N 3.09Å; I994-P996 WeakPolarHBondContact O-CD 3.41Å
995F82.3Confident85.2Confident24 Ų2448 Ų4811%0.10524%0.239CC..  trans-125.850.8-174.9-57.6-72.1000113.5L925 E928 A956 I991 E997 K998L925-F995 HydrophobicContact CD2-CE2 3.99Å; E928-F995 HydrophobicContact CG-CZ 4.01Å; A956-F995 HydrophobicContact CB-CD1 4.04Å; A956-F995 HydrophobicContact CB-CD2 3.69Å; A956-F995 HydrophobicContact CB-CE1 3.98Å; A956-F995 HydrophobicContact CB-CE2 3.64Å; A956-F995 HydrophobicContact CB-CG 3.88Å; A956-F995 HydrophobicContact CB-CZ 3.78Å; I991-F995 CarbonylContact O-C 3.12Å; I991-F995 PolarHBondContact O-N 3.29Å; F995-E997 PolarHBondContact O-N 3.49Å; F995-E997 VanDerWaalsContact O-N 3.13Å; F995-K998 HydrophobicContact CB-CB 4.44Å; F995-K998 HydrophobicContact CB-CD 4.35Å; F995-K998 HydrophobicContact CB-CG 4.31Å; F995-K998 PolarHBondContact O-N 3.28Å
996P86Confident84.9Confident13 Ų1348.4 Ų48.48%0.08424%0.242CC..G310 helixtrans-59.7-27.7-178.325.8-34.7000112.8C992 I994 K998 I999 P1000 P1035 L1036 Q1039C992-P996 WeakPolarHBondContact O-CB 3.35Å; I994-P996 WeakPolarHBondContact O-CD 3.41Å; P996-K998 VanDerWaalsContact C-N 3.26Å; P996-K998 PolarHBondContact O-N 3.35Å; P996-I999 PolarHBondContact O-N 3.02Å; P996-P1000 VanDerWaalsContact O-CD 3.3Å; P996-P1000 WeakPolarHBondContact O-CD 3.42Å; P996-P1035 HydrophobicContact CB-CB 4.46Å; P996-L1036 HydrophobicContact CB-CD2 4.24Å; P996-Q1039 HydrophobicContact CB-CB 3.93Å; P996-Q1039 HydrophobicContact CB-CG 4.22Å; P996-Q1039 HydrophobicContact CG-CB 4.43Å
997E84.8Confident84.9Confident76 Ų7644.9 Ų44.936%0.35523%0.227SC..G310 helixtrans-68.2-21.2178.570.9-77.7179.800114.2F995 Q1001F995-E997 PolarHBondContact O-N 3.49Å; F995-E997 VanDerWaalsContact O-N 3.13Å; E997-Q1001 PolarHBondContact O-NE2 3.05Å
998K84Confident85Confident34 Ų3449.9 Ų49.915%0.14825%0.248CC..G310 helixtrans-85.9-21177.5-64.3-166.3177.4-165.70112.8S954 A956 D957 L960 F995 P996 Q1001S954-K998 PolarHBondContact OG-NZ 3.26Å; S954-K998 VanDerWaalsContact OG-NZ 3.08Å; A956-K998 HydrophobicContact CB-CD 4.03Å; D957-K998 IonicContact OD1-NZ 3.01Å; D957-K998 PolarHBondContact OD1-NZ 2.92Å; D957-K998 IonicContact OD2-NZ 3.96Å; L960-K998 HydrophobicContact CD1-CB 3.71Å; L960-K998 HydrophobicContact CD1-CD 3.72Å; L960-K998 HydrophobicContact CD1-CG 4.37Å; F995-K998 HydrophobicContact CB-CB 4.44Å; F995-K998 HydrophobicContact CB-CD 4.35Å; F995-K998 HydrophobicContact CB-CG 4.31Å; F995-K998 PolarHBondContact O-N 3.28Å; P996-K998 VanDerWaalsContact C-N 3.26Å; P996-K998 PolarHBondContact O-N 3.35Å; K998-Q1001 WeakPolarHBondContact O-CB 3.41Å; K998-Q1001 PolarHBondContact O-N 3.01Å
999I86.9Confident85Confident0 Ų052.1 Ų52.10%026%0.264CS..G310 helixtrans-60.1-43.8-178.1-57.7-58.7000113.3I991 P996 Q1001 L1002 F1007 L1010 M1011 L1036 L1050I991-I999 HydrophobicContact CG2-CD1 3.88Å; P996-I999 PolarHBondContact O-N 3.02Å; I999-Q1001 PolarHBondContact O-N 2.57Å; I999-L1002 HydrophobicContact CD1-CD1 4.07Å; I999-L1002 HydrophobicContact CG2-CD1 4.37Å; I999-L1002 WeakPolarHBondContact O-CB 3.26Å; I999-L1002 VanDerWaalsContact O-CG 3.27Å; I999-L1002 WeakPolarHBondContact O-CG 3.39Å; I999-L1002 PolarHBondContact O-N 3.3Å; I999-F1007 HydrophobicContact CG2-CD2 4.17Å; I999-F1007 HydrophobicContact CG2-CE2 4.13Å; I999-L1010 HydrophobicContact CD1-CD2 3.86Å; I999-L1010 HydrophobicContact CG2-CD2 4.09Å; I999-M1011 HydrophobicContact CG2-CE 4.21Å; I999-L1036 HydrophobicContact CB-CD2 4.11Å; I999-L1036 HydrophobicContact CG1-CD2 3.87Å; I999-L1036 HydrophobicContact CG2-CD2 4.17Å; I999-L1050 HydrophobicContact CG2-CD1 4.41Å
1000P84.7Confident85.2Confident43 Ų4352.3 Ų52.328%0.27927%0.265SS..G310 helixtrans-65.8-17174.8-21.533.3000114.4P996 L1002 L1050P996-P1000 VanDerWaalsContact O-CD 3.3Å; P996-P1000 WeakPolarHBondContact O-CD 3.42Å; P1000-L1002 VanDerWaalsContact C-N 3.33Å; P1000-L1050 HydrophobicContact CG-CB 4.21Å; P1000-L1050 HydrophobicContact CG-CD2 3.74Å
1001Q84.7Confident85.6Confident146 Ų14650.4 Ų50.468%0.68226%0.257SS*.G310 helixtrans-88.6-4.7-177.2-51.6175.726.500112.1E997 K998 I999E997-Q1001 PolarHBondContact O-NE2 3.05Å; K998-Q1001 WeakPolarHBondContact O-CB 3.41Å; K998-Q1001 PolarHBondContact O-N 3.01Å; I999-Q1001 PolarHBondContact O-N 2.57Å
1002L84.1Confident85.9Confident24 Ų2455.5 Ų55.513%0.12628%0.279CS..SBendtrans-68152180-60.6176.7000111.7L960 I999 P1000 L1006 F1007 L1010L960-L1002 HydrophobicContact CB-CD2 4.26Å; L960-L1002 HydrophobicContact CD1-CD2 4.01Å; L960-L1002 HydrophobicContact CD2-CD1 4.49Å; L960-L1002 HydrophobicContact CD2-CD2 3.75Å; L960-L1002 HydrophobicContact CG-CD2 4.21Å; I999-L1002 HydrophobicContact CD1-CD1 4.07Å; I999-L1002 HydrophobicContact CG2-CD1 4.37Å; I999-L1002 WeakPolarHBondContact O-CB 3.26Å; I999-L1002 VanDerWaalsContact O-CG 3.27Å; I999-L1002 WeakPolarHBondContact O-CG 3.39Å; I999-L1002 PolarHBondContact O-N 3.3Å; P1000-L1002 VanDerWaalsContact C-N 3.33Å; L1002-L1006 HydrophobicContact CB-CD2 4.33Å; L1002-L1006 HydrophobicContact CD1-CD2 4.37Å; L1002-L1006 HydrophobicContact CD1-CG 4.41Å; L1002-L1006 HydrophobicContact CD2-CD2 3.99Å; L1002-L1006 HydrophobicContact CG-CD2 4.44Å; L1002-F1007 HydrophobicContact CB-CB 4.35Å; L1002-L1010 HydrophobicContact CD1-CD2 4.16Å
1003P85.5Confident86Confident82 Ų8255.9 Ų55.953%0.53228%0.282SS..  trans-53.9147.6168.6-23.733.7000111.8D1005 L1006 F1007P1003-D1005 VanDerWaalsContact C-N 3.32Å; P1003-D1005 PolarHBondContact O-N 2.95Å; P1003-L1006 HydrophobicContact CB-CB 4.42Å; P1003-L1006 PolarHBondContact O-N 3.41Å; P1003-L1006 VanDerWaalsContact O-N 3.09Å; P1003-F1007 PolarHBondContact O-N 2.96Å
1004E86.4Confident86.4Confident134 Ų13452 Ų5263%0.62626%0.263SS*.Hα-helixtrans-55.7-43-172.2-171.3-178.8165.900113.4K1008E1004-K1008 HydrophobicContact CG-CD 4.41Å; E1004-K1008 WeakPolarHBondContact O-CG 3.41Å; E1004-K1008 PolarHBondContact O-N 3.34Å; E1004-K1008 VanDerWaalsContact OE1-CE 3.31Å; E1004-K1008 WeakPolarHBondContact OE1-CE 3.22Å; E1004-K1008 IonicContact OE1-NZ 2.84Å; E1004-K1008 PolarHBondContact OE1-NZ 2.78Å
1005D84.2Confident86.9Confident123 Ų12351.6 Ų51.666%0.65826%0.26SS*.Hα-helixtrans-67.9-38.5-179.9-65.9-33.2000112.3P1003 S1009P1003-D1005 VanDerWaalsContact C-N 3.32Å; P1003-D1005 PolarHBondContact O-N 2.95Å; D1005-S1009 WeakPolarHBondContact O-CB 2.95Å; D1005-S1009 PolarHBondContact O-N 3.44Å; D1005-S1009 PolarHBondContact O-OG 2.62Å
1006L82.1Confident87.3Confident10 Ų1051.4 Ų51.45%0.05226%0.26CS..Hα-helixtrans-69.3-44.4178.2-176.860.3000111N964 L967 L1002 P1003 K1008 S1009 L1010N964-L1006 HydrophobicContact CB-CD1 4.07Å; N964-L1006 HydrophobicContact CB-CD2 3.68Å; N964-L1006 HydrophobicContact CB-CG 4.48Å; L967-L1006 HydrophobicContact CB-CD1 4.35Å; L967-L1006 HydrophobicContact CD1-CD1 3.76Å; L1002-L1006 HydrophobicContact CB-CD2 4.33Å; L1002-L1006 HydrophobicContact CD1-CD2 4.37Å; L1002-L1006 HydrophobicContact CD1-CG 4.41Å; L1002-L1006 HydrophobicContact CD2-CD2 3.99Å; L1002-L1006 HydrophobicContact CG-CD2 4.44Å; P1003-L1006 HydrophobicContact CB-CB 4.42Å; P1003-L1006 PolarHBondContact O-N 3.41Å; P1003-L1006 VanDerWaalsContact O-N 3.09Å; L1006-K1008 PolarHBondContact O-N 2.95Å; L1006-S1009 PolarHBondContact O-N 3.32Å; L1006-L1010 WeakPolarHBondContact O-CB 3.14Å; L1006-L1010 PolarHBondContact O-N 3.11Å
1007F88.8Confident87.5Confident20 Ų2050.8 Ų50.89%0.08826%0.256CS..Hα-helixtrans-56.8-50.2174.5176.4-94.4000110.9I999 L1002 P1003 S1009 L1010 M1011 P1049 L1050 A1053I999-F1007 HydrophobicContact CG2-CD2 4.17Å; I999-F1007 HydrophobicContact CG2-CE2 4.13Å; L1002-F1007 HydrophobicContact CB-CB 4.35Å; P1003-F1007 PolarHBondContact O-N 2.96Å; F1007-S1009 VanDerWaalsContact C-N 3.3Å; F1007-S1009 PolarHBondContact O-N 2.91Å; F1007-L1010 PolarHBondContact O-N 3.11Å; F1007-M1011 HydrophobicContact CD1-CG 4.23Å; F1007-M1011 HydrophobicContact CE1-CG 3.75Å; F1007-M1011 HydrophobicContact CE2-CE 4.23Å; F1007-M1011 HydrophobicContact CE2-CG 4.06Å; F1007-M1011 HydrophobicContact CE2-SD 4.07Å; F1007-M1011 HydrophobicContact CZ-CG 3.63Å; F1007-M1011 HydrophobicContact CZ-SD 3.9Å; F1007-M1011 VanDerWaalsContact O-CG 3.28Å; F1007-M1011 WeakPolarHBondContact O-CG 3.17Å; F1007-M1011 PolarHBondContact O-N 3.13Å; F1007-P1049 HydrophobicContact CD1-CB 4.24Å; F1007-P1049 HydrophobicContact CE1-CB 3.8Å; F1007-P1049 HydrophobicContact CZ-CB 4.11Å; F1007-L1050 HydrophobicContact CE2-CB 4.22Å; F1007-L1050 HydrophobicContact CE2-CD1 3.95Å; F1007-L1050 HydrophobicContact CZ-CB 4.29Å; F1007-L1050 HydrophobicContact CZ-CD1 4.24Å; F1007-A1053 HydrophobicContact CE1-CB 4.26Å; F1007-A1053 HydrophobicContact CZ-CB 3.91Å
1008K88.8Confident87.6Confident108 Ų10847.6 Ų47.647%0.4724%0.241SC..Hα-helixtrans-59-41.9177.5-75.5174-174.2164.60112.3E1004 L1006 M1011 F1012E1004-K1008 HydrophobicContact CG-CD 4.41Å; E1004-K1008 WeakPolarHBondContact O-CG 3.41Å; E1004-K1008 PolarHBondContact O-N 3.34Å; E1004-K1008 VanDerWaalsContact OE1-CE 3.31Å; E1004-K1008 WeakPolarHBondContact OE1-CE 3.22Å; E1004-K1008 IonicContact OE1-NZ 2.84Å; E1004-K1008 PolarHBondContact OE1-NZ 2.78Å; L1006-K1008 PolarHBondContact O-N 2.95Å; K1008-M1011 PolarHBondContact O-N 3.31Å; K1008-F1012 WeakPolarHBondContact O-CB 3.45Å; K1008-F1012 PolarHBondContact O-N 3.08Å
1009S87.2Confident87.7Confident47 Ų4749.8 Ų49.833%0.32926%0.258SS..Hα-helixtrans-70.5-36.2-177.8-54.90000112.5L967 D1005 L1006 F1007 F1012 S1013L967-S1009 VanDerWaalsContact CD2-CB 3.45Å; D1005-S1009 WeakPolarHBondContact O-CB 2.95Å; D1005-S1009 PolarHBondContact O-N 3.44Å; D1005-S1009 PolarHBondContact O-OG 2.62Å; L1006-S1009 PolarHBondContact O-N 3.32Å; F1007-S1009 VanDerWaalsContact C-N 3.3Å; F1007-S1009 PolarHBondContact O-N 2.91Å; S1009-F1012 PolarHBondContact O-N 2.86Å; S1009-S1013 WeakPolarHBondContact O-CB 3.46Å; S1009-S1013 PolarHBondContact O-N 2.72Å; S1009-S1013 PolarHBondContact O-OG 3.05Å
1010L88.7Confident87.4Confident8 Ų853.8 Ų53.84%0.04229%0.286CS..Hα-helixtrans-65-47.5172.2-179.465.6000111.1L967 I988 I999 L1002 L1006 F1007 F1012 S1013 L1014L967-L1010 HydrophobicContact CD1-CB 4.42Å; I988-L1010 HydrophobicContact CB-CD1 3.85Å; I988-L1010 HydrophobicContact CD1-CD1 4.47Å; I988-L1010 HydrophobicContact CG2-CD1 4.04Å; I999-L1010 HydrophobicContact CD1-CD2 3.86Å; I999-L1010 HydrophobicContact CG2-CD2 4.09Å; L1002-L1010 HydrophobicContact CD1-CD2 4.16Å; L1006-L1010 WeakPolarHBondContact O-CB 3.14Å; L1006-L1010 PolarHBondContact O-N 3.11Å; F1007-L1010 PolarHBondContact O-N 3.11Å; L1010-F1012 VanDerWaalsContact C-N 3.3Å; L1010-F1012 PolarHBondContact O-N 3.02Å; L1010-S1013 WeakPolarHBondContact O-CB 3.33Å; L1010-S1013 PolarHBondContact O-N 3.24Å; L1010-S1013 VanDerWaalsContact O-N 3.13Å; L1010-L1014 PolarHBondContact O-N 3.38Å
1011M91.9Very high87.4Confident13 Ų1354.3 Ų54.36%0.06429%0.285CS..Hα-helixtrans-61.9-39.8177.2-62.7-59.396.900111.5I999 F1007 K1008 S1013 L1014 E1015 L1036 L1050 A1053 F1057I999-M1011 HydrophobicContact CG2-CE 4.21Å; F1007-M1011 HydrophobicContact CD1-CG 4.23Å; F1007-M1011 HydrophobicContact CE1-CG 3.75Å; F1007-M1011 HydrophobicContact CE2-CE 4.23Å; F1007-M1011 HydrophobicContact CE2-CG 4.06Å; F1007-M1011 HydrophobicContact CE2-SD 4.07Å; F1007-M1011 HydrophobicContact CZ-CG 3.63Å; F1007-M1011 HydrophobicContact CZ-SD 3.9Å; F1007-M1011 VanDerWaalsContact O-CG 3.28Å; F1007-M1011 WeakPolarHBondContact O-CG 3.17Å; F1007-M1011 PolarHBondContact O-N 3.13Å; K1008-M1011 PolarHBondContact O-N 3.31Å; M1011-S1013 VanDerWaalsContact C-N 3.34Å; M1011-L1014 HydrophobicContact CE-CD1 3.93Å; M1011-L1014 PolarHBondContact O-N 3.32Å; M1011-E1015 PolarHBondContact O-N 2.94Å; M1011-L1036 HydrophobicContact CE-CD1 4.41Å; M1011-L1050 HydrophobicContact SD-CD1 4.32Å; M1011-A1053 HydrophobicContact CG-CB 3.95Å; M1011-A1053 HydrophobicContact SD-CB 3.81Å; M1011-F1057 HydrophobicContact CB-CZ 4.16Å; M1011-F1057 WeakPolarHBondContact O-CZ 3.42Å; M1011-F1057 HydrophobicContact SD-CE2 3.65Å; M1011-F1057 HydrophobicContact SD-CZ 4.12Å
1012F90Very high87.3Confident115 Ų11550.4 Ų50.450%0.50427%0.273SS..Hα-helixtrans-64.2-38173.9178.8-102.6000112.3K1008 S1009 L1010 E1015 L1016K1008-F1012 WeakPolarHBondContact O-CB 3.45Å; K1008-F1012 PolarHBondContact O-N 3.08Å; S1009-F1012 PolarHBondContact O-N 2.86Å; L1010-F1012 VanDerWaalsContact C-N 3.3Å; L1010-F1012 PolarHBondContact O-N 3.02Å; F1012-E1015 PolarHBondContact O-N 3.49Å; F1012-L1016 HydrophobicContact CE1-CD2 4.3Å; F1012-L1016 WeakPolarHBondContact O-CB 3.44Å; F1012-L1016 PolarHBondContact O-N 3.24Å
1013S90.1Very high87.2Confident8 Ų851.5 Ų51.56%0.05628%0.283CS..Hα-helixtrans-63.9-44.6176-60.90000111.3Y984 Y985 S1009 L1010 M1011 E1015 L1016 G1017Y984-S1013 WeakPolarHBondContact OH-CB 3.29Å; Y984-S1013 PolarHBondContact OH-OG 3.24Å; Y985-S1013 WeakPolarHBondContact CE1-O 3.29Å; Y985-S1013 PolarHBondContact OH-O 2.87Å; S1009-S1013 WeakPolarHBondContact O-CB 3.46Å; S1009-S1013 PolarHBondContact O-N 2.72Å; S1009-S1013 PolarHBondContact O-OG 3.05Å; L1010-S1013 WeakPolarHBondContact O-CB 3.33Å; L1010-S1013 PolarHBondContact O-N 3.24Å; L1010-S1013 VanDerWaalsContact O-N 3.13Å; M1011-S1013 VanDerWaalsContact C-N 3.34Å; S1013-E1015 VanDerWaalsContact C-N 3.33Å; S1013-E1015 PolarHBondContact O-N 3.25Å; S1013-L1016 PolarHBondContact O-N 3.47Å; S1013-G1017 PolarHBondContact O-N 2.94Å
1014L92.1Very high87.1Confident0 Ų053.5 Ų53.50%029%0.286CS..Hα-helixtrans-60.5-42.7174-65.4176.6000111.6I988 L1010 M1011 M1018 C1029 A1032 L1036 F1057I988-L1014 HydrophobicContact CD1-CD2 4.14Å; I988-L1014 HydrophobicContact CG1-CD2 4.48Å; L1010-L1014 PolarHBondContact O-N 3.38Å; M1011-L1014 HydrophobicContact CE-CD1 3.93Å; M1011-L1014 PolarHBondContact O-N 3.32Å; L1014-M1018 VanDerWaalsContact O-CE 3.29Å; L1014-M1018 WeakPolarHBondContact O-CE 3.22Å; L1014-M1018 VanDerWaalsContact O-CG 3.31Å; L1014-M1018 WeakPolarHBondContact O-CG 3.3Å; L1014-M1018 PolarHBondContact O-N 3.16Å; L1014-M1018 VanDerWaalsContact O-N 3.08Å; L1014-C1029 HydrophobicContact CD2-CB 4.18Å; L1014-A1032 HydrophobicContact CD2-CB 4.13Å; L1014-L1036 HydrophobicContact CD1-CD1 4.08Å; L1014-F1057 HydrophobicContact CB-CE1 4.39Å; L1014-F1057 HydrophobicContact CB-CZ 4.06Å
