A0A087XM45_POEFO Loading...

Calcium binding protein 39-like

Component of a complex that binds and activates STK11/LKB1. In the complex, required to stabilize the interaction between CAB39/MO25 (CAB39/MO25alpha or CAB39L/MO25beta) and STK11/LKB1.

AlphaFold DB , UniProt , Accession A0A087XM45, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 334 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
1M30.5Very low55.1Low243 Ų243126.8 Ų126.8100%1.19768%0.676SS**  0140.70-93.2175.3164.400108.4
2P35.7Very low58.4Low96 Ų96119.7 Ų119.762%0.62365%0.648SS**  trans-79.7138.8-130.428.9-34.7000114.4F4P2-F4 HydrophobicContact CG-CE2 4.41Å; P2-F4 PolarHBondContact O-N 3.16Å; P2-F4 VanDerWaalsContact O-N 3.13Å
3L39.6Very low61.2Low178 Ų178116.8 Ų116.893%0.93263%0.632SS**  trans-59.9103158.9-78.2142.5000108G5L3-G5 PolarHBondContact O-N 3.45Å
4F38.6Very low63.7Low197 Ų197108.7 Ų108.786%0.86459%0.588SS**  trans-68.282165-80.8-89.6000108.4P2 K6P2-F4 HydrophobicContact CG-CE2 4.41Å; P2-F4 PolarHBondContact O-N 3.16Å; P2-F4 VanDerWaalsContact O-N 3.13Å; F4-K6 PolarHBondContact O-N 2.94Å
5G39.3Very low65.7Low63 Ų63101.5 Ų101.565%0.64955%0.549SS*.  trans-60.1126.2159.200000107.5L3 S7L3-G5 PolarHBondContact O-N 3.45Å; G5-S7 PolarHBondContact O-N 3.47Å
6K46.3Very low67.6Low191 Ų191102.9 Ų102.983%0.8355%0.549SS*.  trans-51.1116.7168.7-74.9-179.8176.5-179.10106.9F4 H8F4-K6 PolarHBondContact O-N 2.94Å; K6-H8 PolarHBondContact O-N 3.47Å
7S47.9Very low69.2Low110 Ų11098.5 Ų98.577%0.76953%0.527SS*.  trans-59.9104.1173.2176.10000107.5G5 K9G5-S7 PolarHBondContact O-N 3.47Å; S7-K9 PolarHBondContact O-N 3.21Å
8H64.7Low70.7Confident170 Ų17093.1 Ų93.179%0.78750%0.497SS*.  trans-69.9103.1173.2-81.6-77.9000107.1K6K6-H8 PolarHBondContact O-N 3.47Å
9K79.1Confident72Confident90 Ų9092.4 Ų92.439%0.39149%0.49SS..  trans-57.7138.3173.5-68.6-176.1-179.11790109S7 D13 I14 E38S7-K9 PolarHBondContact O-N 3.21Å; K9-D13 HydrophobicContact CB-CB 4.23Å; K9-I14 HydrophobicContact CB-CD1 4.31Å; K9-I14 HydrophobicContact CB-CG1 3.69Å; K9-I14 HydrophobicContact CD-CG1 4.5Å; K9-E38 IonicContact NZ-OE2 3.53Å
10S91.6Very high73.1Confident47 Ų4793.1 Ų93.133%0.32949%0.49SS..  trans-65.4156.817473.40000110.5A12 D13 I14S10-A12 PolarHBondContact O-N 3.18Å; S10-D13 WeakPolarHBondContact CB-OD2 3.33Å; S10-D13 PolarHBondContact N-OD2 3.36Å; S10-D13 PolarHBondContact O-N 3.39Å; S10-D13 PolarHBondContact OG-N 3.3Å; S10-D13 VanDerWaalsContact OG-N 3.16Å; S10-D13 PolarHBondContact OG-OD2 3.42Å; S10-I14 WeakPolarHBondContact O-CG1 3.36Å; S10-I14 PolarHBondContact O-N 3.35Å