1015E92.3Very high87.3Confident56 Ų5647.2 Ų47.226%0.26226%0.256SS..Hα-helixtrans-61.1-45.2174.4172.9160.5-15900112.5M1011 F1012 S1013 M1018 T1019 H1056 F1057 L1060M1011-E1015 PolarHBondContact O-N 2.94Å; F1012-E1015 PolarHBondContact O-N 3.49Å; S1013-E1015 VanDerWaalsContact C-N 3.33Å; S1013-E1015 PolarHBondContact O-N 3.25Å; E1015-M1018 PolarHBondContact O-N 3.28Å; E1015-T1019 WeakPolarHBondContact O-CB 3.44Å; E1015-T1019 WeakPolarHBondContact O-CG2 3.35Å; E1015-T1019 PolarHBondContact O-N 3.47Å; E1015-T1019 VanDerWaalsContact O-N 3.11Å; E1015-T1019 PolarHBondContact O-OG1 2.95Å; E1015-H1056 IonicContact OE1-CE1 2.77Å; E1015-H1056 IonicContact OE1-NE2 3.21Å; E1015-H1056 PolarHBondContact OE1-NE2 2.95Å; E1015-H1056 IonicContact OE2-CD2 3.29Å; E1015-H1056 IonicContact OE2-NE2 2.78Å; E1015-H1056 PolarHBondContact OE2-NE2 3.41Å; E1015-F1057 HydrophobicContact CB-CE1 4.12Å; E1015-L1060 HydrophobicContact CB-CD1 4.3Å; E1015-L1060 HydrophobicContact CG-CD1 3.66Å
1016L90.6Very high87.5Confident19 Ų1941.7 Ų41.710%0.09923%0.227CC..Hα-helixtrans-65.5-43.8178.9-176.965.2000111.6L975 F1012 S1013 M1018 T1019 S1020 M1021L975-L1016 HydrophobicContact CD1-CD2 4.08Å; F1012-L1016 HydrophobicContact CE1-CD2 4.3Å; F1012-L1016 WeakPolarHBondContact O-CB 3.44Å; F1012-L1016 PolarHBondContact O-N 3.24Å; S1013-L1016 PolarHBondContact O-N 3.47Å; L1016-M1018 VanDerWaalsContact C-N 3.29Å; L1016-M1018 PolarHBondContact O-N 3.37Å; L1016-T1019 PolarHBondContact O-N 2.89Å; L1016-S1020 PolarHBondContact O-N 3.07Å; L1016-M1021 HydrophobicContact CD1-CE 4.17Å; L1016-M1021 HydrophobicContact CD2-CE 3.66Å; L1016-M1021 HydrophobicContact CG-CE 3.68Å
1017G88.9Confident87.7Confident0 Ų044.4 Ų44.40%024%0.24CC..Hα-helixtrans-60.2-39177.200000112.5Y985 S1013 S1026Y985-G1017 WeakPolarHBondContact OH-CA 3.31Å; Y985-G1017 PolarHBondContact OH-N 3.4Å; S1013-G1017 PolarHBondContact O-N 2.94Å; G1017-S1026 WeakPolarHBondContact O-CA 3.33Å; G1017-S1026 WeakPolarHBondContact O-CB 3.38Å
1018M87.6Confident87.8Confident10 Ų1045 Ų455%0.04924%0.243CC..Hα-helixtrans-72.3-31.1175.7-71.8-174.7-69.300114.3L1014 E1015 L1016 S1026 C1029 L1030 L1033 F1057 L1060 V1061 M1064L1014-M1018 VanDerWaalsContact O-CE 3.29Å; L1014-M1018 WeakPolarHBondContact O-CE 3.22Å; L1014-M1018 VanDerWaalsContact O-CG 3.31Å; L1014-M1018 WeakPolarHBondContact O-CG 3.3Å; L1014-M1018 PolarHBondContact O-N 3.16Å; L1014-M1018 VanDerWaalsContact O-N 3.08Å; E1015-M1018 PolarHBondContact O-N 3.28Å; L1016-M1018 VanDerWaalsContact C-N 3.29Å; L1016-M1018 PolarHBondContact O-N 3.37Å; M1018-S1026 WeakPolarHBondContact CA-OG 3.21Å; M1018-S1026 PolarHBondContact O-OG 2.88Å; M1018-C1029 HydrophobicContact CG-CB 3.57Å; M1018-L1030 HydrophobicContact CG-CG 4.5Å; M1018-L1030 HydrophobicContact SD-CD2 3.91Å; M1018-L1030 HydrophobicContact SD-CG 4.4Å; M1018-L1033 HydrophobicContact CE-CD1 4.13Å; M1018-L1033 HydrophobicContact SD-CD1 3.68Å; M1018-F1057 HydrophobicContact CE-CD1 3.5Å; M1018-F1057 VanDerWaalsContact CE-CD1 3.5Å; M1018-F1057 HydrophobicContact CE-CE1 3.58Å; M1018-F1057 HydrophobicContact CE-CG 4.48Å; M1018-L1060 HydrophobicContact CB-CD2 3.91Å; M1018-L1060 HydrophobicContact CE-CD1 4.34Å; M1018-L1060 HydrophobicContact CE-CD2 3.75Å; M1018-L1060 HydrophobicContact SD-CD2 3.89Å; M1018-V1061 HydrophobicContact SD-CG2 4.41Å; M1018-M1064 HydrophobicContact CB-CE 4.11Å; M1018-M1064 HydrophobicContact CB-SD 3.97Å; M1018-M1064 HydrophobicContact CG-CE 4.23Å; M1018-M1064 HydrophobicContact SD-CE 3.82Å
1019T85.4Confident87.9Confident80 Ų8039.8 Ų39.849%0.49122%0.221SC..Hα-helixtrans-103-23.1-168.153.70000115E1015 L1016 L1060E1015-T1019 WeakPolarHBondContact O-CB 3.44Å; E1015-T1019 WeakPolarHBondContact O-CG2 3.35Å; E1015-T1019 PolarHBondContact O-N 3.47Å; E1015-T1019 VanDerWaalsContact O-N 3.11Å; E1015-T1019 PolarHBondContact O-OG1 2.95Å; L1016-T1019 PolarHBondContact O-N 2.89Å; T1019-L1060 HydrophobicContact CG2-CD1 3.88Å; T1019-L1060 HydrophobicContact CG2-CD2 4.18Å; T1019-L1060 HydrophobicContact CG2-CG 4.23Å
1020S81.9Confident88.1Confident84 Ų8437.6 Ų37.659%0.58721%0.205SC*.Hα-helixtrans-138.3-10-167.2-169.40000115.8L1016L1016-S1020 PolarHBondContact O-N 3.07Å
1021M84.9Confident88.2Confident54 Ų5440.4 Ų40.427%0.26622%0.218SC..SBendtrans-100.2-170.2-174.2-61-61.6165.600112L975 Y985 L1016 V1025L975-M1021 HydrophobicContact CB-CE 4.23Å; L975-M1021 HydrophobicContact CD1-CE 4.1Å; Y985-M1021 HydrophobicContact CE2-CG 4.25Å; L1016-M1021 HydrophobicContact CD1-CE 4.17Å; L1016-M1021 HydrophobicContact CD2-CE 3.66Å; L1016-M1021 HydrophobicContact CG-CE 3.68Å; M1021-V1025 HydrophobicContact CB-CB 3.95Å; M1021-V1025 HydrophobicContact CB-CG1 3.57Å; M1021-V1025 HydrophobicContact CG-CG1 4.17Å
1022S83Confident88.2Confident63 Ų6339.8 Ų39.844%0.44122%0.215SC..  trans-64.9162179.472.20000112.5E1024 V1025 S1026S1022-E1024 VanDerWaalsContact C-N 3.28Å; S1022-E1024 PolarHBondContact O-N 3.09Å; S1022-V1025 PolarHBondContact O-N 3.32Å; S1022-V1025 WeakPolarHBondContact OG-CG2 3.39Å; S1022-V1025 PolarHBondContact OG-N 2.9Å; S1022-S1026 PolarHBondContact O-N 2.89Å
1023S81.6Confident88.3Confident47 Ų4734.3 Ų34.333%0.32919%0.191SC..Hα-helixtrans-60-37.3177.4-168.90000112.4S1026 Q1027 N1071 M1074S1023-S1026 PolarHBondContact O-N 2.95Å; S1023-Q1027 WeakPolarHBondContact O-CB 3.37Å; S1023-Q1027 PolarHBondContact O-N 3.43Å; S1023-N1071 PolarHBondContact OG-ND2 3.28Å; S1023-N1071 VanDerWaalsContact OG-ND2 3.12Å; S1023-M1074 PolarHBondContact OG-SD 3.25Å; S1023-M1074 VanDerWaalsContact OG-SD 3.39Å
1024E83.8Confident88.3Confident125 Ų12534.3 Ų34.358%0.58419%0.191SC*.Hα-helixtrans-64.2-47.5176.7-66.4175.8-17000111.4S1022 S1026 Q1027 L1028S1022-E1024 VanDerWaalsContact C-N 3.28Å; S1022-E1024 PolarHBondContact O-N 3.09Å; E1024-S1026 VanDerWaalsContact C-N 3.33Å; E1024-S1026 PolarHBondContact O-N 2.95Å; E1024-Q1027 WeakPolarHBondContact O-CB 3.43Å; E1024-Q1027 PolarHBondContact O-N 3.23Å; E1024-L1028 WeakPolarHBondContact O-CG 3.46Å; E1024-L1028 PolarHBondContact O-N 3.05Å
1025V89.1Confident88.3Confident1 Ų135.6 Ų35.61%0.00620%0.199CC..Hα-helixtrans-61.2-44.7176.7165.20000110.8Y985 M1021 S1022 Q1027 L1028 C1029Y985-V1025 HydrophobicContact CD1-CG1 3.58Å; Y985-V1025 HydrophobicContact CD2-CB 4.27Å; Y985-V1025 HydrophobicContact CD2-CG1 3.38Å; Y985-V1025 HydrophobicContact CD2-CG2 3.86Å; Y985-V1025 HydrophobicContact CE1-CG1 3.79Å; Y985-V1025 HydrophobicContact CE2-CG1 3.61Å; Y985-V1025 HydrophobicContact CG-CB 4.3Å; Y985-V1025 HydrophobicContact CG-CG1 3.38Å; Y985-V1025 HydrophobicContact CG-CG2 4.12Å; M1021-V1025 HydrophobicContact CB-CB 3.95Å; M1021-V1025 HydrophobicContact CB-CG1 3.57Å; M1021-V1025 HydrophobicContact CG-CG1 4.17Å; S1022-V1025 PolarHBondContact O-N 3.32Å; S1022-V1025 WeakPolarHBondContact OG-CG2 3.39Å; S1022-V1025 PolarHBondContact OG-N 2.9Å; V1025-Q1027 VanDerWaalsContact C-N 3.26Å; V1025-Q1027 PolarHBondContact O-N 3.3Å; V1025-L1028 WeakPolarHBondContact O-CB 3.46Å; V1025-L1028 PolarHBondContact O-N 3Å; V1025-C1029 PolarHBondContact O-N 3.45Å; V1025-C1029 PolarHBondContact O-SG 2.99Å
1026S88.7Confident88.2Confident7 Ų732.9 Ų32.95%0.04919%0.187CC..Hα-helixtrans-64.6-33178.4-174.40000112.2G1017 M1018 S1022 S1023 E1024 L1030 M1074G1017-S1026 WeakPolarHBondContact O-CA 3.33Å; G1017-S1026 WeakPolarHBondContact O-CB 3.38Å; M1018-S1026 WeakPolarHBondContact CA-OG 3.21Å; M1018-S1026 PolarHBondContact O-OG 2.88Å; S1022-S1026 PolarHBondContact O-N 2.89Å; S1023-S1026 PolarHBondContact O-N 2.95Å; E1024-S1026 VanDerWaalsContact C-N 3.33Å; E1024-S1026 PolarHBondContact O-N 2.95Å; S1026-L1030 WeakPolarHBondContact O-CD1 3.4Å; S1026-L1030 VanDerWaalsContact O-CG 3.23Å; S1026-L1030 WeakPolarHBondContact O-CG 3.37Å; S1026-L1030 PolarHBondContact O-N 3.4Å; S1026-L1030 VanDerWaalsContact O-N 3.12Å; S1026-M1074 WeakPolarHBondContact OG-CE 3.46Å
1027Q87.6Confident88.2Confident68 Ų6832 Ų3232%0.31818%0.182SC..Hα-helixtrans-65.1-48.5172.5179.6177.2-14.400111.1S1023 E1024 V1025 C1029 L1030 E1031 M1074 A1077S1023-Q1027 WeakPolarHBondContact O-CB 3.37Å; S1023-Q1027 PolarHBondContact O-N 3.43Å; E1024-Q1027 WeakPolarHBondContact O-CB 3.43Å; E1024-Q1027 PolarHBondContact O-N 3.23Å; V1025-Q1027 VanDerWaalsContact C-N 3.26Å; V1025-Q1027 PolarHBondContact O-N 3.3Å; Q1027-C1029 VanDerWaalsContact C-N 3.28Å; Q1027-C1029 PolarHBondContact O-N 3.26Å; Q1027-L1030 WeakPolarHBondContact O-CB 3.35Å; Q1027-L1030 PolarHBondContact O-N 2.94Å; Q1027-E1031 HydrophobicContact CG-CG 4.43Å; Q1027-E1031 VanDerWaalsContact CG-OE1 3.32Å; Q1027-E1031 WeakPolarHBondContact CG-OE1 3.4Å; Q1027-E1031 PolarHBondContact NE2-OE1 2.97Å; Q1027-E1031 WeakPolarHBondContact O-CG 3.42Å; Q1027-E1031 PolarHBondContact O-N 3.29Å; Q1027-M1074 HydrophobicContact CB-CG 4.47Å; Q1027-A1077 HydrophobicContact CG-CB 4.16Å
1028L88.9Confident88.1Confident31 Ų3135.8 Ų35.816%0.16220%0.2CC..Hα-helixtrans-56-41.5175.9-71.2172.3000112K986 T989 E1024 V1025 E1031 A1032K986-L1028 HydrophobicContact CG-CD1 3.8Å; T989-L1028 HydrophobicContact CG2-CB 4.29Å; T989-L1028 HydrophobicContact CG2-CD2 4.22Å; T989-L1028 WeakPolarHBondContact CG2-O 3.23Å; T989-L1028 VanDerWaalsContact OG1-C 3.22Å; T989-L1028 PolarHBondContact OG1-O 3.01Å; E1024-L1028 WeakPolarHBondContact O-CG 3.46Å; E1024-L1028 PolarHBondContact O-N 3.05Å; V1025-L1028 WeakPolarHBondContact O-CB 3.46Å; V1025-L1028 PolarHBondContact O-N 3Å; L1028-E1031 PolarHBondContact O-N 3.43Å; L1028-A1032 PolarHBondContact O-N 2.91Å
1029C92.4Very high88.1Confident0 Ų036 Ų360%020%0.201CC..Hα-helixtrans-66.8-36.9176.8-65.60000112.8Y985 L1014 M1018 V1025 Q1027 A1032 L1033Y985-C1029 WeakPolarHBondContact CD1-SG 3.45Å; Y985-C1029 WeakPolarHBondContact CE1-SG 3.47Å; L1014-C1029 HydrophobicContact CD2-CB 4.18Å; M1018-C1029 HydrophobicContact CG-CB 3.57Å; V1025-C1029 PolarHBondContact O-N 3.45Å; V1025-C1029 PolarHBondContact O-SG 2.99Å; Q1027-C1029 VanDerWaalsContact C-N 3.28Å; Q1027-C1029 PolarHBondContact O-N 3.26Å; C1029-A1032 PolarHBondContact O-N 3.33Å; C1029-L1033 WeakPolarHBondContact O-CG 3.49Å; C1029-L1033 PolarHBondContact O-N 3.43Å
1030L91.1Very high88.2Confident1 Ų132.6 Ų32.61%0.00518%0.18CC..Hα-helixtrans-68.7-39.9176.6-74.2166.4000111.8M1018 S1026 Q1027 A1032 L1033 V1061 M1064 M1074 A1077 A1078 A1081M1018-L1030 HydrophobicContact CG-CG 4.5Å; M1018-L1030 HydrophobicContact SD-CD2 3.91Å; M1018-L1030 HydrophobicContact SD-CG 4.4Å; S1026-L1030 WeakPolarHBondContact O-CD1 3.4Å; S1026-L1030 VanDerWaalsContact O-CG 3.23Å; S1026-L1030 WeakPolarHBondContact O-CG 3.37Å; S1026-L1030 PolarHBondContact O-N 3.4Å; S1026-L1030 VanDerWaalsContact O-N 3.12Å; Q1027-L1030 WeakPolarHBondContact O-CB 3.35Å; Q1027-L1030 PolarHBondContact O-N 2.94Å; L1030-A1032 VanDerWaalsContact C-N 3.32Å; L1030-L1033 HydrophobicContact CD2-CD1 4.38Å; L1030-L1033 PolarHBondContact O-N 3.35Å; L1030-V1061 HydrophobicContact CD2-CG1 4.5Å; L1030-V1061 HydrophobicContact CD2-CG2 3.98Å; L1030-M1064 HydrophobicContact CD2-CE 3.66Å; L1030-M1064 HydrophobicContact CG-CE 4.43Å; L1030-M1074 HydrophobicContact CD1-CB 4.38Å; L1030-M1074 HydrophobicContact CD1-CE 3.62Å; L1030-A1077 HydrophobicContact CB-CB 3.94Å; L1030-A1078 HydrophobicContact CD1-CB 3.71Å; L1030-A1078 HydrophobicContact CD2-CB 4.18Å; L1030-A1081 HydrophobicContact CD2-CB 4.28Å
1031E90.2Very high88.3Confident66 Ų6630.4 Ų30.431%0.30817%0.167SC..Hα-helixtrans-61.2-42.3174.9-72.1168.717800110.8Q1027 L1028 L1033 S1034 P1035 A1077Q1027-E1031 HydrophobicContact CG-CG 4.43Å; Q1027-E1031 VanDerWaalsContact CG-OE1 3.32Å; Q1027-E1031 WeakPolarHBondContact CG-OE1 3.4Å; Q1027-E1031 PolarHBondContact NE2-OE1 2.97Å; Q1027-E1031 WeakPolarHBondContact O-CG 3.42Å; Q1027-E1031 PolarHBondContact O-N 3.29Å; L1028-E1031 PolarHBondContact O-N 3.43Å; E1031-L1033 VanDerWaalsContact C-N 3.27Å; E1031-L1033 PolarHBondContact O-N 3.02Å; E1031-S1034 PolarHBondContact O-N 3.27Å; E1031-P1035 WeakPolarHBondContact O-CD 3.32Å; E1031-A1077 HydrophobicContact CG-CB 3.87Å
1032A92.1Very high88.3Confident0 Ų034.6 Ų34.60%018%0.184CC..Hα-helixtrans-60.6-28.4175.500000114.5T989 C992 L1014 L1028 C1029 L1030 L1036T989-A1032 HydrophobicContact CG2-CB 4.06Å; C992-A1032 HydrophobicContact CB-CB 3.81Å; L1014-A1032 HydrophobicContact CD2-CB 4.13Å; L1028-A1032 PolarHBondContact O-N 2.91Å; C1029-A1032 PolarHBondContact O-N 3.33Å; L1030-A1032 VanDerWaalsContact C-N 3.32Å; A1032-L1036 WeakPolarHBondContact O-CG 3.36Å
1033L93.3Very high88Confident0 Ų035.6 Ų35.60%018%0.184CC..Hα-helixtrans-71.4-33.2-176.4-74.2176.5000113.4M1018 C1029 L1030 E1031 L1036 A1037 F1057 V1061 A1081 L1085M1018-L1033 HydrophobicContact CE-CD1 4.13Å; M1018-L1033 HydrophobicContact SD-CD1 3.68Å; C1029-L1033 WeakPolarHBondContact O-CG 3.49Å; C1029-L1033 PolarHBondContact O-N 3.43Å; L1030-L1033 HydrophobicContact CD2-CD1 4.38Å; L1030-L1033 PolarHBondContact O-N 3.35Å; E1031-L1033 VanDerWaalsContact C-N 3.27Å; E1031-L1033 PolarHBondContact O-N 3.02Å; L1033-L1036 PolarHBondContact O-N 3.48Å; L1033-A1037 WeakPolarHBondContact O-CB 3.44Å; L1033-A1037 PolarHBondContact O-N 3.25Å; L1033-F1057 HydrophobicContact CD1-CB 4.28Å; L1033-F1057 HydrophobicContact CD1-CG 4.47Å; L1033-F1057 HydrophobicContact CD2-CB 4.1Å; L1033-F1057 HydrophobicContact CD2-CD1 4.32Å; L1033-F1057 HydrophobicContact CD2-CD2 3.43Å; L1033-F1057 VanDerWaalsContact CD2-CD2 3.43Å; L1033-F1057 HydrophobicContact CD2-CE2 3.82Å; L1033-F1057 HydrophobicContact CD2-CG 3.71Å; L1033-F1057 HydrophobicContact CD2-CZ 4.41Å; L1033-V1061 HydrophobicContact CD1-CG2 3.79Å; L1033-A1081 HydrophobicContact CB-CB 4.03Å; L1033-A1081 HydrophobicContact CD1-CB 4.31Å; L1033-L1085 HydrophobicContact CD1-CD1 4.5Å
1034S90.1Very high87.6Confident8 Ų841.3 Ų41.36%0.05621%0.206CC..Hα-helixtrans-64.8-50.5-175.7-66.10000112.2E1031 L1036 A1037 E1038 A1081E1031-S1034 PolarHBondContact O-N 3.27Å; S1034-L1036 VanDerWaalsContact C-N 3.31Å; S1034-L1036 PolarHBondContact O-N 2.92Å; S1034-A1037 PolarHBondContact O-N 3.25Å; S1034-E1038 WeakPolarHBondContact O-CG 3.25Å; S1034-E1038 PolarHBondContact O-N 3.37Å; S1034-A1081 WeakPolarHBondContact OG-CA 3.41Å; S1034-A1081 PolarHBondContact OG-N 3.16Å
1035P90Very high87.2Confident27 Ų2741.7 Ų41.718%0.17521%0.207CC..Hα-helixtrans-58.6-38.6174.2-2433.2000113.6C992 E993 P996 E1031 E1038 Q1039C992-P1035 WeakPolarHBondContact O-CB 3.42Å; E993-P1035 HydrophobicContact CB-CG 4.47Å; E993-P1035 HydrophobicContact CG-CG 4Å; P996-P1035 HydrophobicContact CB-CB 4.46Å; E1031-P1035 WeakPolarHBondContact O-CD 3.32Å; P1035-E1038 PolarHBondContact O-N 2.9Å; P1035-Q1039 WeakPolarHBondContact O-CB 3.33Å; P1035-Q1039 PolarHBondContact O-N 3.4Å
1036L91.2Very high86.5Confident0 Ų048.9 Ų48.90%024%0.239CC..Hα-helixtrans-64.4-43.3177.7-66.9177.3000112.1C992 P996 I999 M1011 L1014 A1032 L1033 S1034 Q1039 C1040 L1050C992-L1036 HydrophobicContact CB-CD1 4.34Å; C992-L1036 HydrophobicContact CB-CD2 4.28Å; C992-L1036 HydrophobicContact CB-CG 4.24Å; P996-L1036 HydrophobicContact CB-CD2 4.24Å; I999-L1036 HydrophobicContact CB-CD2 4.11Å; I999-L1036 HydrophobicContact CG1-CD2 3.87Å; I999-L1036 HydrophobicContact CG2-CD2 4.17Å; M1011-L1036 HydrophobicContact CE-CD1 4.41Å; L1014-L1036 HydrophobicContact CD1-CD1 4.08Å; A1032-L1036 WeakPolarHBondContact O-CG 3.36Å; L1033-L1036 PolarHBondContact O-N 3.48Å; S1034-L1036 VanDerWaalsContact C-N 3.31Å; S1034-L1036 PolarHBondContact O-N 2.92Å; L1036-Q1039 PolarHBondContact O-N 2.9Å; L1036-C1040 PolarHBondContact O-N 3.32Å; L1036-C1040 VanDerWaalsContact O-N 3.11Å; L1036-L1050 HydrophobicContact CB-CD1 4.44Å; L1036-L1050 HydrophobicContact CD2-CD1 4.37Å
1037A89.9Confident85.8Confident0 Ų055.9 Ų55.90%028%0.276CS..Hα-helixtrans-66.2-40.3176.600000111.9L1033 S1034 Q1039 C1040 A1041 L1085L1033-A1037 WeakPolarHBondContact O-CB 3.44Å; L1033-A1037 PolarHBondContact O-N 3.25Å; S1034-A1037 PolarHBondContact O-N 3.25Å; A1037-Q1039 VanDerWaalsContact C-N 3.3Å; A1037-Q1039 PolarHBondContact O-N 3.15Å; A1037-C1040 WeakPolarHBondContact O-CB 3.16Å; A1037-C1040 PolarHBondContact O-N 2.89Å; A1037-A1041 PolarHBondContact O-N 3.13Å; A1037-L1085 HydrophobicContact CB-CD2 4.14Å
1038E87.5Confident85.7Confident79 Ų7953.7 Ų53.737%0.36927%0.268SS..Hα-helixtrans-61.3-38.9174.1-73.2179.6-170.100111.9S1034 P1035 A1041 K1042S1034-E1038 WeakPolarHBondContact O-CG 3.25Å; S1034-E1038 PolarHBondContact O-N 3.37Å; P1035-E1038 PolarHBondContact O-N 2.9Å; E1038-A1041 WeakPolarHBondContact O-CB 3.4Å; E1038-A1041 PolarHBondContact O-N 2.89Å; E1038-K1042 WeakPolarHBondContact O-CG 3.27Å; E1038-K1042 PolarHBondContact O-N 3.05Å
1039Q88.4Confident85.5Confident15 Ų1555.8 Ų55.87%0.0728%0.283CS..Hα-helixtrans-66.3-40.5176.5-176.458.420.800112.6P996 P1035 L1036 A1037 A1041 K1042 N1043P996-Q1039 HydrophobicContact CB-CB 3.93Å; P996-Q1039 HydrophobicContact CB-CG 4.22Å; P996-Q1039 HydrophobicContact CG-CB 4.43Å; P1035-Q1039 WeakPolarHBondContact O-CB 3.33Å; P1035-Q1039 PolarHBondContact O-N 3.4Å; L1036-Q1039 PolarHBondContact O-N 2.9Å; A1037-Q1039 VanDerWaalsContact C-N 3.3Å; A1037-Q1039 PolarHBondContact O-N 3.15Å; Q1039-A1041 VanDerWaalsContact C-N 3.3Å; Q1039-A1041 PolarHBondContact O-N 2.97Å; Q1039-K1042 PolarHBondContact O-N 2.91Å; Q1039-N1043 PolarHBondContact NE2-ND2 3.4Å; Q1039-N1043 PolarHBondContact NE2-OD1 2.98Å; Q1039-N1043 PolarHBondContact O-N 2.94Å; Q1039-N1043 VanDerWaalsContact O-N 3.11Å
1040C87.2Confident85.3Confident8 Ų855.9 Ų55.95%0.05428%0.284CS..Hα-helixtrans-58.6-42.5170.8-79.70000112.1L1036 A1037 K1042 N1043 Q1044 L1050 L1088L1036-C1040 PolarHBondContact O-N 3.32Å; L1036-C1040 VanDerWaalsContact O-N 3.11Å; A1037-C1040 WeakPolarHBondContact O-CB 3.16Å; A1037-C1040 PolarHBondContact O-N 2.89Å; C1040-K1042 VanDerWaalsContact C-N 3.32Å; C1040-K1042 PolarHBondContact O-N 3.42Å; C1040-N1043 PolarHBondContact O-N 3.22Å; C1040-Q1044 PolarHBondContact O-N 3.16Å; C1040-L1050 VanDerWaalsContact SG-CD2 3.52Å; C1040-L1050 WeakPolarHBondContact SG-CG 3.4Å; C1040-L1088 HydrophobicContact CB-CD1 4.09Å; C1040-L1088 HydrophobicContact CB-CD2 3.65Å
1041A84.4Confident85.2Confident38 Ų3857.4 Ų57.431%0.31429%0.29SS..Hα-helixtrans-64.1-36178.900000112.4A1037 E1038 Q1039 L1088 M1129A1037-A1041 PolarHBondContact O-N 3.13Å; E1038-A1041 WeakPolarHBondContact O-CB 3.4Å; E1038-A1041 PolarHBondContact O-N 2.89Å; Q1039-A1041 VanDerWaalsContact C-N 3.3Å; Q1039-A1041 PolarHBondContact O-N 2.97Å; A1041-L1088 HydrophobicContact CB-CD1 4.27Å; A1041-M1129 HydrophobicContact CB-CE 4.29Å
1042K83.1Confident85.1Confident143 Ų14359.4 Ų59.462%0.62230%0.302SS*.Hα-helixtrans-67.2-43175.4-71.3172.7-171.61680112.6E1038 Q1039 C1040E1038-K1042 WeakPolarHBondContact O-CG 3.27Å; E1038-K1042 PolarHBondContact O-N 3.05Å; Q1039-K1042 PolarHBondContact O-N 2.91Å; C1040-K1042 VanDerWaalsContact C-N 3.32Å; C1040-K1042 PolarHBondContact O-N 3.42Å
1043N78.4Confident85Confident84 Ų8460.2 Ų60.245%0.44931%0.308SS..Hα-helixtrans-78.7-21.4-173.8-75.8-2.3000114.2Q1039 C1040 E1045Q1039-N1043 PolarHBondContact NE2-ND2 3.4Å; Q1039-N1043 PolarHBondContact NE2-OD1 2.98Å; Q1039-N1043 PolarHBondContact O-N 2.94Å; Q1039-N1043 VanDerWaalsContact O-N 3.11Å; C1040-N1043 PolarHBondContact O-N 3.22Å; N1043-E1045 PolarHBondContact O-N 3.48Å
1044Q71.5Confident84.9Confident166 Ų16660.2 Ų60.278%0.77631%0.309SS*.  trans57.77.6178.3-57-175.210.700116.5C1040 K1046C1040-Q1044 PolarHBondContact O-N 3.16Å; Q1044-K1046 PolarHBondContact O-N 2.72Å
1045E76.6Confident84.9Confident133 Ų13365.6 Ų65.662%0.62133%0.328SS*.  trans-84102.1176.8-71.1-173.217000112.1N1043 D1047 S1048N1043-E1045 PolarHBondContact O-N 3.48Å; E1045-D1047 VanDerWaalsContact C-N 3.3Å; E1045-D1047 PolarHBondContact O-N 3.1Å; E1045-S1048 PolarHBondContact O-N 3.47Å; E1045-S1048 PolarHBondContact O-OG 2.99Å; E1045-S1048 VanDerWaalsContact O-OG 3.08Å
1046K73.1Confident85Confident152 Ų15268.4 Ų68.466%0.66134%0.338SS*.THydrogen-bonded Turntrans-74.2-12.9-175.7-63-171.7177.6-172.20115.2Q1044 F1051Q1044-K1046 PolarHBondContact O-N 2.72Å; K1046-F1051 HydrophobicContact CB-CE1 4.34Å; K1046-F1051 HydrophobicContact CB-CZ 4.5Å; K1046-F1051 HydrophobicContact CG-CZ 4.4Å; K1046-F1051 WeakPolarHBondContact O-CD1 3.32Å
1047D75.8Confident85.2Confident155 Ų15568.6 Ų68.683%0.82934%0.339SS*.THydrogen-bonded Turntrans-104.16.9179.6-64.3-39000112.9E1045E1045-D1047 VanDerWaalsContact C-N 3.3Å; E1045-D1047 PolarHBondContact O-N 3.1Å
1048S84.1Confident85.3Confident21 Ų2168.6 Ų68.615%0.14734%0.339CS..SBendtrans-69.3145.7179.8650000111.7E1045 L1050 F1051 I1052E1045-S1048 PolarHBondContact O-N 3.47Å; E1045-S1048 PolarHBondContact O-OG 2.99Å; E1045-S1048 VanDerWaalsContact O-OG 3.08Å; S1048-L1050 PolarHBondContact O-N 3.4Å; S1048-F1051 WeakPolarHBondContact O-CB 3.34Å; S1048-F1051 PolarHBondContact O-N 3.44Å; S1048-F1051 WeakPolarHBondContact OG-CB 3.46Å; S1048-F1051 PolarHBondContact OG-N 2.67Å; S1048-I1052 PolarHBondContact O-N 3.39Å
1049P85.5Confident85.5Confident75 Ų7570.1 Ų70.149%0.48735%0.345SS..Hα-helixtrans-54.2-35.8176.3-27.434.8000113.5F1007 I1052 A1053F1007-P1049 HydrophobicContact CD1-CB 4.24Å; F1007-P1049 HydrophobicContact CE1-CB 3.8Å; F1007-P1049 HydrophobicContact CZ-CB 4.11Å; P1049-I1052 PolarHBondContact O-N 2.85Å; P1049-A1053 PolarHBondContact O-N 3.34Å
1050L87.7Confident85.6Confident2 Ų270.1 Ų70.11%0.0135%0.345CS..Hα-helixtrans-66.9-38.1175.8-172.367.2000112.4I999 P1000 F1007 M1011 L1036 C1040 S1048 I1052 A1053 T1054I999-L1050 HydrophobicContact CG2-CD1 4.41Å; P1000-L1050 HydrophobicContact CG-CB 4.21Å; P1000-L1050 HydrophobicContact CG-CD2 3.74Å; F1007-L1050 HydrophobicContact CE2-CB 4.22Å; F1007-L1050 HydrophobicContact CE2-CD1 3.95Å; F1007-L1050 HydrophobicContact CZ-CB 4.29Å; F1007-L1050 HydrophobicContact CZ-CD1 4.24Å; M1011-L1050 HydrophobicContact SD-CD1 4.32Å; L1036-L1050 HydrophobicContact CB-CD1 4.44Å; L1036-L1050 HydrophobicContact CD2-CD1 4.37Å; C1040-L1050 VanDerWaalsContact SG-CD2 3.52Å; C1040-L1050 WeakPolarHBondContact SG-CG 3.4Å; S1048-L1050 PolarHBondContact O-N 3.4Å; L1050-I1052 VanDerWaalsContact C-N 3.3Å; L1050-I1052 PolarHBondContact O-N 2.95Å; L1050-A1053 PolarHBondContact O-N 3.12Å; L1050-T1054 HydrophobicContact CD1-CG2 4.48Å; L1050-T1054 HydrophobicContact CG-CG2 4.46Å; L1050-T1054 WeakPolarHBondContact O-CB 3.42Å; L1050-T1054 WeakPolarHBondContact O-CG2 3.2Å; L1050-T1054 PolarHBondContact O-N 3.34Å; L1050-T1054 PolarHBondContact O-OG1 2.99Å
1051F88.9Confident85.8Confident33 Ų3369.8 Ų69.815%0.14534%0.343CS..Hα-helixtrans-63.4-37.7174.7-171.1-91.4000111.7K1046 S1048 T1054 R1055 L1088 H1089K1046-F1051 HydrophobicContact CB-CE1 4.34Å; K1046-F1051 HydrophobicContact CB-CZ 4.5Å; K1046-F1051 HydrophobicContact CG-CZ 4.4Å; K1046-F1051 WeakPolarHBondContact O-CD1 3.32Å; S1048-F1051 WeakPolarHBondContact O-CB 3.34Å; S1048-F1051 PolarHBondContact O-N 3.44Å; S1048-F1051 WeakPolarHBondContact OG-CB 3.46Å; S1048-F1051 PolarHBondContact OG-N 2.67Å; F1051-T1054 WeakPolarHBondContact CA-OG1 3.42Å; F1051-T1054 PolarHBondContact O-OG1 3.02Å; F1051-R1055 PolarHBondContact O-N 3.17Å; F1051-L1088 HydrophobicContact CD2-CD1 4.27Å; F1051-L1088 HydrophobicContact CD2-CD2 4.29Å; F1051-L1088 HydrophobicContact CD2-CG 4.27Å; F1051-L1088 HydrophobicContact CE2-CD1 3.88Å; F1051-L1088 HydrophobicContact CE2-CD2 4.35Å; F1051-L1088 HydrophobicContact CE2-CG 3.85Å; F1051-H1089 AromaticContact CD1-CE1 3.75Å; F1051-H1089 AromaticContact CD2-CE1 3.77Å; F1051-H1089 AromaticContact CE1-CE1 3.44Å; F1051-H1089 VanDerWaalsContact CE1-CE1 3.44Å; F1051-H1089 WeakPolarHBondContact CE1-CE1 3.23Å; F1051-H1089 AromaticContact CE1-ND1 3.72Å; F1051-H1089 AromaticContact CE2-CE1 3.45Å; F1051-H1089 VanDerWaalsContact CE2-CE1 3.45Å; F1051-H1089 WeakPolarHBondContact CE2-CE1 3.46Å; F1051-H1089 AromaticContact CE2-ND1 3.9Å; F1051-H1089 AromaticContact CG-CE1 3.91Å; F1051-H1089 AromaticContact CZ-CE1 3.27Å; F1051-H1089 WeakPolarHBondContact CZ-CE1 3.41Å; F1051-H1089 AromaticContact CZ-ND1 3.39Å; F1051-H1089 WeakPolarHBondContact CZ-ND1 3.45Å; F1051-H1089 PolarHBondContact O-CE1 3.48Å; F1051-H1089 VanDerWaalsContact O-CE1 3.26Å; F1051-H1089 PolarHBondContact O-NE2 3.16Å
1052I88.8Confident86Confident109 Ų10968.1 Ų68.156%0.55933%0.328SS*.Hα-helixtrans-69.8-43.3176.1-59.8171.1000111.2S1048 P1049 L1050 R1055 H1056S1048-I1052 PolarHBondContact O-N 3.39Å; P1049-I1052 PolarHBondContact O-N 2.85Å; L1050-I1052 VanDerWaalsContact C-N 3.3Å; L1050-I1052 PolarHBondContact O-N 2.95Å; I1052-R1055 WeakPolarHBondContact O-CB 3.48Å; I1052-R1055 PolarHBondContact O-N 3.26Å; I1052-H1056 PolarHBondContact O-N 3.35Å
1053A90Very high86.1Confident16 Ų1663.4 Ų63.413%0.13231%0.31CS..Hα-helixtrans-63.9-44.4178.300000112.1F1007 M1011 P1049 L1050 R1055 H1056 F1057F1007-A1053 HydrophobicContact CE1-CB 4.26Å; F1007-A1053 HydrophobicContact CZ-CB 3.91Å; M1011-A1053 HydrophobicContact CG-CB 3.95Å; M1011-A1053 HydrophobicContact SD-CB 3.81Å; P1049-A1053 PolarHBondContact O-N 3.34Å; L1050-A1053 PolarHBondContact O-N 3.12Å; A1053-R1055 PolarHBondContact O-N 3.12Å; A1053-H1056 WeakPolarHBondContact O-CB 3.49Å; A1053-H1056 PolarHBondContact O-N 2.95Å; A1053-F1057 HydrophobicContact CB-CE2 4.38Å; A1053-F1057 VanDerWaalsContact O-CD2 3.28Å; A1053-F1057 WeakPolarHBondContact O-CD2 3.35Å; A1053-F1057 PolarHBondContact O-N 3.02Å
1054T90.8Very high86.3Confident1 Ų160 Ų601%0.00629%0.292CS..Hα-helixtrans-61.4-31.3175.951.90000112.5L1050 F1051 F1057 L1058 L1085 H1089L1050-T1054 HydrophobicContact CD1-CG2 4.48Å; L1050-T1054 HydrophobicContact CG-CG2 4.46Å; L1050-T1054 WeakPolarHBondContact O-CB 3.42Å; L1050-T1054 WeakPolarHBondContact O-CG2 3.2Å; L1050-T1054 PolarHBondContact O-N 3.34Å; L1050-T1054 PolarHBondContact O-OG1 2.99Å; F1051-T1054 WeakPolarHBondContact CA-OG1 3.42Å; F1051-T1054 PolarHBondContact O-OG1 3.02Å; T1054-F1057 PolarHBondContact O-N 3.45Å; T1054-L1058 PolarHBondContact O-N 3.34Å; T1054-L1085 HydrophobicContact CG2-CD2 4.22Å; T1054-L1085 WeakPolarHBondContact O-CD2 3.19Å; T1054-H1089 PolarHBondContact OG1-NE2 3.23Å
1055R90.5Very high86.5Confident121 Ų12152.5 Ų52.546%0.45726%0.256SS..Hα-helixtrans-63.4-39.5172.3-174.3-178.8171.6161.910.4112.5F1051 I1052 A1053 L1058 H1089 E1092F1051-R1055 PolarHBondContact O-N 3.17Å; I1052-R1055 WeakPolarHBondContact O-CB 3.48Å; I1052-R1055 PolarHBondContact O-N 3.26Å; A1053-R1055 PolarHBondContact O-N 3.12Å; R1055-L1058 PolarHBondContact O-N 3.46Å; R1055-H1089 PolarHBondContact N-NE2 3.32Å; R1055-E1092 HydrophobicContact CG-CG 3.94Å; R1055-E1092 IonicContact CZ-OE1 3.81Å; R1055-E1092 IonicContact NE-OE1 3.27Å; R1055-E1092 PolarHBondContact NE-OE1 3.36Å; R1055-E1092 IonicContact NH1-OE1 2.65Å; R1055-E1092 PolarHBondContact NH1-OE1 3.05Å; R1055-E1092 IonicContact NH2-OE1 3.89Å; R1055-E1092 PolarHBondContact NH2-OE1 2.91Å
1056H92Very high86.6Confident86 Ų8646.4 Ų46.440%0.39823%0.229SC..Hα-helixtrans-65.3-44.6173.6176.166.3000111.3E1015 I1052 A1053 L1058 K1059 L1060E1015-H1056 IonicContact OE1-CE1 2.77Å; E1015-H1056 IonicContact OE1-NE2 3.21Å; E1015-H1056 PolarHBondContact OE1-NE2 2.95Å; E1015-H1056 IonicContact OE2-CD2 3.29Å; E1015-H1056 IonicContact OE2-NE2 2.78Å; E1015-H1056 PolarHBondContact OE2-NE2 3.41Å; I1052-H1056 PolarHBondContact O-N 3.35Å; A1053-H1056 WeakPolarHBondContact O-CB 3.49Å; A1053-H1056 PolarHBondContact O-N 2.95Å; H1056-L1058 VanDerWaalsContact C-N 3.27Å; H1056-L1058 PolarHBondContact O-N 2.84Å; H1056-K1059 WeakPolarHBondContact O-CB 3.39Å; H1056-K1059 PolarHBondContact O-N 3.19Å; H1056-K1059 VanDerWaalsContact O-N 3.09Å; H1056-L1060 PolarHBondContact O-N 3.33Å