11P93.2Very high74.2Confident10 Ų1089.8 Ų89.87%0.06547%0.473CS..Hα-helixtrans-51.7-41.4173.9-28.736.2000112.9D13 I14 I15 T62 Q65 L66P11-D13 PolarHBondContact O-N 2.89Å; P11-I14 PolarHBondContact O-N 2.92Å; P11-I15 WeakPolarHBondContact O-CG1 3.45Å; P11-I15 PolarHBondContact O-N 3.18Å; P11-T62 HydrophobicContact CG-CG2 3.81Å; P11-Q65 HydrophobicContact CB-CB 4.42Å; P11-Q65 HydrophobicContact CG-CB 4.13Å; P11-L66 HydrophobicContact CB-CB 4.11Å; P11-L66 HydrophobicContact CB-CD1 4.23Å
12A94.6Very high77.2Confident41 Ų4178.5 Ų78.534%0.33942%0.417SS..Hα-helixtrans-62.1-43.2176.900000112.5S10 I14 I15 K16 E69S10-A12 PolarHBondContact O-N 3.18Å; A12-I14 VanDerWaalsContact C-N 3.35Å; A12-I14 PolarHBondContact O-N 2.79Å; A12-I15 PolarHBondContact O-N 3.37Å; A12-K16 WeakPolarHBondContact O-CB 3.46Å; A12-K16 PolarHBondContact O-N 3.48Å; A12-E69 HydrophobicContact CB-CG 4.33Å
13D94.8Very high80Confident82 Ų8276.1 Ų76.144%0.43941%0.406SS..Hα-helixtrans-65.8-38.1177.9-63.8-45.5000112.1K9 S10 P11 T17K9-D13 HydrophobicContact CB-CB 4.23Å; S10-D13 WeakPolarHBondContact CB-OD2 3.33Å; S10-D13 PolarHBondContact N-OD2 3.36Å; S10-D13 PolarHBondContact O-N 3.39Å; S10-D13 PolarHBondContact OG-N 3.3Å; S10-D13 VanDerWaalsContact OG-N 3.16Å; S10-D13 PolarHBondContact OG-OD2 3.42Å; P11-D13 PolarHBondContact O-N 2.89Å; D13-T17 VanDerWaalsContact O-CB 3.28Å; D13-T17 WeakPolarHBondContact O-CB 3.47Å; D13-T17 PolarHBondContact O-N 2.82Å; D13-T17 PolarHBondContact O-OG1 3.28Å
14I95.4Very high82.6Confident4 Ų470 Ų702%0.02137%0.373CS..Hα-helixtrans-62.6-49.5175.8-65167.1000109.7K9 S10 P11 A12 K16 T17 L18 C42 M46 I49K9-I14 HydrophobicContact CB-CD1 4.31Å; K9-I14 HydrophobicContact CB-CG1 3.69Å; K9-I14 HydrophobicContact CD-CG1 4.5Å; S10-I14 WeakPolarHBondContact O-CG1 3.36Å; S10-I14 PolarHBondContact O-N 3.35Å; P11-I14 PolarHBondContact O-N 2.92Å; A12-I14 VanDerWaalsContact C-N 3.35Å; A12-I14 PolarHBondContact O-N 2.79Å; I14-K16 PolarHBondContact O-N 3.21Å; I14-T17 PolarHBondContact O-N 2.77Å; I14-L18 VanDerWaalsContact O-CB 3.27Å; I14-L18 WeakPolarHBondContact O-CB 3.37Å; I14-L18 PolarHBondContact O-N 3.46Å; I14-C42 HydrophobicContact CG2-CB 4.01Å; I14-M46 HydrophobicContact CG2-CG 3.61Å; I14-M46 HydrophobicContact CG2-SD 4.18Å; I14-I49 HydrophobicContact CD1-CD1 3.67Å
15I94.9Very high85.1Confident1 Ų161.1 Ų61.11%0.00534%0.335CS..Hα-helixtrans-62.1-45.2-179.4-65.9-69.5000111.1P11 A12 L18 K19 M46 L66 E69 L70 N73 L75P11-I15 WeakPolarHBondContact O-CG1 3.45Å; P11-I15 PolarHBondContact O-N 3.18Å; A12-I15 PolarHBondContact O-N 3.37Å; I15-L18 PolarHBondContact O-N 3.36Å; I15-K19 HydrophobicContact CG2-CD 4.45Å; I15-K19 WeakPolarHBondContact O-CG 3.46Å; I15-K19 PolarHBondContact O-N 3.25Å; I15-M46 HydrophobicContact CD1-CE 4.12Å; I15-M46 HydrophobicContact CD1-SD 4.43Å; I15-L66 HydrophobicContact CD1-CD1 3.88Å; I15-L66 HydrophobicContact CG1-CD1 4.09Å; I15-E69 HydrophobicContact CB-CB 4.45Å; I15-E69 HydrophobicContact CG1-CB 3.86Å; I15-L70 HydrophobicContact CD1-CD2 3.57Å; I15-L70 HydrophobicContact CD1-CG 3.97Å; I15-N73 HydrophobicContact CG2-CB 3.89Å; I15-L75 HydrophobicContact CD1-CD2 3.27Å; I15-L75 HydrophobicContact CG1-CD2 4.46Å; I15-L75 HydrophobicContact CG2-CD2 4.23Å