1057F94.5Very high86.6Confident3 Ų342.2 Ų42.21%0.01321%0.213CC..Hα-helixtrans-62.4-30.8177.8-66.2-49.8000113.6M1011 L1014 E1015 M1018 L1033 A1053 T1054 K1059 L1060 V1061 L1085M1011-F1057 HydrophobicContact CB-CZ 4.16Å; M1011-F1057 WeakPolarHBondContact O-CZ 3.42Å; M1011-F1057 HydrophobicContact SD-CE2 3.65Å; M1011-F1057 HydrophobicContact SD-CZ 4.12Å; L1014-F1057 HydrophobicContact CB-CE1 4.39Å; L1014-F1057 HydrophobicContact CB-CZ 4.06Å; E1015-F1057 HydrophobicContact CB-CE1 4.12Å; M1018-F1057 HydrophobicContact CE-CD1 3.5Å; M1018-F1057 VanDerWaalsContact CE-CD1 3.5Å; M1018-F1057 HydrophobicContact CE-CE1 3.58Å; M1018-F1057 HydrophobicContact CE-CG 4.48Å; L1033-F1057 HydrophobicContact CD1-CB 4.28Å; L1033-F1057 HydrophobicContact CD1-CG 4.47Å; L1033-F1057 HydrophobicContact CD2-CB 4.1Å; L1033-F1057 HydrophobicContact CD2-CD1 4.32Å; L1033-F1057 HydrophobicContact CD2-CD2 3.43Å; L1033-F1057 VanDerWaalsContact CD2-CD2 3.43Å; L1033-F1057 HydrophobicContact CD2-CE2 3.82Å; L1033-F1057 HydrophobicContact CD2-CG 3.71Å; L1033-F1057 HydrophobicContact CD2-CZ 4.41Å; A1053-F1057 HydrophobicContact CB-CE2 4.38Å; A1053-F1057 VanDerWaalsContact O-CD2 3.28Å; A1053-F1057 WeakPolarHBondContact O-CD2 3.35Å; A1053-F1057 PolarHBondContact O-N 3.02Å; T1054-F1057 PolarHBondContact O-N 3.45Å; F1057-K1059 VanDerWaalsContact C-N 3.28Å; F1057-K1059 PolarHBondContact O-N 3.46Å; F1057-L1060 PolarHBondContact O-N 2.96Å; F1057-V1061 WeakPolarHBondContact O-CB 3.2Å; F1057-V1061 WeakPolarHBondContact O-CG2 3.36Å; F1057-V1061 PolarHBondContact O-N 3.23Å; F1057-L1085 HydrophobicContact CB-CD1 4.15Å
1058L93.6Very high86.3Confident1 Ų139.6 Ų39.61%0.00520%0.196CC..Hα-helixtrans-55.7-46.5172.8173.361.9000111.1T1054 R1055 H1056 F1062 L1082 L1085 V1086 H1089 E1092 L1096T1054-L1058 PolarHBondContact O-N 3.34Å; R1055-L1058 PolarHBondContact O-N 3.46Å; H1056-L1058 VanDerWaalsContact C-N 3.27Å; H1056-L1058 PolarHBondContact O-N 2.84Å; L1058-F1062 WeakPolarHBondContact O-CB 3.34Å; L1058-F1062 PolarHBondContact O-N 3.49Å; L1058-L1082 HydrophobicContact CD1-CD1 3.92Å; L1058-L1085 HydrophobicContact CB-CB 4.22Å; L1058-L1085 HydrophobicContact CD1-CB 3.94Å; L1058-V1086 HydrophobicContact CD1-CG2 3.92Å; L1058-H1089 HydrophobicContact CD2-CB 3.76Å; L1058-E1092 HydrophobicContact CD2-CB 4Å; L1058-L1096 HydrophobicContact CD2-CD1 4.45Å; L1058-L1096 HydrophobicContact CG-CD1 4.22Å
1059K91.1Very high85.3Confident111 Ų11145.6 Ų45.648%0.48322%0.219SC..Hα-helixtrans-65-43.2178.1-176-176.7174.9-171.70111.2H1056 F1057 F1062 D1063 L1096H1056-K1059 WeakPolarHBondContact O-CB 3.39Å; H1056-K1059 PolarHBondContact O-N 3.19Å; H1056-K1059 VanDerWaalsContact O-N 3.09Å; F1057-K1059 VanDerWaalsContact C-N 3.28Å; F1057-K1059 PolarHBondContact O-N 3.46Å; K1059-F1062 PolarHBondContact O-N 2.99Å; K1059-D1063 WeakPolarHBondContact O-CB 3.45Å; K1059-D1063 PolarHBondContact O-N 3.03Å; K1059-L1096 HydrophobicContact CB-CD1 4.34Å; K1059-L1096 HydrophobicContact CG-CD2 4.12Å
1060L90.3Very high84.2Confident15 Ų1544.4 Ų44.48%0.07921%0.207CC..Hα-helixtrans-63.8-48.9-178.6-166.3152.9000111.6E1015 M1018 T1019 H1056 F1057 F1062 D1063 M1064E1015-L1060 HydrophobicContact CB-CD1 4.3Å; E1015-L1060 HydrophobicContact CG-CD1 3.66Å; M1018-L1060 HydrophobicContact CB-CD2 3.91Å; M1018-L1060 HydrophobicContact CE-CD1 4.34Å; M1018-L1060 HydrophobicContact CE-CD2 3.75Å; M1018-L1060 HydrophobicContact SD-CD2 3.89Å; T1019-L1060 HydrophobicContact CG2-CD1 3.88Å; T1019-L1060 HydrophobicContact CG2-CD2 4.18Å; T1019-L1060 HydrophobicContact CG2-CG 4.23Å; H1056-L1060 PolarHBondContact O-N 3.33Å; F1057-L1060 PolarHBondContact O-N 2.96Å; L1060-F1062 VanDerWaalsContact C-N 3.33Å; L1060-F1062 PolarHBondContact O-N 3.18Å; L1060-D1063 PolarHBondContact O-N 3.4Å; L1060-M1064 HydrophobicContact CD2-CE 3.6Å; L1060-M1064 HydrophobicContact CD2-CG 4.1Å; L1060-M1064 HydrophobicContact CD2-SD 3.76Å; L1060-M1064 WeakPolarHBondContact O-CG 3.43Å; L1060-M1064 PolarHBondContact O-N 3.15Å
1061V90.3Very high82.8Confident0 Ų047.1 Ų47.10%022%0.221CC..Hα-helixtrans-65.1-37.8176.7178.90000111.2M1018 L1030 L1033 F1057 M1064 L1065 L1082 L1085M1018-V1061 HydrophobicContact SD-CG2 4.41Å; L1030-V1061 HydrophobicContact CD2-CG1 4.5Å; L1030-V1061 HydrophobicContact CD2-CG2 3.98Å; L1033-V1061 HydrophobicContact CD1-CG2 3.79Å; F1057-V1061 WeakPolarHBondContact O-CB 3.2Å; F1057-V1061 WeakPolarHBondContact O-CG2 3.36Å; F1057-V1061 PolarHBondContact O-N 3.23Å; V1061-M1064 HydrophobicContact CB-CE 4.42Å; V1061-M1064 HydrophobicContact CG2-CE 4.03Å; V1061-M1064 PolarHBondContact O-N 3.12Å; V1061-L1065 HydrophobicContact CG1-CD1 4Å; V1061-L1065 WeakPolarHBondContact O-CB 3.41Å; V1061-L1065 PolarHBondContact O-N 2.65Å; V1061-L1082 HydrophobicContact CG1-CB 3.84Å; V1061-L1082 HydrophobicContact CG1-CD1 4.26Å; V1061-L1085 HydrophobicContact CB-CD1 4.49Å; V1061-L1085 HydrophobicContact CG2-CD1 4.12Å
1062F88.8Confident81.5Confident4 Ų446.8 Ų46.82%0.01822%0.222CC..Hα-helixtrans-61-48.2172.4-176.5-86.5000111.4L1058 K1059 L1060 M1064 L1065 V1066 Y1093 L1096 V1097 L1100 F1117L1058-F1062 WeakPolarHBondContact O-CB 3.34Å; L1058-F1062 PolarHBondContact O-N 3.49Å; K1059-F1062 PolarHBondContact O-N 2.99Å; L1060-F1062 VanDerWaalsContact C-N 3.33Å; L1060-F1062 PolarHBondContact O-N 3.18Å; F1062-M1064 VanDerWaalsContact C-N 3.34Å; F1062-M1064 PolarHBondContact O-N 2.9Å; F1062-L1065 PolarHBondContact O-N 2.93Å; F1062-V1066 HydrophobicContact CD1-CB 4.27Å; F1062-V1066 HydrophobicContact CD1-CG2 4.35Å; F1062-V1066 HydrophobicContact CD2-CG2 3.94Å; F1062-V1066 HydrophobicContact CE1-CB 4.09Å; F1062-V1066 HydrophobicContact CE1-CG1 4.07Å; F1062-V1066 HydrophobicContact CE1-CG2 4.3Å; F1062-V1066 HydrophobicContact CE2-CG2 3.91Å; F1062-V1066 HydrophobicContact CG-CG2 4.17Å; F1062-V1066 HydrophobicContact CZ-CB 4.24Å; F1062-V1066 HydrophobicContact CZ-CG1 4Å; F1062-V1066 HydrophobicContact CZ-CG2 4.09Å; F1062-V1066 WeakPolarHBondContact O-CA 3.5Å; F1062-V1066 WeakPolarHBondContact O-CB 3.44Å; F1062-V1066 VanDerWaalsContact O-CG2 3.32Å; F1062-V1066 WeakPolarHBondContact O-CG2 3.47Å; F1062-V1066 PolarHBondContact O-N 2.89Å; F1062-Y1093 HydrophobicContact CD2-CD2 4.36Å; F1062-Y1093 HydrophobicContact CD2-CE2 4.15Å; F1062-Y1093 HydrophobicContact CE2-CD2 4.48Å; F1062-Y1093 HydrophobicContact CE2-CE2 4.05Å; F1062-L1096 HydrophobicContact CB-CD1 4.36Å; F1062-L1096 HydrophobicContact CE1-CB 4.45Å; F1062-L1096 HydrophobicContact CG-CD1 4.34Å; F1062-L1096 HydrophobicContact CZ-CB 4.43Å; F1062-V1097 HydrophobicContact CE2-CG2 4.06Å; F1062-V1097 HydrophobicContact CZ-CG2 4.4Å; F1062-L1100 HydrophobicContact CE1-CD2 4.14Å; F1062-L1100 HydrophobicContact CZ-CD2 3.95Å; F1062-F1117 AromaticContact CE2-CE1 3.96Å; F1062-F1117 HydrophobicContact CE2-CE1 3.96Å; F1062-F1117 HydrophobicContact CE2-CZ 4.26Å; F1062-F1117 HydrophobicContact CZ-CE1 4.16Å; F1062-F1117 AromaticContact CZ-CZ 3.98Å; F1062-F1117 HydrophobicContact CZ-CZ 3.98Å
1063D86.2Confident80Confident43 Ų4347.5 Ų47.523%0.2322%0.223CC..Iπ-helixtrans-62.3-41.9178.6-71-13.9000110.8K1059 L1060 L1067 Q1068K1059-D1063 WeakPolarHBondContact O-CB 3.45Å; K1059-D1063 PolarHBondContact O-N 3.03Å; L1060-D1063 PolarHBondContact O-N 3.4Å; D1063-L1067 HydrophobicContact CB-CD1 4.42Å; D1063-L1067 CarbonylContact O-C 3.6Å; D1063-L1067 WeakPolarHBondContact O-CA 3.47Å; D1063-L1067 WeakPolarHBondContact O-CB 3.28Å; D1063-L1067 PolarHBondContact O-N 3.37Å; D1063-L1067 VanDerWaalsContact OD1-CD1 3.23Å; D1063-L1067 WeakPolarHBondContact OD1-CD1 3.39Å; D1063-Q1068 WeakPolarHBondContact O-CG 3.12Å; D1063-Q1068 PolarHBondContact O-N 2.92Å
1064M81.6Confident79.1Confident14 Ų1447.6 Ų47.67%0.06922%0.221CC..Iπ-helixtrans-61.2-47.3176.2-73.6-165.9-55.400112.8M1018 L1030 L1060 V1061 F1062 H1070M1018-M1064 HydrophobicContact CB-CE 4.11Å; M1018-M1064 HydrophobicContact CB-SD 3.97Å; M1018-M1064 HydrophobicContact CG-CE 4.23Å; M1018-M1064 HydrophobicContact SD-CE 3.82Å; L1030-M1064 HydrophobicContact CD2-CE 3.66Å; L1030-M1064 HydrophobicContact CG-CE 4.43Å; L1060-M1064 HydrophobicContact CD2-CE 3.6Å; L1060-M1064 HydrophobicContact CD2-CG 4.1Å; L1060-M1064 HydrophobicContact CD2-SD 3.76Å; L1060-M1064 WeakPolarHBondContact O-CG 3.43Å; L1060-M1064 PolarHBondContact O-N 3.15Å; V1061-M1064 HydrophobicContact CB-CE 4.42Å; V1061-M1064 HydrophobicContact CG2-CE 4.03Å; V1061-M1064 PolarHBondContact O-N 3.12Å; F1062-M1064 VanDerWaalsContact C-N 3.34Å; F1062-M1064 PolarHBondContact O-N 2.9Å; M1064-H1070 PolarHBondContact O-ND1 3.05Å
1065L77.5Confident78.2Confident7 Ų748 Ų484%0.03722%0.223CC..Iπ-helixtrans-79-36.2-176.5-78174.8000113.6V1061 F1062 H1070 A1078 L1082 L1141V1061-L1065 HydrophobicContact CG1-CD1 4Å; V1061-L1065 WeakPolarHBondContact O-CB 3.41Å; V1061-L1065 PolarHBondContact O-N 2.65Å; F1062-L1065 PolarHBondContact O-N 2.93Å; L1065-H1070 PolarHBondContact O-CE1 3.3Å; L1065-H1070 VanDerWaalsContact O-CE1 3.28Å; L1065-A1078 HydrophobicContact CD1-CB 3.94Å; L1065-A1078 HydrophobicContact CD2-CB 3.66Å; L1065-A1078 HydrophobicContact CG-CB 3.93Å; L1065-L1082 HydrophobicContact CD1-CB 3.84Å; L1065-L1082 HydrophobicContact CD1-CD2 3.61Å; L1065-L1082 HydrophobicContact CD1-CG 4.27Å; L1065-L1141 HydrophobicContact CD1-CD2 4.35Å
1066V77.7Confident77.7Confident6 Ų644.7 Ų44.74%0.03622%0.217CC..Iπ-helixtrans-103-36.3-167.6-177.40000112.4F1062 L1100 F1117 F1144 L1152F1062-V1066 HydrophobicContact CD1-CB 4.27Å; F1062-V1066 HydrophobicContact CD1-CG2 4.35Å; F1062-V1066 HydrophobicContact CD2-CG2 3.94Å; F1062-V1066 HydrophobicContact CE1-CB 4.09Å; F1062-V1066 HydrophobicContact CE1-CG1 4.07Å; F1062-V1066 HydrophobicContact CE1-CG2 4.3Å; F1062-V1066 HydrophobicContact CE2-CG2 3.91Å; F1062-V1066 HydrophobicContact CG-CG2 4.17Å; F1062-V1066 HydrophobicContact CZ-CB 4.24Å; F1062-V1066 HydrophobicContact CZ-CG1 4Å; F1062-V1066 HydrophobicContact CZ-CG2 4.09Å; F1062-V1066 WeakPolarHBondContact O-CA 3.5Å; F1062-V1066 WeakPolarHBondContact O-CB 3.44Å; F1062-V1066 VanDerWaalsContact O-CG2 3.32Å; F1062-V1066 WeakPolarHBondContact O-CG2 3.47Å; F1062-V1066 PolarHBondContact O-N 2.89Å; V1066-L1100 HydrophobicContact CG1-CD2 3.79Å; V1066-F1117 HydrophobicContact CG1-CZ 4.06Å; V1066-F1144 HydrophobicContact CG1-CE1 4.47Å; V1066-F1144 HydrophobicContact CG1-CZ 4.45Å; V1066-F1144 HydrophobicContact CG2-CE1 4.15Å; V1066-L1152 HydrophobicContact CG1-CD1 3.44Å; V1066-L1152 VanDerWaalsContact CG1-CD1 3.44Å; V1066-L1152 WeakPolarHBondContact O-CB 3.4Å
1067L72.9Confident77.3Confident64 Ų6441 Ų4134%0.33520%0.201SC..Iπ-helixtrans-107.9-28-172.2-58.9-177000113.6D1063 L1100D1063-L1067 HydrophobicContact CB-CD1 4.42Å; D1063-L1067 CarbonylContact O-C 3.6Å; D1063-L1067 WeakPolarHBondContact O-CA 3.47Å; D1063-L1067 WeakPolarHBondContact O-CB 3.28Å; D1063-L1067 PolarHBondContact O-N 3.37Å; D1063-L1067 VanDerWaalsContact OD1-CD1 3.23Å; D1063-L1067 WeakPolarHBondContact OD1-CD1 3.39Å; L1067-L1100 HydrophobicContact CD2-CD1 3.79Å; L1067-L1100 HydrophobicContact CD2-CD2 4.36Å
1068Q70.6Confident76.9Confident100 Ų10041 Ų4147%0.46720%0.202SC..SBendtrans-99.8158.7-179.2-60.1-178.414.600111.5D1063 C1153D1063-Q1068 WeakPolarHBondContact O-CG 3.12Å; D1063-Q1068 PolarHBondContact O-N 2.92Å; Q1068-C1153 PolarHBondContact O-SG 3.18Å; Q1068-C1153 VanDerWaalsContact O-SG 3.4Å
1069K62.7Low76.6Confident147 Ų14741 Ų4164%0.63920%0.201SC*.  trans-78.1121.1165.6-65.1-171-179.4-166.40107.2S175 C1153S175-K1069 WeakPolarHBondContact O-CE 3.47Å; S175-K1069 PolarHBondContact O-NZ 3.35Å; K1069-C1153 HydrophobicContact CG-CB 4.01Å
1070H61Low76.5Confident50 Ų5038.6 Ų38.623%0.23119%0.192CC..  trans-119153.3179.362.2-87.2000111.2M1064 L1065 T1072M1064-H1070 PolarHBondContact O-ND1 3.05Å; L1065-H1070 PolarHBondContact O-CE1 3.3Å; L1065-H1070 VanDerWaalsContact O-CE1 3.28Å; H1070-T1072 PolarHBondContact O-N 2.8Å
1071N59.8Low76.5Confident58 Ų5837.9 Ų37.931%0.3119%0.188SC..  trans-64.8129.3172.9-176.9-4.1000108.9S1023 E1073 M1074S1023-N1071 PolarHBondContact OG-ND2 3.28Å; S1023-N1071 VanDerWaalsContact OG-ND2 3.12Å; N1071-E1073 PolarHBondContact ND2-OE2 3.06Å; N1071-E1073 PolarHBondContact O-N 3.12Å; N1071-E1073 PolarHBondContact OD1-N 3.15Å; N1071-M1074 HydrophobicContact CB-CG 4.27Å; N1071-M1074 HydrophobicContact CB-SD 3.99Å; N1071-M1074 PolarHBondContact O-N 3.38Å; N1071-M1074 VanDerWaalsContact O-N 3.16Å
1072T60.6Low76.6Confident27 Ų2738 Ų3817%0.16619%0.189CC..G310 helixtrans-59.6-30.7176.541.90000112.3R245 H1070 M1074 T1075R245-T1072 PolarHBondContact NH2-O 3.3Å; H1070-T1072 PolarHBondContact O-N 2.8Å; T1072-M1074 PolarHBondContact O-N 2.6Å; T1072-T1075 WeakPolarHBondContact CA-OG1 3.35Å; T1072-T1075 WeakPolarHBondContact O-CB 3.31Å; T1072-T1075 PolarHBondContact O-N 3.27Å; T1072-T1075 PolarHBondContact O-OG1 3.03Å
1073E58.4Low76.7Confident123 Ų12337.9 Ų37.958%0.57519%0.189SC*.G310 helixtrans-59.3-32.6178.4-68169.8161.300112.1N1071 T1075N1071-E1073 PolarHBondContact ND2-OE2 3.06Å; N1071-E1073 PolarHBondContact O-N 3.12Å; N1071-E1073 PolarHBondContact OD1-N 3.15Å; E1073-T1075 VanDerWaalsContact C-N 3.34Å; E1073-T1075 PolarHBondContact O-N 3.07Å
1074M69.5Low76.9Confident19 Ų1935.9 Ų35.99%0.09418%0.178CC..G310 helixtrans-81.4-8.7179.1-59.2167.858.200113.8S1023 S1026 Q1027 L1030 N1071 T1072 V1076 A1077 A1078S1023-M1074 PolarHBondContact OG-SD 3.25Å; S1023-M1074 VanDerWaalsContact OG-SD 3.39Å; S1026-M1074 WeakPolarHBondContact OG-CE 3.46Å; Q1027-M1074 HydrophobicContact CB-CG 4.47Å; L1030-M1074 HydrophobicContact CD1-CB 4.38Å; L1030-M1074 HydrophobicContact CD1-CE 3.62Å; N1071-M1074 HydrophobicContact CB-CG 4.27Å; N1071-M1074 HydrophobicContact CB-SD 3.99Å; N1071-M1074 PolarHBondContact O-N 3.38Å; N1071-M1074 VanDerWaalsContact O-N 3.16Å; T1072-M1074 PolarHBondContact O-N 2.6Å; M1074-V1076 PolarHBondContact O-N 2.78Å; M1074-A1077 PolarHBondContact O-N 3.06Å; M1074-A1078 WeakPolarHBondContact O-CB 3.47Å; M1074-A1078 PolarHBondContact O-N 2.8Å
1075T71.9Confident77.4Confident8 Ų835.2 Ų35.25%0.04918%0.175CC..Hα-helixtrans-60.5-30.3-174.5-52.10000112.6T1072 E1073 G1079T1072-T1075 WeakPolarHBondContact CA-OG1 3.35Å; T1072-T1075 WeakPolarHBondContact O-CB 3.31Å; T1072-T1075 PolarHBondContact O-N 3.27Å; T1072-T1075 PolarHBondContact O-OG1 3.03Å; E1073-T1075 VanDerWaalsContact C-N 3.34Å; E1073-T1075 PolarHBondContact O-N 3.07Å; T1075-G1079 WeakPolarHBondContact O-CA 3.45Å; T1075-G1079 PolarHBondContact O-N 3.33Å
1076V80.3Confident78Confident52 Ų5235 Ų3532%0.31517%0.173SC..Hα-helixtrans-69.7-61178.1-179.40000109.6M1074 A1078 G1079 E1080M1074-V1076 PolarHBondContact O-N 2.78Å; V1076-A1078 VanDerWaalsContact C-N 3.32Å; V1076-A1078 PolarHBondContact O-N 3.15Å; V1076-G1079 PolarHBondContact O-N 3.11Å; V1076-E1080 HydrophobicContact CG1-CG 4.48Å; V1076-E1080 WeakPolarHBondContact O-CG 3.26Å; V1076-E1080 PolarHBondContact O-N 3.17Å
1077A83.5Confident78.4Confident8 Ų835.5 Ų35.57%0.06618%0.177CC..Hα-helixtrans-55.2-45.617800000112.3Q1027 L1030 E1031 M1074 G1079 E1080 A1081Q1027-A1077 HydrophobicContact CG-CB 4.16Å; L1030-A1077 HydrophobicContact CB-CB 3.94Å; E1031-A1077 HydrophobicContact CG-CB 3.87Å; M1074-A1077 PolarHBondContact O-N 3.06Å; A1077-G1079 PolarHBondContact O-N 3.28Å; A1077-E1080 PolarHBondContact O-N 3.1Å; A1077-A1081 WeakPolarHBondContact O-CB 3.34Å; A1077-A1081 PolarHBondContact O-N 3.19Å
1078A86.7Confident79.2Confident4 Ų434 Ų343%0.03317%0.169CC..Hα-helixtrans-63-40.117600000112.5L1030 L1065 M1074 V1076 L1082L1030-A1078 HydrophobicContact CD1-CB 3.71Å; L1030-A1078 HydrophobicContact CD2-CB 4.18Å; L1065-A1078 HydrophobicContact CD1-CB 3.94Å; L1065-A1078 HydrophobicContact CD2-CB 3.66Å; L1065-A1078 HydrophobicContact CG-CB 3.93Å; M1074-A1078 WeakPolarHBondContact O-CB 3.47Å; M1074-A1078 PolarHBondContact O-N 2.8Å; V1076-A1078 VanDerWaalsContact C-N 3.32Å; V1076-A1078 PolarHBondContact O-N 3.15Å; A1078-L1082 VanDerWaalsContact O-CB 3.27Å; A1078-L1082 WeakPolarHBondContact O-CB 3.31Å; A1078-L1082 PolarHBondContact O-N 2.89Å
1079G87.5Confident80.1Confident0 Ų029.4 Ų29.40%015%0.148CC..Hα-helixtrans-67.9-37.5177.900000112.6T1075 V1076 A1077 Y1083 L1138T1075-G1079 WeakPolarHBondContact O-CA 3.45Å; T1075-G1079 PolarHBondContact O-N 3.33Å; V1076-G1079 PolarHBondContact O-N 3.11Å; A1077-G1079 PolarHBondContact O-N 3.28Å; G1079-Y1083 VanDerWaalsContact O-CB 3.29Å; G1079-Y1083 WeakPolarHBondContact O-CB 3.3Å; G1079-Y1083 PolarHBondContact O-N 3Å; G1079-L1138 VanDerWaalsContact C-CD2 3.43Å
1080E88.7Confident81.3Confident61 Ų6126.3 Ų26.329%0.28514%0.135SC..Hα-helixtrans-66.6-45.6174.6-65.1-156.7154.500111.6V1076 A1077 Y1083 T1084 K1134 L1138V1076-E1080 HydrophobicContact CG1-CG 4.48Å; V1076-E1080 WeakPolarHBondContact O-CG 3.26Å; V1076-E1080 PolarHBondContact O-N 3.17Å; A1077-E1080 PolarHBondContact O-N 3.1Å; E1080-Y1083 PolarHBondContact O-N 3.03Å; E1080-T1084 WeakPolarHBondContact O-CG2 3.46Å; E1080-T1084 PolarHBondContact O-N 2.93Å; E1080-T1084 PolarHBondContact O-OG1 2.59Å; E1080-T1084 VanDerWaalsContact O-OG1 3.11Å; E1080-K1134 WeakPolarHBondContact OE1-CE 3.27Å; E1080-K1134 IonicContact OE1-NZ 3.45Å; E1080-K1134 PolarHBondContact OE1-NZ 3.27Å; E1080-K1134 WeakPolarHBondContact OE2-CE 3.11Å; E1080-K1134 IonicContact OE2-NZ 2.77Å; E1080-K1134 PolarHBondContact OE2-NZ 3.49Å; E1080-L1138 HydrophobicContact CG-CD1 3.99Å; E1080-L1138 HydrophobicContact CG-CD2 4.1Å
1081A91.3Very high82.6Confident0 Ų027.2 Ų27.20%015%0.152CC..Hα-helixtrans-61.9-45.5174.100000111.5L1030 L1033 S1034 A1077 Y1083 T1084 L1085L1030-A1081 HydrophobicContact CD2-CB 4.28Å; L1033-A1081 HydrophobicContact CB-CB 4.03Å; L1033-A1081 HydrophobicContact CD1-CB 4.31Å; S1034-A1081 WeakPolarHBondContact OG-CA 3.41Å; S1034-A1081 PolarHBondContact OG-N 3.16Å; A1077-A1081 WeakPolarHBondContact O-CB 3.34Å; A1077-A1081 PolarHBondContact O-N 3.19Å; A1081-Y1083 VanDerWaalsContact C-N 3.34Å; A1081-Y1083 PolarHBondContact O-N 3.04Å; A1081-T1084 PolarHBondContact O-N 3.43Å; A1081-T1084 PolarHBondContact O-OG1 3.37Å; A1081-L1085 WeakPolarHBondContact O-CB 3.47Å; A1081-L1085 WeakPolarHBondContact O-CD1 3.28Å; A1081-L1085 WeakPolarHBondContact O-CG 3.41Å; A1081-L1085 PolarHBondContact O-N 3.4Å
1082L91.1Very high84.1Confident2 Ų226.2 Ų26.21%0.0115%0.145CC..Hα-helixtrans-60.3-45.9177.1-177.964.1000110.9L1058 V1061 L1065 A1078 T1084 L1085 V1086 F1137 L1141L1058-L1082 HydrophobicContact CD1-CD1 3.92Å; V1061-L1082 HydrophobicContact CG1-CB 3.84Å; V1061-L1082 HydrophobicContact CG1-CD1 4.26Å; L1065-L1082 HydrophobicContact CD1-CB 3.84Å; L1065-L1082 HydrophobicContact CD1-CD2 3.61Å; L1065-L1082 HydrophobicContact CD1-CG 4.27Å; A1078-L1082 VanDerWaalsContact O-CB 3.27Å; A1078-L1082 WeakPolarHBondContact O-CB 3.31Å; A1078-L1082 PolarHBondContact O-N 2.89Å; L1082-T1084 PolarHBondContact O-N 3.23Å; L1082-L1085 PolarHBondContact O-N 3.43Å; L1082-V1086 HydrophobicContact CD1-CG2 3.99Å; L1082-V1086 HydrophobicContact CG-CG2 4.15Å; L1082-V1086 WeakPolarHBondContact O-CB 3.39Å; L1082-V1086 WeakPolarHBondContact O-CG2 3.5Å; L1082-V1086 PolarHBondContact O-N 3.23Å; L1082-F1137 HydrophobicContact CD2-CE1 4.5Å; L1082-F1137 HydrophobicContact CD2-CZ 4.14Å; L1082-F1137 HydrophobicContact CG-CZ 4.36Å; L1082-L1141 HydrophobicContact CD2-CD1 4.3Å
1083Y90.6Very high85.5Confident3 Ų325.6 Ų25.61%0.01214%0.14CC..Hα-helixtrans-59.6-48.8-179.8176.7-105.3000112.1G1079 E1080 A1081 L1085 V1086 C1087 T1128 D1130 Q1133 K1134 F1137G1079-Y1083 VanDerWaalsContact O-CB 3.29Å; G1079-Y1083 WeakPolarHBondContact O-CB 3.3Å; G1079-Y1083 PolarHBondContact O-N 3Å; E1080-Y1083 PolarHBondContact O-N 3.03Å; A1081-Y1083 VanDerWaalsContact C-N 3.34Å; A1081-Y1083 PolarHBondContact O-N 3.04Å; Y1083-L1085 VanDerWaalsContact C-N 3.35Å; Y1083-L1085 PolarHBondContact O-N 3.04Å; Y1083-V1086 PolarHBondContact O-N 3.29Å; Y1083-C1087 PolarHBondContact O-N 3.33Å; Y1083-C1087 PolarHBondContact O-SG 2.74Å; Y1083-T1128 PolarHBondContact OH-O 3.09Å; Y1083-D1130 PolarHBondContact OH-O 3.25Å; Y1083-Q1133 WeakPolarHBondContact OH-CB 3.36Å; Y1083-K1134 HydrophobicContact CD1-CB 3.78Å; Y1083-K1134 HydrophobicContact CD1-CD 4.21Å; Y1083-K1134 HydrophobicContact CD1-CG 3.64Å; Y1083-K1134 HydrophobicContact CE1-CB 3.43Å; Y1083-K1134 VanDerWaalsContact CE1-CB 3.43Å; Y1083-K1134 HydrophobicContact CE1-CD 4.46Å; Y1083-K1134 HydrophobicContact CE1-CG 3.85Å; Y1083-K1134 HydrophobicContact CG-CG 4.3Å; Y1083-K1134 PolarHBondContact OH-N 3.07Å; Y1083-K1134 VanDerWaalsContact OH-N 3.13Å; Y1083-F1137 HydrophobicContact CD2-CB 3.57Å; Y1083-F1137 AromaticContact CD2-CD1 3.66Å; Y1083-F1137 HydrophobicContact CD2-CD1 3.66Å; Y1083-F1137 AromaticContact CD2-CD2 3.91Å; Y1083-F1137 HydrophobicContact CD2-CD2 3.91Å; Y1083-F1137 HydrophobicContact CD2-CE1 4.29Å; Y1083-F1137 AromaticContact CD2-CG 3.43Å; Y1083-F1137 HydrophobicContact CD2-CG 3.43Å; Y1083-F1137 VanDerWaalsContact CD2-CG 3.43Å; Y1083-F1137 HydrophobicContact CE2-CB 3.81Å; Y1083-F1137 HydrophobicContact CE2-CD2 4.49Å; Y1083-F1137 HydrophobicContact CE2-CG 4.11Å; Y1083-F1137 HydrophobicContact CG-CB 4.45Å; Y1083-F1137 HydrophobicContact CG-CD1 4.04Å; Y1083-F1137 HydrophobicContact CG-CG 4.26Å
1084T90.4Very high87Confident1 Ų122.5 Ų22.51%0.00613%0.132CC..Hα-helixtrans-64-40.9179.853.30000111.3E1080 A1081 L1082 C1087 L1088 M1129E1080-T1084 WeakPolarHBondContact O-CG2 3.46Å; E1080-T1084 PolarHBondContact O-N 2.93Å; E1080-T1084 PolarHBondContact O-OG1 2.59Å; E1080-T1084 VanDerWaalsContact O-OG1 3.11Å; A1081-T1084 PolarHBondContact O-N 3.43Å; A1081-T1084 PolarHBondContact O-OG1 3.37Å; L1082-T1084 PolarHBondContact O-N 3.23Å; T1084-C1087 WeakPolarHBondContact O-CB 3.45Å; T1084-C1087 PolarHBondContact O-N 3.02Å; T1084-L1088 PolarHBondContact O-N 3.15Å; T1084-M1129 HydrophobicContact CG2-CE 4.31Å; T1084-M1129 HydrophobicContact CG2-SD 3.96Å; T1084-M1129 WeakPolarHBondContact O-CE 3.4Å
1085L92.1Very high88Confident0 Ų027 Ų270%015%0.153CC..Hα-helixtrans-67.2-37.6176-67.8170.8000113.1L1033 A1037 T1054 F1057 L1058 V1061 A1081 L1082 Y1083 L1088 H1089L1033-L1085 HydrophobicContact CD1-CD1 4.5Å; A1037-L1085 HydrophobicContact CB-CD2 4.14Å; T1054-L1085 HydrophobicContact CG2-CD2 4.22Å; T1054-L1085 WeakPolarHBondContact O-CD2 3.19Å; F1057-L1085 HydrophobicContact CB-CD1 4.15Å; L1058-L1085 HydrophobicContact CB-CB 4.22Å; L1058-L1085 HydrophobicContact CD1-CB 3.94Å; V1061-L1085 HydrophobicContact CB-CD1 4.49Å; V1061-L1085 HydrophobicContact CG2-CD1 4.12Å; A1081-L1085 WeakPolarHBondContact O-CB 3.47Å; A1081-L1085 WeakPolarHBondContact O-CD1 3.28Å; A1081-L1085 WeakPolarHBondContact O-CG 3.41Å; A1081-L1085 PolarHBondContact O-N 3.4Å; L1082-L1085 PolarHBondContact O-N 3.43Å; Y1083-L1085 VanDerWaalsContact C-N 3.35Å; Y1083-L1085 PolarHBondContact O-N 3.04Å; L1085-L1088 PolarHBondContact O-N 3.22Å; L1085-H1089 PolarHBondContact O-N 3.02Å
1086V90.1Very high88.9Confident2 Ų228.5 Ų28.51%0.01216%0.16CC..Hα-helixtrans-66.5-41.1175.3168.10000111.2L1058 L1082 Y1083 L1088 Q1090 Y1093 P1127L1058-V1086 HydrophobicContact CD1-CG2 3.92Å; L1082-V1086 HydrophobicContact CD1-CG2 3.99Å; L1082-V1086 HydrophobicContact CG-CG2 4.15Å; L1082-V1086 WeakPolarHBondContact O-CB 3.39Å; L1082-V1086 WeakPolarHBondContact O-CG2 3.5Å; L1082-V1086 PolarHBondContact O-N 3.23Å; Y1083-V1086 PolarHBondContact O-N 3.29Å; V1086-L1088 PolarHBondContact O-N 2.93Å; V1086-Q1090 WeakPolarHBondContact O-CG 3.49Å; V1086-Q1090 PolarHBondContact O-N 2.87Å; V1086-Y1093 HydrophobicContact CG1-CD1 4.12Å; V1086-Y1093 HydrophobicContact CG1-CE1 4.49Å; V1086-Y1093 HydrophobicContact CG1-CG 4.11Å; V1086-Y1093 HydrophobicContact CG2-CD2 3.51Å; V1086-Y1093 HydrophobicContact CG2-CE2 3.9Å; V1086-Y1093 HydrophobicContact CG2-CG 3.85Å; V1086-P1127 HydrophobicContact CG1-CG 4.1Å
1087C87.8Confident89.3Confident16 Ų1626.7 Ų26.711%0.10815%0.149CC..Hα-helixtrans-57-37.9173.1-73.60000111.7Y1083 T1084 Q1090 M1129Y1083-C1087 PolarHBondContact O-N 3.33Å; Y1083-C1087 PolarHBondContact O-SG 2.74Å; T1084-C1087 WeakPolarHBondContact O-CB 3.45Å; T1084-C1087 PolarHBondContact O-N 3.02Å; C1087-Q1090 PolarHBondContact O-NE2 2.96Å; C1087-M1129 HydrophobicContact CB-CE 3.7Å; C1087-M1129 HydrophobicContact CB-CG 4.25Å; C1087-M1129 HydrophobicContact CB-SD 3.7Å
1088L88.3Confident89.6Confident34 Ų3432.8 Ų32.818%0.17818%0.176CC..Hα-helixtrans-79.5-43.3-176.9-167.764.6000113.2C1040 A1041 F1051 T1084 L1085 V1086C1040-L1088 HydrophobicContact CB-CD1 4.09Å; C1040-L1088 HydrophobicContact CB-CD2 3.65Å; A1041-L1088 HydrophobicContact CB-CD1 4.27Å; F1051-L1088 HydrophobicContact CD2-CD1 4.27Å; F1051-L1088 HydrophobicContact CD2-CD2 4.29Å; F1051-L1088 HydrophobicContact CD2-CG 4.27Å; F1051-L1088 HydrophobicContact CE2-CD1 3.88Å; F1051-L1088 HydrophobicContact CE2-CD2 4.35Å; F1051-L1088 HydrophobicContact CE2-CG 3.85Å; T1084-L1088 PolarHBondContact O-N 3.15Å; L1085-L1088 PolarHBondContact O-N 3.22Å; V1086-L1088 PolarHBondContact O-N 2.93Å
1089H90.9Very high89.8Confident2 Ų236.5 Ų36.51%0.00920%0.199CC..  trans-121.958.9-169.9-60-67.3000112.5F1051 T1054 R1055 L1058 L1085 A1091 E1092 Y1093F1051-H1089 AromaticContact CD1-CE1 3.75Å; F1051-H1089 AromaticContact CD2-CE1 3.77Å; F1051-H1089 AromaticContact CE1-CE1 3.44Å; F1051-H1089 VanDerWaalsContact CE1-CE1 3.44Å; F1051-H1089 WeakPolarHBondContact CE1-CE1 3.23Å; F1051-H1089 AromaticContact CE1-ND1 3.72Å; F1051-H1089 AromaticContact CE2-CE1 3.45Å; F1051-H1089 VanDerWaalsContact CE2-CE1 3.45Å; F1051-H1089 WeakPolarHBondContact CE2-CE1 3.46Å; F1051-H1089 AromaticContact CE2-ND1 3.9Å; F1051-H1089 AromaticContact CG-CE1 3.91Å; F1051-H1089 AromaticContact CZ-CE1 3.27Å; F1051-H1089 WeakPolarHBondContact CZ-CE1 3.41Å; F1051-H1089 AromaticContact CZ-ND1 3.39Å; F1051-H1089 WeakPolarHBondContact CZ-ND1 3.45Å; F1051-H1089 PolarHBondContact O-CE1 3.48Å; F1051-H1089 VanDerWaalsContact O-CE1 3.26Å; F1051-H1089 PolarHBondContact O-NE2 3.16Å; T1054-H1089 PolarHBondContact OG1-NE2 3.23Å; R1055-H1089 PolarHBondContact N-NE2 3.32Å; L1058-H1089 HydrophobicContact CD2-CB 3.76Å; L1085-H1089 PolarHBondContact O-N 3.02Å; H1089-A1091 VanDerWaalsContact C-N 3.35Å; H1089-A1091 PolarHBondContact O-N 2.89Å; H1089-E1092 HydrophobicContact CB-CB 4.3Å; H1089-E1092 PolarHBondContact O-N 3.37Å; H1089-Y1093 PolarHBondContact O-N 3.12Å
1090Q87.9Confident89.8Confident82 Ų8237.3 Ų37.338%0.38320%0.203SC..Hα-helixtrans-63.8-34.1-172.9-65.9179.626.700114.3V1086 C1087 S1094 P1127V1086-Q1090 WeakPolarHBondContact O-CG 3.49Å; V1086-Q1090 PolarHBondContact O-N 2.87Å; C1087-Q1090 PolarHBondContact O-NE2 2.96Å; Q1090-S1094 PolarHBondContact O-N 2.9Å; Q1090-S1094 VanDerWaalsContact O-N 3.08Å; Q1090-S1094 PolarHBondContact O-OG 2.76Å; Q1090-P1127 HydrophobicContact CG-CG 4.08Å; Q1090-P1127 PolarHBondContact NE2-O 3.43Å
1091A88.1Confident89.7Confident70 Ų7035.3 Ų35.358%0.57919%0.194SC*.Hα-helixtrans-69.2-45.3-178.900000110.7H1089 S1094 E1095H1089-A1091 VanDerWaalsContact C-N 3.35Å; H1089-A1091 PolarHBondContact O-N 2.89Å; A1091-S1094 WeakPolarHBondContact O-CB 3.46Å; A1091-S1094 PolarHBondContact O-N 2.86Å; A1091-E1095 PolarHBondContact O-N 3Å
1092E91.4Very high89.5Confident36 Ų3639.7 Ų39.717%0.16823%0.225CC..Hα-helixtrans-64.6-41.4177-6877.4-172.400111.9R1055 L1058 H1089 S1094 E1095 L1096R1055-E1092 HydrophobicContact CG-CG 3.94Å; R1055-E1092 IonicContact CZ-OE1 3.81Å; R1055-E1092 IonicContact NE-OE1 3.27Å; R1055-E1092 PolarHBondContact NE-OE1 3.36Å; R1055-E1092 IonicContact NH1-OE1 2.65Å; R1055-E1092 PolarHBondContact NH1-OE1 3.05Å; R1055-E1092 IonicContact NH2-OE1 3.89Å; R1055-E1092 PolarHBondContact NH2-OE1 2.91Å; L1058-E1092 HydrophobicContact CD2-CB 4Å; H1089-E1092 HydrophobicContact CB-CB 4.3Å; H1089-E1092 PolarHBondContact O-N 3.37Å; E1092-S1094 VanDerWaalsContact C-N 3.3Å; E1092-S1094 PolarHBondContact O-N 3.48Å; E1092-E1095 PolarHBondContact O-N 3.38Å; E1092-L1096 WeakPolarHBondContact O-CG 3.2Å; E1092-L1096 PolarHBondContact O-N 2.84Å