16K95.1Very high87.6Confident124 Ų12460.5 Ų60.554%0.53932%0.318SS..Hα-helixtrans-60.2-50.2175.8-177.8179.1175.2-177.30111.6A12 I14 L18 K19 E20A12-K16 WeakPolarHBondContact O-CB 3.46Å; A12-K16 PolarHBondContact O-N 3.48Å; I14-K16 PolarHBondContact O-N 3.21Å; K16-L18 VanDerWaalsContact C-N 3.3Å; K16-L18 PolarHBondContact O-N 2.9Å; K16-K19 PolarHBondContact O-N 3.04Å; K16-E20 WeakPolarHBondContact CE-OE1 3.34Å; K16-E20 WeakPolarHBondContact O-CG 3.19Å; K16-E20 PolarHBondContact O-N 2.98Å
17T95.8Very high89.7Confident28 Ų2858.6 Ų58.617%0.17231%0.31CS..Hα-helixtrans-59.1-43.5179.1-56.20000111D13 I14 E20 N21D13-T17 VanDerWaalsContact O-CB 3.28Å; D13-T17 WeakPolarHBondContact O-CB 3.47Å; D13-T17 PolarHBondContact O-N 2.82Å; D13-T17 PolarHBondContact O-OG1 3.28Å; I14-T17 PolarHBondContact O-N 2.77Å; T17-E20 PolarHBondContact O-N 3.12Å; T17-N21 WeakPolarHBondContact CG2-ND2 3.34Å; T17-N21 PolarHBondContact O-N 3Å; T17-N21 PolarHBondContact O-ND2 3.42Å
18L96.1Very high91.2Very high0 Ų059.8 Ų59.80%030%0.303CS..Hα-helixtrans-64.4-44.3-179.7-17948.6000111.6I14 I15 K16 N21 L22 V39 C42 L43 M46 L75 L79I14-L18 VanDerWaalsContact O-CB 3.27Å; I14-L18 WeakPolarHBondContact O-CB 3.37Å; I14-L18 PolarHBondContact O-N 3.46Å; I15-L18 PolarHBondContact O-N 3.36Å; K16-L18 VanDerWaalsContact C-N 3.3Å; K16-L18 PolarHBondContact O-N 2.9Å; L18-N21 PolarHBondContact O-N 2.86Å; L18-L22 WeakPolarHBondContact O-CB 3.5Å; L18-L22 PolarHBondContact O-N 2.89Å; L18-V39 HydrophobicContact CD1-CB 4.16Å; L18-V39 HydrophobicContact CD1-CG1 3.81Å; L18-V39 HydrophobicContact CD1-CG2 3.97Å; L18-C42 HydrophobicContact CB-CB 3.98Å; L18-C42 HydrophobicContact CD1-CB 4.28Å; L18-C42 HydrophobicContact CD2-CB 4.3Å; L18-C42 HydrophobicContact CG-CB 4.43Å; L18-L43 HydrophobicContact CD2-CD2 3.97Å; L18-M46 HydrophobicContact CD2-SD 3.44Å; L18-M46 WeakPolarHBondContact CD2-SD 3.01Å; L18-L75 HydrophobicContact CD2-CD2 3.74Å; L18-L75 HydrophobicContact CG-CD1 4.45Å; L18-L75 HydrophobicContact CG-CD2 4.2Å; L18-L79 HydrophobicContact CD1-CD2 4.44Å; L18-L79 HydrophobicContact CD2-CD2 4.25Å; L18-L79 HydrophobicContact CG-CD2 4.44Å
19K94.8Very high91.6Very high81 Ų8155.6 Ų55.635%0.35229%0.287SS..Hα-helixtrans-62.1-45.6176.5-73.9-175.474.2176.30112.7I15 K16 L22 A23 N73 L75I15-K19 HydrophobicContact CG2-CD 4.45Å; I15-K19 WeakPolarHBondContact O-CG 3.46Å; I15-K19 PolarHBondContact O-N 3.25Å; K16-K19 PolarHBondContact O-N 3.04Å; K19-L22 PolarHBondContact O-N 2.72Å; K19-A23 PolarHBondContact O-N 3.42Å; K19-A23 VanDerWaalsContact O-N 3.07Å; K19-N73 HydrophobicContact CD-CB 3.97Å; K19-N73 PolarHBondContact NZ-O 2.9Å; K19-L75 HydrophobicContact CD-CD1 4.39Å; K19-L75 HydrophobicContact CG-CD1 3.67Å