1093Y90.2Very high89.3Confident15 Ų1542.9 Ų42.96%0.05925%0.247CC..Hα-helixtrans-58.6-45173.1173.5-102.6000111.4F1062 V1086 H1089 E1095 L1096 V1097 T1121F1062-Y1093 HydrophobicContact CD2-CD2 4.36Å; F1062-Y1093 HydrophobicContact CD2-CE2 4.15Å; F1062-Y1093 HydrophobicContact CE2-CD2 4.48Å; F1062-Y1093 HydrophobicContact CE2-CE2 4.05Å; V1086-Y1093 HydrophobicContact CG1-CD1 4.12Å; V1086-Y1093 HydrophobicContact CG1-CE1 4.49Å; V1086-Y1093 HydrophobicContact CG1-CG 4.11Å; V1086-Y1093 HydrophobicContact CG2-CD2 3.51Å; V1086-Y1093 HydrophobicContact CG2-CE2 3.9Å; V1086-Y1093 HydrophobicContact CG2-CG 3.85Å; H1089-Y1093 PolarHBondContact O-N 3.12Å; Y1093-E1095 VanDerWaalsContact C-N 3.34Å; Y1093-E1095 PolarHBondContact O-N 2.88Å; Y1093-L1096 PolarHBondContact O-N 3.28Å; Y1093-V1097 HydrophobicContact CD1-CG2 4.37Å; Y1093-V1097 HydrophobicContact CD2-CG2 4.31Å; Y1093-V1097 HydrophobicContact CE1-CG2 3.89Å; Y1093-V1097 HydrophobicContact CE2-CG2 3.84Å; Y1093-V1097 WeakPolarHBondContact O-CG2 3.48Å; Y1093-V1097 PolarHBondContact O-N 3.05Å; Y1093-T1121 HydrophobicContact CE1-CG2 3.79Å
1094S88.6Confident88.9Confident58 Ų5845 Ų4541%0.40626%0.257SS..Hα-helixtrans-62.2-42.4177.9-55.40000111.4Q1090 A1091 E1092 V1097 E1098Q1090-S1094 PolarHBondContact O-N 2.9Å; Q1090-S1094 VanDerWaalsContact O-N 3.08Å; Q1090-S1094 PolarHBondContact O-OG 2.76Å; A1091-S1094 WeakPolarHBondContact O-CB 3.46Å; A1091-S1094 PolarHBondContact O-N 2.86Å; E1092-S1094 VanDerWaalsContact C-N 3.3Å; E1092-S1094 PolarHBondContact O-N 3.48Å; S1094-V1097 PolarHBondContact O-N 3.21Å; S1094-E1098 WeakPolarHBondContact O-CB 3.4Å; S1094-E1098 WeakPolarHBondContact O-CG 3.48Å; S1094-E1098 PolarHBondContact O-N 3.04Å
1095E91.8Very high88.4Confident114 Ų11454.1 Ų54.153%0.53329%0.291SS..Hα-helixtrans-62.1-41.9175.5-173.4-179.4-176.700112.3A1091 E1092 Y1093 T1099A1091-E1095 PolarHBondContact O-N 3Å; E1092-E1095 PolarHBondContact O-N 3.38Å; Y1093-E1095 VanDerWaalsContact C-N 3.34Å; Y1093-E1095 PolarHBondContact O-N 2.88Å; E1095-T1099 WeakPolarHBondContact O-CB 3.47Å; E1095-T1099 PolarHBondContact O-N 3.37Å; E1095-T1099 PolarHBondContact O-OG1 3.44Å
1096L89.9Confident87.9Confident39 Ų3957.3 Ų57.320%0.20431%0.308CS..Hα-helixtrans-62.6-45.3175.8-71.8172.5000111.5L1058 K1059 F1062 E1092 Y1093 T1099 L1100L1058-L1096 HydrophobicContact CD2-CD1 4.45Å; L1058-L1096 HydrophobicContact CG-CD1 4.22Å; K1059-L1096 HydrophobicContact CB-CD1 4.34Å; K1059-L1096 HydrophobicContact CG-CD2 4.12Å; F1062-L1096 HydrophobicContact CB-CD1 4.36Å; F1062-L1096 HydrophobicContact CE1-CB 4.45Å; F1062-L1096 HydrophobicContact CG-CD1 4.34Å; F1062-L1096 HydrophobicContact CZ-CB 4.43Å; E1092-L1096 WeakPolarHBondContact O-CG 3.2Å; E1092-L1096 PolarHBondContact O-N 2.84Å; Y1093-L1096 PolarHBondContact O-N 3.28Å; L1096-T1099 PolarHBondContact O-N 3.47Å; L1096-L1100 WeakPolarHBondContact O-CB 3.44Å; L1096-L1100 PolarHBondContact O-N 3.42Å
1097V89.3Confident87.5Confident14 Ų1460.8 Ų60.89%0.08534%0.337CS..Hα-helixtrans-63.9-47.5177.5172.90000111F1062 Y1093 S1094 T1099 L1100 L1101 F1117F1062-V1097 HydrophobicContact CE2-CG2 4.06Å; F1062-V1097 HydrophobicContact CZ-CG2 4.4Å; Y1093-V1097 HydrophobicContact CD1-CG2 4.37Å; Y1093-V1097 HydrophobicContact CD2-CG2 4.31Å; Y1093-V1097 HydrophobicContact CE1-CG2 3.89Å; Y1093-V1097 HydrophobicContact CE2-CG2 3.84Å; Y1093-V1097 WeakPolarHBondContact O-CG2 3.48Å; Y1093-V1097 PolarHBondContact O-N 3.05Å; S1094-V1097 PolarHBondContact O-N 3.21Å; V1097-T1099 PolarHBondContact O-N 2.63Å; V1097-L1100 PolarHBondContact O-N 3.28Å; V1097-L1101 HydrophobicContact CG1-CD1 3.86Å; V1097-L1101 HydrophobicContact CG1-CG 4.32Å; V1097-L1101 WeakPolarHBondContact O-CB 3.27Å; V1097-L1101 VanDerWaalsContact O-CG 3.28Å; V1097-L1101 WeakPolarHBondContact O-CG 3.28Å; V1097-L1101 PolarHBondContact O-N 2.81Å; V1097-F1117 HydrophobicContact CG1-CB 3.96Å; V1097-F1117 HydrophobicContact CG1-CD1 4.02Å; V1097-F1117 HydrophobicContact CG1-CD2 3.84Å; V1097-F1117 HydrophobicContact CG1-CE1 4.49Å; V1097-F1117 HydrophobicContact CG1-CE2 4.34Å; V1097-F1117 HydrophobicContact CG1-CG 3.68Å; V1097-F1117 HydrophobicContact CG2-CD1 3.73Å; V1097-F1117 HydrophobicContact CG2-CE1 3.79Å; V1097-F1117 HydrophobicContact CG2-CG 4.27Å; V1097-F1117 HydrophobicContact CG2-CZ 4.36Å
1098E89.2Confident87.3Confident136 Ų13663.4 Ų63.464%0.63635%0.353SS*.Hα-helixtrans-63.5-40.2178.2-74.5-178.7-176.300112.4S1094 L1100 L1101 S1102S1094-E1098 WeakPolarHBondContact O-CB 3.4Å; S1094-E1098 WeakPolarHBondContact O-CG 3.48Å; S1094-E1098 PolarHBondContact O-N 3.04Å; E1098-L1100 VanDerWaalsContact C-N 3.35Å; E1098-L1101 PolarHBondContact O-N 3.26Å; E1098-S1102 VanDerWaalsContact O-CB 3.29Å; E1098-S1102 WeakPolarHBondContact O-CB 3.46Å; E1098-S1102 PolarHBondContact O-N 3.24Å; E1098-S1102 PolarHBondContact O-OG 2.85Å
1099T90.2Very high86.9Confident81 Ų8162.3 Ų62.350%0.49735%0.347SS..Hα-helixtrans-62.3-44.2175.3-61.40000110.8E1095 L1096 V1097 S1102 S1103E1095-T1099 WeakPolarHBondContact O-CB 3.47Å; E1095-T1099 PolarHBondContact O-N 3.37Å; E1095-T1099 PolarHBondContact O-OG1 3.44Å; L1096-T1099 PolarHBondContact O-N 3.47Å; V1097-T1099 PolarHBondContact O-N 2.63Å; T1099-S1102 WeakPolarHBondContact CA-OG 3.47Å; T1099-S1102 PolarHBondContact O-OG 2.93Å; T1099-S1103 WeakPolarHBondContact O-CB 3.49Å; T1099-S1103 PolarHBondContact O-N 3.35Å; T1099-S1103 VanDerWaalsContact O-N 3.08Å
1100L87.1Confident86.6Confident17 Ų1767.6 Ų67.69%0.08937%0.368CS..Hα-helixtrans-65.1-46.2177.7179.661.3000111.7F1062 V1066 L1067 L1096 V1097 E1098 S1103 Q1104 F1117 L1152F1062-L1100 HydrophobicContact CE1-CD2 4.14Å; F1062-L1100 HydrophobicContact CZ-CD2 3.95Å; V1066-L1100 HydrophobicContact CG1-CD2 3.79Å; L1067-L1100 HydrophobicContact CD2-CD1 3.79Å; L1067-L1100 HydrophobicContact CD2-CD2 4.36Å; L1096-L1100 WeakPolarHBondContact O-CB 3.44Å; L1096-L1100 PolarHBondContact O-N 3.42Å; V1097-L1100 PolarHBondContact O-N 3.28Å; E1098-L1100 VanDerWaalsContact C-N 3.35Å; L1100-S1103 PolarHBondContact O-N 3.48Å; L1100-S1103 PolarHBondContact O-OG 3.16Å; L1100-Q1104 WeakPolarHBondContact O-CG 3.38Å; L1100-Q1104 PolarHBondContact O-NE2 3.25Å; L1100-F1117 HydrophobicContact CD2-CE2 3.84Å; L1100-F1117 HydrophobicContact CD2-CZ 3.72Å; L1100-L1152 HydrophobicContact CD1-CD2 4.14Å; L1100-L1152 HydrophobicContact CD2-CD1 3.78Å
1101L87.2Confident86.5Confident19 Ų1969.7 Ų69.710%0.09938%0.377CS..Hα-helixtrans-63.2-45.6178.6-71.5175.8000111.5V1097 E1098 S1103 Q1104 Y1110 L1113 A1114 F1117V1097-L1101 HydrophobicContact CG1-CD1 3.86Å; V1097-L1101 HydrophobicContact CG1-CG 4.32Å; V1097-L1101 WeakPolarHBondContact O-CB 3.27Å; V1097-L1101 VanDerWaalsContact O-CG 3.28Å; V1097-L1101 WeakPolarHBondContact O-CG 3.28Å; V1097-L1101 PolarHBondContact O-N 2.81Å; E1098-L1101 PolarHBondContact O-N 3.26Å; L1101-S1103 PolarHBondContact O-N 3Å; L1101-Q1104 WeakPolarHBondContact O-CB 3.38Å; L1101-Q1104 WeakPolarHBondContact O-CG 3.48Å; L1101-Q1104 PolarHBondContact O-N 2.88Å; L1101-Q1104 VanDerWaalsContact O-N 3.13Å; L1101-Y1110 HydrophobicContact CB-CD2 4.22Å; L1101-Y1110 HydrophobicContact CB-CE2 3.83Å; L1101-Y1110 VanDerWaalsContact O-CD2 3.3Å; L1101-Y1110 WeakPolarHBondContact O-CD2 3.43Å; L1101-L1113 HydrophobicContact CD2-CB 3.46Å; L1101-L1113 VanDerWaalsContact CD2-CB 3.46Å; L1101-A1114 HydrophobicContact CD1-CB 4.36Å; L1101-A1114 HydrophobicContact CD2-CB 4.28Å; L1101-F1117 HydrophobicContact CD2-CD2 4.27Å
1102S87.7Confident86.2Confident92 Ų9270.5 Ų70.564%0.64337%0.366SS*.Hα-helixtrans-66.4-24.7178.160.70000113.6E1098 T1099 Q1104E1098-S1102 VanDerWaalsContact O-CB 3.29Å; E1098-S1102 WeakPolarHBondContact O-CB 3.46Å; E1098-S1102 PolarHBondContact O-N 3.24Å; E1098-S1102 PolarHBondContact O-OG 2.85Å; T1099-S1102 WeakPolarHBondContact CA-OG 3.47Å; T1099-S1102 PolarHBondContact O-OG 2.93Å; S1102-Q1104 PolarHBondContact O-N 3.06Å
1103S86.3Confident85.8Confident69 Ų6968.8 Ų68.848%0.48336%0.358SS..THydrogen-bonded Turntrans-73-12.8174.879.60000114T1099 L1100 L1101T1099-S1103 WeakPolarHBondContact O-CB 3.49Å; T1099-S1103 PolarHBondContact O-N 3.35Å; T1099-S1103 VanDerWaalsContact O-N 3.08Å; L1100-S1103 PolarHBondContact O-N 3.48Å; L1100-S1103 PolarHBondContact O-OG 3.16Å; L1101-S1103 PolarHBondContact O-N 3Å
1104Q83.3Confident85.6Confident47 Ų4768.8 Ų68.822%0.2236%0.361CS..  trans-78.3127.6-178.1-55.9-55.7-36.700111.7L1100 L1101 S1102 L1113L1100-Q1104 WeakPolarHBondContact O-CG 3.38Å; L1100-Q1104 PolarHBondContact O-NE2 3.25Å; L1101-Q1104 WeakPolarHBondContact O-CB 3.38Å; L1101-Q1104 WeakPolarHBondContact O-CG 3.48Å; L1101-Q1104 PolarHBondContact O-N 2.88Å; L1101-Q1104 VanDerWaalsContact O-N 3.13Å; S1102-Q1104 PolarHBondContact O-N 3.06Å; Q1104-L1113 HydrophobicContact CG-CD1 3.73Å
1105R79.9Confident85.4Confident193 Ų19370.1 Ų70.173%0.72836%0.364SS*.  trans-90.9-21.6-178.9-63.3-179.9179.9178.4-7.1114M1M1-R1105 PolarHBondContact SD-NH1 3.1Å
1106D79.9Confident85.1Confident67 Ų6765.3 Ų65.336%0.35834%0.343SS..  trans-99.2120.8-178-172.8-30000109.3V1108 I1109 Y1110D1106-V1108 PolarHBondContact O-N 3.43Å; D1106-V1108 WeakPolarHBondContact OD1-CB 3.23Å; D1106-V1108 PolarHBondContact OD1-N 3.33Å; D1106-I1109 HydrophobicContact CB-CB 4.1Å; D1106-I1109 HydrophobicContact CB-CD1 3.9Å; D1106-I1109 HydrophobicContact CB-CG1 3.91Å; D1106-I1109 PolarHBondContact O-N 3.32Å; D1106-Y1110 PolarHBondContact O-N 3.07Å
1107A83.1Confident84.9Confident75 Ų7563.8 Ų63.862%0.6234%0.335SS*.Hα-helixtrans-61.8-30.2-178.100000112.8Q1111A1107-Q1111 WeakPolarHBondContact O-CB 3.22Å; A1107-Q1111 PolarHBondContact O-N 3.18Å
1108V82Confident84.8Confident72 Ų7268.2 Ų68.244%0.43636%0.358SS..Hα-helixtrans-72.2-41.4178.7-178.60000110.6L84 D1106 R1112L84-V1108 HydrophobicContact CD2-CG1 4.24Å; D1106-V1108 PolarHBondContact O-N 3.43Å; D1106-V1108 WeakPolarHBondContact OD1-CB 3.23Å; D1106-V1108 PolarHBondContact OD1-N 3.33Å; V1108-R1112 WeakPolarHBondContact O-CG 3.38Å; V1108-R1112 PolarHBondContact O-N 3.21Å
1109I80.3Confident84.6Confident11 Ų1168.3 Ų68.36%0.05636%0.357CS..Hα-helixtrans-67-43.5175.6-60.8-179.2000109.7D1106 Q1111 R1112 L1113D1106-I1109 HydrophobicContact CB-CB 4.1Å; D1106-I1109 HydrophobicContact CB-CD1 3.9Å; D1106-I1109 HydrophobicContact CB-CG1 3.91Å; D1106-I1109 PolarHBondContact O-N 3.32Å; I1109-Q1111 PolarHBondContact O-N 2.9Å; I1109-R1112 PolarHBondContact O-N 3.14Å; I1109-L1113 HydrophobicContact CG2-CD1 3.68Å; I1109-L1113 HydrophobicContact CG2-CG 4.21Å; I1109-L1113 WeakPolarHBondContact O-CB 3.32Å; I1109-L1113 VanDerWaalsContact O-CG 3.29Å; I1109-L1113 WeakPolarHBondContact O-CG 3.35Å; I1109-L1113 PolarHBondContact O-N 2.9Å
1110Y86.1Confident84.2Confident112 Ų11264.7 Ų64.744%0.43933%0.334SS..Hα-helixtrans-53.9-53.8175.5175.1-88.8000111.9L1101 D1106 R1112 L1113 A1114L1101-Y1110 HydrophobicContact CB-CD2 4.22Å; L1101-Y1110 HydrophobicContact CB-CE2 3.83Å; L1101-Y1110 VanDerWaalsContact O-CD2 3.3Å; L1101-Y1110 WeakPolarHBondContact O-CD2 3.43Å; D1106-Y1110 PolarHBondContact O-N 3.07Å; Y1110-R1112 VanDerWaalsContact C-N 3.3Å; Y1110-R1112 PolarHBondContact O-N 2.92Å; Y1110-L1113 PolarHBondContact O-N 2.85Å; Y1110-A1114 WeakPolarHBondContact O-CB 3.49Å; Y1110-A1114 PolarHBondContact O-N 2.98Å
1111Q84.8Confident83.5Confident126 Ų12665.3 Ų65.359%0.58934%0.339SS*.Hα-helixtrans-62-40.3-175-169.91723.900111.6A1107 I1109 A1114 D1115A1107-Q1111 WeakPolarHBondContact O-CB 3.22Å; A1107-Q1111 PolarHBondContact O-N 3.18Å; I1109-Q1111 PolarHBondContact O-N 2.9Å; Q1111-A1114 PolarHBondContact O-N 3.33Å; Q1111-D1115 VanDerWaalsContact O-CG 3.3Å; Q1111-D1115 PolarHBondContact O-N 2.78Å
1112R81.4Confident82.9Confident87 Ų8767.7 Ų67.733%0.32836%0.361SS..Hα-helixtrans-69.4-40.8178.3-73.3-177.6173.7-179.2-1.4113.4I83 V1108 I1109 Y1110 A1114 D1115 A1116 L1151I83-R1112 VanDerWaalsContact C-NH1 3.26Å; I83-R1112 VanDerWaalsContact CB-NH1 3.27Å; I83-R1112 VanDerWaalsContact CG2-CZ 3.49Å; I83-R1112 VanDerWaalsContact O-CZ 3.3Å; I83-R1112 PolarHBondContact O-NH1 3.48Å; I83-R1112 PolarHBondContact O-NH2 3.11Å; V1108-R1112 WeakPolarHBondContact O-CG 3.38Å; V1108-R1112 PolarHBondContact O-N 3.21Å; I1109-R1112 PolarHBondContact O-N 3.14Å; Y1110-R1112 VanDerWaalsContact C-N 3.3Å; Y1110-R1112 PolarHBondContact O-N 2.92Å; R1112-A1114 VanDerWaalsContact C-N 3.33Å; R1112-D1115 PolarHBondContact O-N 3.21Å; R1112-A1116 WeakPolarHBondContact O-CB 3.01Å; R1112-A1116 PolarHBondContact O-N 3.12Å; R1112-L1151 HydrophobicContact CB-CD1 4.43Å
1113L83.3Confident81.7Confident0 Ų065.9 Ų65.90%035%0.348CS..Hα-helixtrans-64-42.4174.9-71.6172.8000110.8L1101 Q1104 I1109 Y1110 D1115 A1116 F1117 V1148 L1152L1101-L1113 HydrophobicContact CD2-CB 3.46Å; L1101-L1113 VanDerWaalsContact CD2-CB 3.46Å; Q1104-L1113 HydrophobicContact CG-CD1 3.73Å; I1109-L1113 HydrophobicContact CG2-CD1 3.68Å; I1109-L1113 HydrophobicContact CG2-CG 4.21Å; I1109-L1113 WeakPolarHBondContact O-CB 3.32Å; I1109-L1113 VanDerWaalsContact O-CG 3.29Å; I1109-L1113 WeakPolarHBondContact O-CG 3.35Å; I1109-L1113 PolarHBondContact O-N 2.9Å; Y1110-L1113 PolarHBondContact O-N 2.85Å; L1113-D1115 PolarHBondContact O-N 2.95Å; L1113-A1116 PolarHBondContact O-N 2.92Å; L1113-F1117 WeakPolarHBondContact O-CD2 3.09Å; L1113-F1117 PolarHBondContact O-N 3.35Å; L1113-V1148 HydrophobicContact CD2-CB 4.32Å; L1113-V1148 HydrophobicContact CD2-CG1 3.41Å; L1113-V1148 VanDerWaalsContact CD2-CG1 3.41Å; L1113-V1148 HydrophobicContact CD2-CG2 4.07Å; L1113-L1152 HydrophobicContact CD1-CD2 3.69Å; L1113-L1152 HydrophobicContact CD1-CG 4.34Å; L1113-L1152 HydrophobicContact CD2-CD1 3.77Å; L1113-L1152 HydrophobicContact CD2-CD2 4.1Å; L1113-L1152 HydrophobicContact CD2-CG 3.81Å
1114A85.5Confident80.5Confident16 Ų1662.6 Ų62.613%0.13233%0.325CS..Hα-helixtrans-59.5-46.817600000111.3L1101 Y1110 Q1111 R1112 A1116 F1117 N1118L1101-A1114 HydrophobicContact CD1-CB 4.36Å; L1101-A1114 HydrophobicContact CD2-CB 4.28Å; Y1110-A1114 WeakPolarHBondContact O-CB 3.49Å; Y1110-A1114 PolarHBondContact O-N 2.98Å; Q1111-A1114 PolarHBondContact O-N 3.33Å; R1112-A1114 VanDerWaalsContact C-N 3.33Å; A1114-A1116 VanDerWaalsContact C-N 3.33Å; A1114-A1116 PolarHBondContact O-N 3.14Å; A1114-F1117 PolarHBondContact O-N 3.2Å; A1114-N1118 WeakPolarHBondContact O-CB 3.48Å; A1114-N1118 PolarHBondContact O-N 3.39Å; A1114-N1118 PolarHBondContact O-ND2 3.04Å; A1114-N1118 VanDerWaalsContact O-ND2 3.1Å
1115D85.9Confident79.8Confident86 Ų8665.4 Ų65.446%0.4635%0.346SS..Hα-helixtrans-61.7-39.5176.1-70.7-21.2000112.4Q1111 R1112 L1113 K1119Q1111-D1115 VanDerWaalsContact O-CG 3.3Å; Q1111-D1115 PolarHBondContact O-N 2.78Å; R1112-D1115 PolarHBondContact O-N 3.21Å; L1113-D1115 PolarHBondContact O-N 2.95Å; D1115-K1119 WeakPolarHBondContact O-CG 3.3Å; D1115-K1119 PolarHBondContact O-N 3.32Å
1116A84.9Confident79.4Confident13 Ų1360.2 Ų60.211%0.10734%0.337CS..Hα-helixtrans-67.6-45.7179.200000112.3R1112 L1113 A1114 N1118 K1119 L1120 F1144 V1148R1112-A1116 WeakPolarHBondContact O-CB 3.01Å; R1112-A1116 PolarHBondContact O-N 3.12Å; L1113-A1116 PolarHBondContact O-N 2.92Å; A1114-A1116 VanDerWaalsContact C-N 3.33Å; A1114-A1116 PolarHBondContact O-N 3.14Å; A1116-N1118 VanDerWaalsContact C-N 3.35Å; A1116-K1119 PolarHBondContact O-N 3.01Å; A1116-L1120 WeakPolarHBondContact O-CB 3.38Å; A1116-L1120 PolarHBondContact O-N 3.36Å; A1116-F1144 HydrophobicContact CB-CD2 3.76Å; A1116-F1144 HydrophobicContact CB-CE2 3.86Å; A1116-V1148 HydrophobicContact CB-CG2 3.48Å; A1116-V1148 VanDerWaalsContact CB-CG2 3.48Å
1117F86.6Confident79.1Confident7 Ų757.7 Ų57.73%0.03132%0.324CS..Hα-helixtrans-65.5-37.1175.8-79.7-65.2000112.5F1062 V1066 V1097 L1100 L1101 L1113 A1114 K1119 L1120 T1121 F1144F1062-F1117 AromaticContact CE2-CE1 3.96Å; F1062-F1117 HydrophobicContact CE2-CE1 3.96Å; F1062-F1117 HydrophobicContact CE2-CZ 4.26Å; F1062-F1117 HydrophobicContact CZ-CE1 4.16Å; F1062-F1117 AromaticContact CZ-CZ 3.98Å; F1062-F1117 HydrophobicContact CZ-CZ 3.98Å; V1066-F1117 HydrophobicContact CG1-CZ 4.06Å; V1097-F1117 HydrophobicContact CG1-CB 3.96Å; V1097-F1117 HydrophobicContact CG1-CD1 4.02Å; V1097-F1117 HydrophobicContact CG1-CD2 3.84Å; V1097-F1117 HydrophobicContact CG1-CE1 4.49Å; V1097-F1117 HydrophobicContact CG1-CE2 4.34Å; V1097-F1117 HydrophobicContact CG1-CG 3.68Å; V1097-F1117 HydrophobicContact CG2-CD1 3.73Å; V1097-F1117 HydrophobicContact CG2-CE1 3.79Å; V1097-F1117 HydrophobicContact CG2-CG 4.27Å; V1097-F1117 HydrophobicContact CG2-CZ 4.36Å; L1100-F1117 HydrophobicContact CD2-CE2 3.84Å; L1100-F1117 HydrophobicContact CD2-CZ 3.72Å; L1101-F1117 HydrophobicContact CD2-CD2 4.27Å; L1113-F1117 WeakPolarHBondContact O-CD2 3.09Å; L1113-F1117 PolarHBondContact O-N 3.35Å; A1114-F1117 PolarHBondContact O-N 3.2Å; F1117-K1119 VanDerWaalsContact C-N 3.35Å; F1117-L1120 HydrophobicContact CD1-CD2 4.45Å; F1117-L1120 PolarHBondContact O-N 3.49Å; F1117-T1121 PolarHBondContact O-N 3.13Å; F1117-T1121 PolarHBondContact O-OG1 3.14Å; F1117-T1121 VanDerWaalsContact O-OG1 3.13Å; F1117-F1144 AromaticContact CD1-CE2 3.69Å; F1117-F1144 HydrophobicContact CD1-CE2 3.69Å; F1117-F1144 AromaticContact CD1-CZ 3.96Å; F1117-F1144 HydrophobicContact CD1-CZ 3.96Å; F1117-F1144 HydrophobicContact CD2-CE2 4.24Å; F1117-F1144 HydrophobicContact CE1-CE1 4.47Å; F1117-F1144 AromaticContact CE1-CE2 3.7Å; F1117-F1144 HydrophobicContact CE1-CE2 3.7Å; F1117-F1144 AromaticContact CE1-CZ 3.45Å; F1117-F1144 HydrophobicContact CE1-CZ 3.45Å; F1117-F1144 VanDerWaalsContact CE1-CZ 3.45Å; F1117-F1144 HydrophobicContact CE2-CE2 4.24Å; F1117-F1144 HydrophobicContact CE2-CZ 4.11Å; F1117-F1144 AromaticContact CG-CE2 3.96Å; F1117-F1144 HydrophobicContact CG-CE2 3.96Å; F1117-F1144 HydrophobicContact CG-CZ 4.48Å; F1117-F1144 AromaticContact CZ-CE2 3.98Å; F1117-F1144 HydrophobicContact CZ-CE2 3.98Å; F1117-F1144 AromaticContact CZ-CZ 3.53Å; F1117-F1144 HydrophobicContact CZ-CZ 3.53Å
1118N85.1Confident78.9Confident107 Ų10757.2 Ų57.257%0.57231%0.314SS*.Hα-helixtrans-62.2-42.6173.9-74.8-27.3000111.5A1114 A1116 A1122A1114-N1118 WeakPolarHBondContact O-CB 3.48Å; A1114-N1118 PolarHBondContact O-N 3.39Å; A1114-N1118 PolarHBondContact O-ND2 3.04Å; A1114-N1118 VanDerWaalsContact O-ND2 3.1Å; A1116-N1118 VanDerWaalsContact C-N 3.35Å; N1118-A1122 VanDerWaalsContact O-CB 3.3Å; N1118-A1122 WeakPolarHBondContact O-CB 3.41Å; N1118-A1122 PolarHBondContact O-N 3.4Å; N1118-A1122 VanDerWaalsContact O-N 3.1Å
1119K85.3Confident78.8Confident138 Ų13857.4 Ų57.460%0.631%0.311SS*.Hα-helixtrans-67.4-39.8176.3-75.8179-177.6-178.40112.8D1115 A1116 F1117 T1121 A1122D1115-K1119 WeakPolarHBondContact O-CG 3.3Å; D1115-K1119 PolarHBondContact O-N 3.32Å; A1116-K1119 PolarHBondContact O-N 3.01Å; F1117-K1119 VanDerWaalsContact C-N 3.35Å; K1119-T1121 PolarHBondContact O-N 2.82Å; K1119-A1122 PolarHBondContact O-N 3.47Å
1120L82.3Confident78.8Confident4 Ų460.1 Ų60.12%0.02133%0.325CS..Hα-helixtrans-56.8-37.2-178.8-176.560.7000112.3A1116 F1117 F1137 L1141 F1144A1116-L1120 WeakPolarHBondContact O-CB 3.38Å; A1116-L1120 PolarHBondContact O-N 3.36Å; F1117-L1120 HydrophobicContact CD1-CD2 4.45Å; F1117-L1120 PolarHBondContact O-N 3.49Å; L1120-F1137 HydrophobicContact CD1-CD2 4.25Å; L1120-F1137 HydrophobicContact CD1-CE2 3.83Å; L1120-F1137 HydrophobicContact CD1-CZ 4.09Å; L1120-F1137 HydrophobicContact CD2-CE2 4.34Å; L1120-F1137 HydrophobicContact CD2-CZ 4.45Å; L1120-F1137 HydrophobicContact CG-CD2 4.44Å; L1120-F1137 HydrophobicContact CG-CE2 3.76Å; L1120-F1137 HydrophobicContact CG-CZ 4.25Å; L1120-L1141 HydrophobicContact CD1-CB 3.94Å; L1120-L1141 HydrophobicContact CD1-CD1 3.98Å; L1120-L1141 HydrophobicContact CD2-CD1 4.4Å; L1120-F1144 HydrophobicContact CB-CD2 4.21Å; L1120-F1144 HydrophobicContact CD1-CB 4.12Å; L1120-F1144 HydrophobicContact CD1-CG 4.48Å; L1120-F1144 HydrophobicContact CD2-CD1 4.47Å; L1120-F1144 HydrophobicContact CD2-CD2 4.07Å; L1120-F1144 HydrophobicContact CD2-CE2 4.34Å; L1120-F1144 HydrophobicContact CD2-CG 4.15Å
1121T73.7Confident78.6Confident31 Ų3164.8 Ų64.819%0.1934%0.342CS..Hα-helixtrans-103.4-2.7-177.255.10000114.4Y1093 F1117 K1119 S1123 S1124 T1125Y1093-T1121 HydrophobicContact CE1-CG2 3.79Å; F1117-T1121 PolarHBondContact O-N 3.13Å; F1117-T1121 PolarHBondContact O-OG1 3.14Å; F1117-T1121 VanDerWaalsContact O-OG1 3.13Å; K1119-T1121 PolarHBondContact O-N 2.82Å; T1121-S1123 VanDerWaalsContact C-N 3.34Å; T1121-S1123 PolarHBondContact O-N 2.91Å; T1121-S1124 CarbonylContact O-C 3.52Å; T1121-S1124 PolarHBondContact O-N 3.33Å; T1121-T1125 PolarHBondContact O-OG1 3.5Å
1122A74.4Confident78.5Confident68 Ų6867 Ų6756%0.56235%0.35SS*.Hα-helixtrans-64.4-32.7-176.200000113.9N1118 K1119 S1124 T1125N1118-A1122 VanDerWaalsContact O-CB 3.3Å; N1118-A1122 WeakPolarHBondContact O-CB 3.41Å; N1118-A1122 PolarHBondContact O-N 3.4Å; N1118-A1122 VanDerWaalsContact O-N 3.1Å; K1119-A1122 PolarHBondContact O-N 3.47Å; A1122-S1124 VanDerWaalsContact C-N 3.31Å; A1122-T1125 PolarHBondContact O-OG1 3.35Å
1123S61.5Low78.6Confident54 Ų5465.2 Ų65.238%0.37835%0.345SS..THydrogen-bonded Turntrans-83.7-7.1179.251.60000113.8T1121T1121-S1123 VanDerWaalsContact C-N 3.34Å; T1121-S1123 PolarHBondContact O-N 2.91Å
1124S61.3Low78.6Confident1 Ų166.9 Ų66.91%0.00735%0.352CS..SBendtrans-139.553.2-170600000110.1T1121 A1122 P1126 P1127T1121-S1124 CarbonylContact O-C 3.52Å; T1121-S1124 PolarHBondContact O-N 3.33Å; A1122-S1124 VanDerWaalsContact C-N 3.31Å; S1124-P1126 CarbonylContact O-C 3.58Å; S1124-P1127 WeakPolarHBondContact O-CA 3.41Å; S1124-P1127 VanDerWaalsContact O-CB 3.27Å; S1124-P1127 WeakPolarHBondContact O-CB 3.36Å; S1124-P1127 WeakPolarHBondContact O-CD 3.3Å
1125T69.1Low78.5Confident105 Ų10570.4 Ų70.464%0.64437%0.372SS*.SBendtrans-117.7110.5-178.2-2.60000111.6T1121 A1122T1121-T1125 PolarHBondContact O-OG1 3.5Å; A1122-T1125 PolarHBondContact O-OG1 3.35Å
1126P70.1Confident78.4Confident84 Ų8468 Ų6855%0.54536%0.364SS..SBendcis-71.1150.1-9.131.7-33.6000111.4S1124 T1128S1124-P1126 CarbonylContact O-C 3.58Å; P1126-T1128 PolarHBondContact O-N 2.98Å
1127P73.7Confident78.5Confident14 Ų1467.4 Ų67.49%0.09136%0.359CS..  trans-73.4123.7-178.726.1-30.5000108.8V1086 Q1090 S1124V1086-P1127 HydrophobicContact CG1-CG 4.1Å; Q1090-P1127 HydrophobicContact CG-CG 4.08Å; Q1090-P1127 PolarHBondContact NE2-O 3.43Å; S1124-P1127 WeakPolarHBondContact O-CA 3.41Å; S1124-P1127 VanDerWaalsContact O-CB 3.27Å; S1124-P1127 WeakPolarHBondContact O-CB 3.36Å; S1124-P1127 WeakPolarHBondContact O-CD 3.3Å
1128T79.3Confident78.3Confident65 Ų6568.6 Ų68.640%0.39937%0.366SS..  trans-117.5156.7177.959.60000110.3Y1083 P1126 D1130 Q1133Y1083-T1128 PolarHBondContact OH-O 3.09Å; P1126-T1128 PolarHBondContact O-N 2.98Å; T1128-D1130 PolarHBondContact O-N 3.09Å; T1128-Q1133 PolarHBondContact OG1-NE2 3.41Å; T1128-Q1133 PolarHBondContact OG1-OE1 3.26Å
1129M80.4Confident78Confident76 Ų7670 Ų7037%0.37437%0.367SS..SBendtrans-71.561177-61.9-66.6-165.200112A1041 T1084 C1087A1041-M1129 HydrophobicContact CB-CE 4.29Å; T1084-M1129 HydrophobicContact CG2-CE 4.31Å; T1084-M1129 HydrophobicContact CG2-SD 3.96Å; T1084-M1129 WeakPolarHBondContact O-CE 3.4Å; C1087-M1129 HydrophobicContact CB-CE 3.7Å; C1087-M1129 HydrophobicContact CB-CG 4.25Å; C1087-M1129 HydrophobicContact CB-SD 3.7Å
1130D80.6Confident78Confident68 Ų6864.8 Ų64.836%0.36435%0.347SS..  trans-111135.3178172.764.5000110.8Y1083 T1128 K1132 Q1133 K1134Y1083-D1130 PolarHBondContact OH-O 3.25Å; T1128-D1130 PolarHBondContact O-N 3.09Å; D1130-K1132 VanDerWaalsContact C-N 3.3Å; D1130-K1132 PolarHBondContact O-N 3.48Å; D1130-K1132 WeakPolarHBondContact OD2-CA 3.32Å; D1130-K1132 VanDerWaalsContact OD2-CB 3.26Å; D1130-K1132 WeakPolarHBondContact OD2-CB 3.4Å; D1130-K1132 PolarHBondContact OD2-N 3.43Å; D1130-Q1133 HydrophobicContact CB-CB 4.27Å; D1130-Q1133 HydrophobicContact CB-CG 4.28Å; D1130-Q1133 PolarHBondContact O-N 2.84Å; D1130-Q1133 PolarHBondContact OD2-N 3.16Å; D1130-Q1133 VanDerWaalsContact OD2-N 3.07Å; D1130-K1134 PolarHBondContact O-N 2.85Å
1131R80.7Confident78Confident211 Ų21164.7 Ų64.780%0.79635%0.347SS*.Hα-helixtrans-61.2-35.7-177.2-173.7177.1176.7179.41.2112.6V1135R1131-V1135 WeakPolarHBondContact O-CG2 3.48Å; R1131-V1135 PolarHBondContact O-N 3.46Å; R1131-V1135 VanDerWaalsContact O-N 3.14Å
1132K82.9Confident78Confident173 Ų17366 Ų6675%0.75235%0.351SS*.Hα-helixtrans-71.7-41.2179.7-61.9179.5176.5177.20111D1130 V1135 A1136D1130-K1132 VanDerWaalsContact C-N 3.3Å; D1130-K1132 PolarHBondContact O-N 3.48Å; D1130-K1132 WeakPolarHBondContact OD2-CA 3.32Å; D1130-K1132 VanDerWaalsContact OD2-CB 3.26Å; D1130-K1132 WeakPolarHBondContact OD2-CB 3.4Å; D1130-K1132 PolarHBondContact OD2-N 3.43Å; K1132-V1135 PolarHBondContact O-N 3.48Å; K1132-A1136 PolarHBondContact O-N 3.47Å; K1132-A1136 VanDerWaalsContact O-N 3.08Å
1133Q83.8Confident78.1Confident48 Ų4868 Ų6822%0.22435%0.349CS..Hα-helixtrans-65.2-38.7174.5-69.7-169.913.100112.3Y1083 T1128 D1130 A1136 F1137Y1083-Q1133 WeakPolarHBondContact OH-CB 3.36Å; T1128-Q1133 PolarHBondContact OG1-NE2 3.41Å; T1128-Q1133 PolarHBondContact OG1-OE1 3.26Å; D1130-Q1133 HydrophobicContact CB-CB 4.27Å; D1130-Q1133 HydrophobicContact CB-CG 4.28Å; D1130-Q1133 PolarHBondContact O-N 2.84Å; D1130-Q1133 PolarHBondContact OD2-N 3.16Å; D1130-Q1133 VanDerWaalsContact OD2-N 3.07Å; Q1133-A1136 PolarHBondContact O-N 2.91Å; Q1133-F1137 WeakPolarHBondContact O-CB 3.29Å; Q1133-F1137 PolarHBondContact O-N 3.41Å
1134K83.9Confident79Confident35 Ų3565.7 Ų65.715%0.15233%0.332CS..Hα-helixtrans-56.9-51.9173.8-174.6176175.9-177.10111.4E1080 Y1083 D1130 A1136 F1137 L1138E1080-K1134 WeakPolarHBondContact OE1-CE 3.27Å; E1080-K1134 IonicContact OE1-NZ 3.45Å; E1080-K1134 PolarHBondContact OE1-NZ 3.27Å; E1080-K1134 WeakPolarHBondContact OE2-CE 3.11Å; E1080-K1134 IonicContact OE2-NZ 2.77Å; E1080-K1134 PolarHBondContact OE2-NZ 3.49Å; Y1083-K1134 HydrophobicContact CD1-CB 3.78Å; Y1083-K1134 HydrophobicContact CD1-CD 4.21Å; Y1083-K1134 HydrophobicContact CD1-CG 3.64Å; Y1083-K1134 HydrophobicContact CE1-CB 3.43Å; Y1083-K1134 VanDerWaalsContact CE1-CB 3.43Å; Y1083-K1134 HydrophobicContact CE1-CD 4.46Å; Y1083-K1134 HydrophobicContact CE1-CG 3.85Å; Y1083-K1134 HydrophobicContact CG-CG 4.3Å; Y1083-K1134 PolarHBondContact OH-N 3.07Å; Y1083-K1134 VanDerWaalsContact OH-N 3.13Å; D1130-K1134 PolarHBondContact O-N 2.85Å; K1134-A1136 VanDerWaalsContact C-N 3.32Å; K1134-A1136 PolarHBondContact O-N 3Å; K1134-F1137 PolarHBondContact O-N 3.37Å; K1134-L1138 HydrophobicContact CG-CD1 4.38Å; K1134-L1138 WeakPolarHBondContact O-CG 3.29Å; K1134-L1138 PolarHBondContact O-N 3.47Å
1135V83.1Confident79.6Confident91 Ų9166.5 Ų66.555%0.55234%0.337SS*.Hα-helixtrans-61.2-411791730000111.7R1131 K1132 K1139R1131-V1135 WeakPolarHBondContact O-CG2 3.48Å; R1131-V1135 PolarHBondContact O-N 3.46Å; R1131-V1135 VanDerWaalsContact O-N 3.14Å; K1132-V1135 PolarHBondContact O-N 3.48Å; V1135-K1139 PolarHBondContact O-N 2.86Å
1136A84.2Confident79.6Confident35 Ų3563 Ų6329%0.28932%0.319SS..Hα-helixtrans-65-41.2176.100000112.2K1132 Q1133 K1134 K1139 S1140K1132-A1136 PolarHBondContact O-N 3.47Å; K1132-A1136 VanDerWaalsContact O-N 3.08Å; Q1133-A1136 PolarHBondContact O-N 2.91Å; K1134-A1136 VanDerWaalsContact C-N 3.32Å; K1134-A1136 PolarHBondContact O-N 3Å; A1136-K1139 PolarHBondContact O-N 3.06Å; A1136-S1140 PolarHBondContact O-N 3.17Å; A1136-S1140 PolarHBondContact O-OG 3.46Å