20E94.6Very high91.1Very high106 Ų10661.9 Ų61.950%0.49531%0.314SS..Hα-helixtrans-61.7-46.1-180-72.6174.6-176.500111.6K16 T17 A23 I24K16-E20 WeakPolarHBondContact CE-OE1 3.34Å; K16-E20 WeakPolarHBondContact O-CG 3.19Å; K16-E20 PolarHBondContact O-N 2.98Å; T17-E20 PolarHBondContact O-N 3.12Å; E20-A23 PolarHBondContact O-N 2.9Å; E20-I24 WeakPolarHBondContact O-CG1 3.45Å; E20-I24 PolarHBondContact O-N 3.21Å
21N95.4Very high90.5Very high24 Ų2467.2 Ų67.213%0.12833%0.331CS..Hα-helixtrans-74.4-34.1-179.2-71.5-79.3000112.7T17 L18 A23 I24 L25 A35 V39T17-N21 WeakPolarHBondContact CG2-ND2 3.34Å; T17-N21 PolarHBondContact O-N 3Å; T17-N21 PolarHBondContact O-ND2 3.42Å; L18-N21 PolarHBondContact O-N 2.86Å; N21-A23 VanDerWaalsContact C-N 3.29Å; N21-A23 PolarHBondContact O-N 3.29Å; N21-I24 WeakPolarHBondContact O-CB 3.37Å; N21-I24 PolarHBondContact O-N 2.85Å; N21-I24 VanDerWaalsContact O-N 3.13Å; N21-L25 PolarHBondContact O-N 3.49Å; N21-A35 HydrophobicContact CB-CB 4.21Å; N21-V39 HydrophobicContact CB-CG2 3.77Å
22L94.7Very high90.1Very high5 Ų568.7 Ų68.73%0.02634%0.34CS..Hα-helixtrans-61.3-40.4173.1-171.363.3000111L18 K19 I24 L25 V26 A78 L79 N82 I86L18-L22 WeakPolarHBondContact O-CB 3.5Å; L18-L22 PolarHBondContact O-N 2.89Å; K19-L22 PolarHBondContact O-N 2.72Å; L22-I24 VanDerWaalsContact C-N 3.28Å; L22-I24 PolarHBondContact O-N 2.89Å; L22-L25 PolarHBondContact O-N 2.77Å; L22-V26 VanDerWaalsContact O-CG2 3.29Å; L22-V26 WeakPolarHBondContact O-CG2 3.4Å; L22-V26 PolarHBondContact O-N 3.44Å; L22-A78 HydrophobicContact CD2-CB 4.41Å; L22-L79 HydrophobicContact CD2-CD2 4.26Å; L22-N82 HydrophobicContact CD1-CB 3.85Å; L22-N82 HydrophobicContact CD2-CB 4.07Å; L22-N82 HydrophobicContact CG-CB 4.01Å; L22-I86 HydrophobicContact CD1-CD1 4.23Å; L22-I86 HydrophobicContact CD1-CG1 4.03Å
23A93.3Very high89.7Confident47 Ų4773.3 Ų73.339%0.38836%0.359SS..Hα-helixtrans-63.3-32.7175.200000113K19 E20 N21 K27K19-A23 PolarHBondContact O-N 3.42Å; K19-A23 VanDerWaalsContact O-N 3.07Å; E20-A23 PolarHBondContact O-N 2.9Å; N21-A23 VanDerWaalsContact C-N 3.29Å; N21-A23 PolarHBondContact O-N 3.29Å; A23-K27 WeakPolarHBondContact O-CG 3.45Å; A23-K27 PolarHBondContact O-N 3.19Å
24I93.6Very high89.7Confident49 Ų4976.5 Ų76.525%0.25137%0.369SS..Hα-helixtrans-69.2-41.9174.2-64.4168.5000110.7E20 N21 L22 V26 K27 H28 D29 A35E20-I24 WeakPolarHBondContact O-CG1 3.45Å; E20-I24 PolarHBondContact O-N 3.21Å; N21-I24 WeakPolarHBondContact O-CB 3.37Å; N21-I24 PolarHBondContact O-N 2.85Å; N21-I24 VanDerWaalsContact O-N 3.13Å; L22-I24 VanDerWaalsContact C-N 3.28Å; L22-I24 PolarHBondContact O-N 2.89Å; I24-V26 PolarHBondContact O-N 2.98Å; I24-K27 PolarHBondContact O-N 2.89Å; I24-H28 PolarHBondContact O-N 3.24Å; I24-D29 HydrophobicContact CG2-CB 4.3Å; I24-A35 HydrophobicContact CB-CB 4Å; I24-A35 HydrophobicContact CG2-CB 3.77Å