1137F85.8Confident79.7Confident1 Ų163.2 Ų63.20%0.00432%0.315CS..Hα-helixtrans-63.2-46.6176.1177.7-90.4000111.9L1082 Y1083 L1120 Q1133 K1134 K1139 S1140 L1141L1082-F1137 HydrophobicContact CD2-CE1 4.5Å; L1082-F1137 HydrophobicContact CD2-CZ 4.14Å; L1082-F1137 HydrophobicContact CG-CZ 4.36Å; Y1083-F1137 HydrophobicContact CD2-CB 3.57Å; Y1083-F1137 AromaticContact CD2-CD1 3.66Å; Y1083-F1137 HydrophobicContact CD2-CD1 3.66Å; Y1083-F1137 AromaticContact CD2-CD2 3.91Å; Y1083-F1137 HydrophobicContact CD2-CD2 3.91Å; Y1083-F1137 HydrophobicContact CD2-CE1 4.29Å; Y1083-F1137 AromaticContact CD2-CG 3.43Å; Y1083-F1137 HydrophobicContact CD2-CG 3.43Å; Y1083-F1137 VanDerWaalsContact CD2-CG 3.43Å; Y1083-F1137 HydrophobicContact CE2-CB 3.81Å; Y1083-F1137 HydrophobicContact CE2-CD2 4.49Å; Y1083-F1137 HydrophobicContact CE2-CG 4.11Å; Y1083-F1137 HydrophobicContact CG-CB 4.45Å; Y1083-F1137 HydrophobicContact CG-CD1 4.04Å; Y1083-F1137 HydrophobicContact CG-CG 4.26Å; L1120-F1137 HydrophobicContact CD1-CD2 4.25Å; L1120-F1137 HydrophobicContact CD1-CE2 3.83Å; L1120-F1137 HydrophobicContact CD1-CZ 4.09Å; L1120-F1137 HydrophobicContact CD2-CE2 4.34Å; L1120-F1137 HydrophobicContact CD2-CZ 4.45Å; L1120-F1137 HydrophobicContact CG-CD2 4.44Å; L1120-F1137 HydrophobicContact CG-CE2 3.76Å; L1120-F1137 HydrophobicContact CG-CZ 4.25Å; Q1133-F1137 WeakPolarHBondContact O-CB 3.29Å; Q1133-F1137 PolarHBondContact O-N 3.41Å; K1134-F1137 PolarHBondContact O-N 3.37Å; F1137-K1139 VanDerWaalsContact C-N 3.27Å; F1137-K1139 PolarHBondContact O-N 3.34Å; F1137-S1140 CarbonylContact O-C 3.57Å; F1137-S1140 PolarHBondContact O-N 3.33Å; F1137-S1140 VanDerWaalsContact O-N 3.1Å; F1137-L1141 HydrophobicContact CE1-CB 4.41Å; F1137-L1141 HydrophobicContact CE1-CD2 4.23Å; F1137-L1141 WeakPolarHBondContact O-CB 3.17Å; F1137-L1141 PolarHBondContact O-N 2.84Å
1138L83.4Confident79.7Confident31 Ų3162.7 Ų62.716%0.16231%0.312CS..Hα-helixtrans-57.8-41.8177.9-69.1175.6000111.6G1079 E1080 K1134 L1141 E1142G1079-L1138 VanDerWaalsContact C-CD2 3.43Å; E1080-L1138 HydrophobicContact CG-CD1 3.99Å; E1080-L1138 HydrophobicContact CG-CD2 4.1Å; K1134-L1138 HydrophobicContact CG-CD1 4.38Å; K1134-L1138 WeakPolarHBondContact O-CG 3.29Å; K1134-L1138 PolarHBondContact O-N 3.47Å; L1138-L1141 WeakPolarHBondContact O-CB 3.5Å; L1138-L1141 PolarHBondContact O-N 2.94Å; L1138-E1142 PolarHBondContact O-N 3.15Å; L1138-E1142 VanDerWaalsContact O-N 3.12Å
1139K79.1Confident79Confident138 Ų13860 Ų6060%0.630%0.298SS*.Hα-helixtrans-62.9-44.7174.7-171.1178.9-179.7179.50112.2V1135 A1136 F1137 L1141 E1142 E1143V1135-K1139 PolarHBondContact O-N 2.86Å; A1136-K1139 PolarHBondContact O-N 3.06Å; F1137-K1139 VanDerWaalsContact C-N 3.27Å; F1137-K1139 PolarHBondContact O-N 3.34Å; K1139-L1141 VanDerWaalsContact C-N 3.28Å; K1139-L1141 PolarHBondContact O-N 2.99Å; K1139-E1142 PolarHBondContact O-N 3.18Å; K1139-E1143 PolarHBondContact O-N 2.92Å
1140S84.3Confident78.2Confident27 Ų2757.3 Ų57.319%0.18929%0.289CS..Hα-helixtrans-66-30.7175.9-61.90000112.6A1136 F1137 E1143 F1144A1136-S1140 PolarHBondContact O-N 3.17Å; A1136-S1140 PolarHBondContact O-OG 3.46Å; F1137-S1140 CarbonylContact O-C 3.57Å; F1137-S1140 PolarHBondContact O-N 3.33Å; F1137-S1140 VanDerWaalsContact O-N 3.1Å; S1140-E1143 PolarHBondContact O-N 3.09Å; S1140-F1144 WeakPolarHBondContact O-CB 3.09Å; S1140-F1144 PolarHBondContact O-N 3.39Å
1141L82.7Confident77.6Confident2 Ų255.2 Ų55.21%0.0128%0.277CS..Hα-helixtrans-68-38.8176.7-176.367.1000111.4L1065 L1082 L1120 F1137 L1138 K1139 E1143 F1144 V1145L1065-L1141 HydrophobicContact CD1-CD2 4.35Å; L1082-L1141 HydrophobicContact CD2-CD1 4.3Å; L1120-L1141 HydrophobicContact CD1-CB 3.94Å; L1120-L1141 HydrophobicContact CD1-CD1 3.98Å; L1120-L1141 HydrophobicContact CD2-CD1 4.4Å; F1137-L1141 HydrophobicContact CE1-CB 4.41Å; F1137-L1141 HydrophobicContact CE1-CD2 4.23Å; F1137-L1141 WeakPolarHBondContact O-CB 3.17Å; F1137-L1141 PolarHBondContact O-N 2.84Å; L1138-L1141 WeakPolarHBondContact O-CB 3.5Å; L1138-L1141 PolarHBondContact O-N 2.94Å; K1139-L1141 VanDerWaalsContact C-N 3.28Å; K1139-L1141 PolarHBondContact O-N 2.99Å; L1141-E1143 PolarHBondContact O-N 3.25Å; L1141-F1144 HydrophobicContact CD1-CD1 4.32Å; L1141-F1144 WeakPolarHBondContact O-CB 3.4Å; L1141-F1144 PolarHBondContact O-N 2.91Å; L1141-V1145 HydrophobicContact CD1-CG2 4.37Å; L1141-V1145 HydrophobicContact CG-CG2 4.43Å; L1141-V1145 WeakPolarHBondContact O-CG2 3.21Å; L1141-V1145 PolarHBondContact O-N 3.23Å
1142E74.5Confident76.8Confident60 Ų6045.9 Ų45.928%0.2824%0.243SC..Hα-helixtrans-61.3-44.4174.2-69.9-179.8152.900111.4R245 L1138 K1139 F1144 A1146R245-E1142 IonicContact CZ-OE1 2.75Å; R245-E1142 IonicContact NH1-OE1 2.6Å; R245-E1142 PolarHBondContact NH1-OE1 3.35Å; L1138-E1142 PolarHBondContact O-N 3.15Å; L1138-E1142 VanDerWaalsContact O-N 3.12Å; K1139-E1142 PolarHBondContact O-N 3.18Å; E1142-F1144 VanDerWaalsContact C-N 3.33Å; E1142-F1144 PolarHBondContact O-N 2.68Å; E1142-A1146 WeakPolarHBondContact O-CB 3.33Å; E1142-A1146 PolarHBondContact O-N 3.42Å; E1142-A1146 VanDerWaalsContact O-N 3.16Å
1143E76.1Confident75.6Confident108 Ų10839.1 Ų39.151%0.50522%0.217SC..Hα-helixtrans-64.1-38173.2-66.6-176.8-168.400112.1K1139 S1140 L1141 N1147K1139-E1143 PolarHBondContact O-N 2.92Å; S1140-E1143 PolarHBondContact O-N 3.09Å; L1141-E1143 PolarHBondContact O-N 3.25Å; E1143-N1147 WeakPolarHBondContact O-CB 3.29Å; E1143-N1147 VanDerWaalsContact O-CG 3.29Å; E1143-N1147 PolarHBondContact O-N 3.44Å; E1143-N1147 VanDerWaalsContact O-N 3.14Å; E1143-N1147 PolarHBondContact O-ND2 3.3Å
1144F79.3Confident73.9Confident7 Ų739.2 Ų39.23%0.03122%0.221CC..Hα-helixtrans-63-53.1177.8176.6-88.1000111.3V1066 A1116 F1117 L1120 S1140 L1141 E1142 A1146 N1147 V1148V1066-F1144 HydrophobicContact CG1-CE1 4.47Å; V1066-F1144 HydrophobicContact CG1-CZ 4.45Å; V1066-F1144 HydrophobicContact CG2-CE1 4.15Å; A1116-F1144 HydrophobicContact CB-CD2 3.76Å; A1116-F1144 HydrophobicContact CB-CE2 3.86Å; F1117-F1144 AromaticContact CD1-CE2 3.69Å; F1117-F1144 HydrophobicContact CD1-CE2 3.69Å; F1117-F1144 AromaticContact CD1-CZ 3.96Å; F1117-F1144 HydrophobicContact CD1-CZ 3.96Å; F1117-F1144 HydrophobicContact CD2-CE2 4.24Å; F1117-F1144 HydrophobicContact CE1-CE1 4.47Å; F1117-F1144 AromaticContact CE1-CE2 3.7Å; F1117-F1144 HydrophobicContact CE1-CE2 3.7Å; F1117-F1144 AromaticContact CE1-CZ 3.45Å; F1117-F1144 HydrophobicContact CE1-CZ 3.45Å; F1117-F1144 VanDerWaalsContact CE1-CZ 3.45Å; F1117-F1144 HydrophobicContact CE2-CE2 4.24Å; F1117-F1144 HydrophobicContact CE2-CZ 4.11Å; F1117-F1144 AromaticContact CG-CE2 3.96Å; F1117-F1144 HydrophobicContact CG-CE2 3.96Å; F1117-F1144 HydrophobicContact CG-CZ 4.48Å; F1117-F1144 AromaticContact CZ-CE2 3.98Å; F1117-F1144 HydrophobicContact CZ-CE2 3.98Å; F1117-F1144 AromaticContact CZ-CZ 3.53Å; F1117-F1144 HydrophobicContact CZ-CZ 3.53Å; L1120-F1144 HydrophobicContact CB-CD2 4.21Å; L1120-F1144 HydrophobicContact CD1-CB 4.12Å; L1120-F1144 HydrophobicContact CD1-CG 4.48Å; L1120-F1144 HydrophobicContact CD2-CD1 4.47Å; L1120-F1144 HydrophobicContact CD2-CD2 4.07Å; L1120-F1144 HydrophobicContact CD2-CE2 4.34Å; L1120-F1144 HydrophobicContact CD2-CG 4.15Å; S1140-F1144 WeakPolarHBondContact O-CB 3.09Å; S1140-F1144 PolarHBondContact O-N 3.39Å; L1141-F1144 HydrophobicContact CD1-CD1 4.32Å; L1141-F1144 WeakPolarHBondContact O-CB 3.4Å; L1141-F1144 PolarHBondContact O-N 2.91Å; E1142-F1144 VanDerWaalsContact C-N 3.33Å; E1142-F1144 PolarHBondContact O-N 2.68Å; F1144-A1146 VanDerWaalsContact C-N 3.3Å; F1144-A1146 PolarHBondContact O-N 2.86Å; F1144-N1147 PolarHBondContact O-N 3.11Å; F1144-N1147 VanDerWaalsContact O-N 3.11Å; F1144-V1148 HydrophobicContact CD1-CB 4.4Å; F1144-V1148 HydrophobicContact CD2-CG2 3.93Å; F1144-V1148 HydrophobicContact CE1-CB 4.09Å; F1144-V1148 HydrophobicContact CE1-CG1 4.07Å; F1144-V1148 HydrophobicContact CE1-CG2 4.33Å; F1144-V1148 HydrophobicContact CE2-CB 4.37Å; F1144-V1148 HydrophobicContact CE2-CG1 4.45Å; F1144-V1148 HydrophobicContact CE2-CG2 3.74Å; F1144-V1148 HydrophobicContact CG-CG2 4.3Å; F1144-V1148 HydrophobicContact CZ-CB 4.07Å; F1144-V1148 HydrophobicContact CZ-CG1 3.84Å; F1144-V1148 HydrophobicContact CZ-CG2 3.94Å; F1144-V1148 VanDerWaalsContact O-CB 3.22Å; F1144-V1148 WeakPolarHBondContact O-CB 3.48Å; F1144-V1148 WeakPolarHBondContact O-CG2 3.37Å; F1144-V1148 PolarHBondContact O-N 2.75Å
1145V74.8Confident71.5Confident17 Ų1749 Ų4910%0.10326%0.264CS..Hα-helixtrans-59-42.5-179.5173.50000110.6L1141 N1147 V1148 G1149L1141-V1145 HydrophobicContact CD1-CG2 4.37Å; L1141-V1145 HydrophobicContact CG-CG2 4.43Å; L1141-V1145 WeakPolarHBondContact O-CG2 3.21Å; L1141-V1145 PolarHBondContact O-N 3.23Å; V1145-N1147 VanDerWaalsContact C-N 3.33Å; V1145-N1147 PolarHBondContact O-N 2.95Å; V1145-V1148 PolarHBondContact O-N 2.9Å; V1145-G1149 PolarHBondContact O-N 3.15Å
1146A68.9Low71Confident33 Ų3347 Ų4727%0.27325%0.249SC..Hα-helixtrans-63.7-34.1177.800000113.7E1142 F1144E1142-A1146 WeakPolarHBondContact O-CB 3.33Å; E1142-A1146 PolarHBondContact O-N 3.42Å; E1142-A1146 VanDerWaalsContact O-N 3.16Å; F1144-A1146 VanDerWaalsContact C-N 3.3Å; F1144-A1146 PolarHBondContact O-N 2.86Å
1147N72.3Confident70.3Confident87 Ų8747.6 Ų47.647%0.46525%0.247SC..Hα-helixtrans-87.3-28-179-73.3-47.2000113.4E1143 F1144 V1145E1143-N1147 WeakPolarHBondContact O-CB 3.29Å; E1143-N1147 VanDerWaalsContact O-CG 3.29Å; E1143-N1147 PolarHBondContact O-N 3.44Å; E1143-N1147 VanDerWaalsContact O-N 3.14Å; E1143-N1147 PolarHBondContact O-ND2 3.3Å; F1144-N1147 PolarHBondContact O-N 3.11Å; F1144-N1147 VanDerWaalsContact O-N 3.11Å; V1145-N1147 VanDerWaalsContact C-N 3.33Å; V1145-N1147 PolarHBondContact O-N 2.95Å
1148V72.9Confident69.4Low3 Ų350.2 Ų50.22%0.01826%0.261CS..Hα-helixtrans-108.7-27.9-167.8175.80000113.2L1113 A1116 F1144 V1145 G1150 L1151 L1152L1113-V1148 HydrophobicContact CD2-CB 4.32Å; L1113-V1148 HydrophobicContact CD2-CG1 3.41Å; L1113-V1148 VanDerWaalsContact CD2-CG1 3.41Å; L1113-V1148 HydrophobicContact CD2-CG2 4.07Å; A1116-V1148 HydrophobicContact CB-CG2 3.48Å; A1116-V1148 VanDerWaalsContact CB-CG2 3.48Å; F1144-V1148 HydrophobicContact CD1-CB 4.4Å; F1144-V1148 HydrophobicContact CD2-CG2 3.93Å; F1144-V1148 HydrophobicContact CE1-CB 4.09Å; F1144-V1148 HydrophobicContact CE1-CG1 4.07Å; F1144-V1148 HydrophobicContact CE1-CG2 4.33Å; F1144-V1148 HydrophobicContact CE2-CB 4.37Å; F1144-V1148 HydrophobicContact CE2-CG1 4.45Å; F1144-V1148 HydrophobicContact CE2-CG2 3.74Å; F1144-V1148 HydrophobicContact CG-CG2 4.3Å; F1144-V1148 HydrophobicContact CZ-CB 4.07Å; F1144-V1148 HydrophobicContact CZ-CG1 3.84Å; F1144-V1148 HydrophobicContact CZ-CG2 3.94Å; F1144-V1148 VanDerWaalsContact O-CB 3.22Å; F1144-V1148 WeakPolarHBondContact O-CB 3.48Å; F1144-V1148 WeakPolarHBondContact O-CG2 3.37Å; F1144-V1148 PolarHBondContact O-N 2.75Å; V1145-V1148 PolarHBondContact O-N 2.9Å; V1148-G1150 VanDerWaalsContact C-N 3.28Å; V1148-G1150 PolarHBondContact O-N 3.31Å; V1148-L1151 WeakPolarHBondContact O-CA 3.41Å; V1148-L1151 WeakPolarHBondContact O-CB 3.32Å; V1148-L1151 PolarHBondContact O-N 2.94Å; V1148-L1152 HydrophobicContact CG1-CB 4.34Å; V1148-L1152 HydrophobicContact CG1-CD1 3.31Å; V1148-L1152 HydrophobicContact CG1-CG 3.71Å; V1148-L1152 PolarHBondContact O-N 3.44Å; V1148-L1152 VanDerWaalsContact O-N 3.15Å
1149G65Low68.6Low10 Ų1051.3 Ų51.310%0.10327%0.267CS..Hα-helixtrans-55-40.3-176.700000113.7V1145 L1151 C1153V1145-G1149 PolarHBondContact O-N 3.15Å; G1149-L1151 VanDerWaalsContact C-N 3.28Å; G1149-L1151 PolarHBondContact O-N 3.26Å; G1149-C1153 WeakPolarHBondContact O-CB 3.45Å; G1149-C1153 PolarHBondContact O-N 3.2Å; G1149-C1153 PolarHBondContact O-SG 3.24Å
1150G63.4Low67.9Low18 Ų1845.9 Ų45.919%0.18625%0.246CC..Hα-helixtrans-67.4-22.4175.600000114.9R80 V1148R80-G1150 WeakPolarHBondContact CG-O 3.33Å; V1148-G1150 VanDerWaalsContact C-N 3.28Å; V1148-G1150 PolarHBondContact O-N 3.31Å
1151L67.6Low66.8Low24 Ų2447.1 Ų47.113%0.12625%0.25CC..Hα-helixtrans-90.6-33.3-177.3-60.8174.9000112.9L84 R1112 V1148 G1149L84-L1151 HydrophobicContact CD1-CD2 4.49Å; R1112-L1151 HydrophobicContact CB-CD1 4.43Å; V1148-L1151 WeakPolarHBondContact O-CA 3.41Å; V1148-L1151 WeakPolarHBondContact O-CB 3.32Å; V1148-L1151 PolarHBondContact O-N 2.94Å; G1149-L1151 VanDerWaalsContact C-N 3.28Å; G1149-L1151 PolarHBondContact O-N 3.26Å
1152L64.6Low65.7Low15 Ų1550.4 Ų50.48%0.07927%0.267CS..Hα-helixtrans-108.3-29.7-169.7-70.1-176.4000115.7V1066 L1100 L1113 V1148 V1154V1066-L1152 HydrophobicContact CG1-CD1 3.44Å; V1066-L1152 VanDerWaalsContact CG1-CD1 3.44Å; V1066-L1152 WeakPolarHBondContact O-CB 3.4Å; L1100-L1152 HydrophobicContact CD1-CD2 4.14Å; L1100-L1152 HydrophobicContact CD2-CD1 3.78Å; L1113-L1152 HydrophobicContact CD1-CD2 3.69Å; L1113-L1152 HydrophobicContact CD1-CG 4.34Å; L1113-L1152 HydrophobicContact CD2-CD1 3.77Å; L1113-L1152 HydrophobicContact CD2-CD2 4.1Å; L1113-L1152 HydrophobicContact CD2-CG 3.81Å; V1148-L1152 HydrophobicContact CG1-CB 4.34Å; V1148-L1152 HydrophobicContact CG1-CD1 3.31Å; V1148-L1152 HydrophobicContact CG1-CG 3.71Å; V1148-L1152 PolarHBondContact O-N 3.44Å; V1148-L1152 VanDerWaalsContact O-N 3.15Å; L1152-V1154 PolarHBondContact O-N 3.05Å
1153C57.5Low65Low32 Ų3249.6 Ų49.622%0.21627%0.266CS..SBendtrans-73.825.2-178.8-57.30000113.5Q1068 K1069 G1149Q1068-C1153 PolarHBondContact O-SG 3.18Å; Q1068-C1153 VanDerWaalsContact O-SG 3.4Å; K1069-C1153 HydrophobicContact CG-CB 4.01Å; G1149-C1153 WeakPolarHBondContact O-CB 3.45Å; G1149-C1153 PolarHBondContact O-N 3.2Å; G1149-C1153 PolarHBondContact O-SG 3.24Å
1154V48.4Very low64.1Low49 Ų4944.8 Ų44.830%0.29725%0.246SC..  trans-119.979.8-175-1670000108.4R80 L1152R80-V1154 HydrophobicContact CG-CG2 4.03Å; L1152-V1154 PolarHBondContact O-N 3.05Å
1155K34.4Very low62.7Low242 Ų24248.2 Ų48.2100%1.05227%0.265SS*.  trans-118.40152.5-81-173.3179.7170.50110.2

Retrieved 1,155 of 1,155 residues in 2449.9 ms (Link to these results)

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