25L92.6Very high89.6Confident11 Ų1176.4 Ų76.46%0.05837%0.369CS..Hα-helixtrans-60.6-44.8177.4-69-176.8000111.8N21 L22 K27 H28 T32 A35 V39N21-L25 PolarHBondContact O-N 3.49Å; L22-L25 PolarHBondContact O-N 2.77Å; L25-K27 VanDerWaalsContact C-N 3.3Å; L25-K27 PolarHBondContact O-N 3.34Å; L25-H28 PolarHBondContact O-N 3.08Å; L25-T32 WeakPolarHBondContact CD2-O 3.09Å; L25-A35 HydrophobicContact CD2-CB 3.93Å; L25-A35 HydrophobicContact CG-CB 4.22Å; L25-V39 HydrophobicContact CD1-CB 4.32Å; L25-V39 HydrophobicContact CD1-CG2 3.8Å
26V91.2Very high89.6Confident50 Ų5077.6 Ų77.630%0.30338%0.378SS..Hα-helixtrans-62.6-36.4179.2175.40000112L22 I24 H28 N82 Y85L22-V26 VanDerWaalsContact O-CG2 3.29Å; L22-V26 WeakPolarHBondContact O-CG2 3.4Å; L22-V26 PolarHBondContact O-N 3.44Å; I24-V26 PolarHBondContact O-N 2.98Å; V26-H28 VanDerWaalsContact C-N 3.29Å; V26-H28 PolarHBondContact O-N 3.5Å; V26-N82 HydrophobicContact CG2-CB 3.95Å; V26-N82 WeakPolarHBondContact CG2-OD1 2.95Å; V26-Y85 HydrophobicContact CB-CD2 4.48Å; V26-Y85 HydrophobicContact CB-CE2 4.38Å; V26-Y85 HydrophobicContact CG1-CE2 4.24Å; V26-Y85 HydrophobicContact CG2-CD2 3.71Å; V26-Y85 HydrophobicContact CG2-CE2 3.91Å; V26-Y85 HydrophobicContact CG2-CG 4.4Å
27K90Very high89.6Confident151 Ų15176.8 Ų76.866%0.65738%0.376SS*.Hα-helixtrans-75.4-12.6179.3-73.5179.3-179-1780114.2A23 I24 L25 D29A23-K27 WeakPolarHBondContact O-CG 3.45Å; A23-K27 PolarHBondContact O-N 3.19Å; I24-K27 PolarHBondContact O-N 2.89Å; L25-K27 VanDerWaalsContact C-N 3.3Å; L25-K27 PolarHBondContact O-N 3.34Å; K27-D29 VanDerWaalsContact C-N 3.29Å; K27-D29 PolarHBondContact O-N 3.48Å
28H78.9Confident89.6Confident134 Ų13477.2 Ų77.262%0.6238%0.376SS*.THydrogen-bonded Turntrans53.141.1-174.1-74.3-76.6000114I24 L25 V26 Y85I24-H28 PolarHBondContact O-N 3.24Å; L25-H28 PolarHBondContact O-N 3.08Å; V26-H28 VanDerWaalsContact C-N 3.29Å; V26-H28 PolarHBondContact O-N 3.5Å; H28-Y85 AromaticContact NE2-CD1 3.71Å; H28-Y85 AromaticContact NE2-CE1 3.37Å; H28-Y85 WeakPolarHBondContact NE2-CE1 3.44Å
29D74.6Confident89.6Confident83 Ų8377.3 Ų77.344%0.44438%0.376SS..  trans-72.1162.5177.6-78.7-37.1000112.9I24 K27 K31 T32I24-D29 HydrophobicContact CG2-CB 4.3Å; K27-D29 VanDerWaalsContact C-N 3.29Å; K27-D29 PolarHBondContact O-N 3.48Å; D29-K31 PolarHBondContact O-N 3.41Å; D29-T32 WeakPolarHBondContact O-CG2 3.28Å; D29-T32 PolarHBondContact O-N 3Å; D29-T32 VanDerWaalsContact O-N 3.16Å
30K68.6Low89.7Confident221 Ų22174.2 Ų74.296%0.96137%0.365SS*.THydrogen-bonded Turntrans-56.7-5.9179-69.9-175.3178-179.60116
31K77.7Confident89.8Confident160 Ų16073.3 Ų73.370%0.69636%0.359SS*.THydrogen-bonded Turntrans-107.918.5-178.2-64-178.6-179.3174.80113.1D29 D33 K34 A35D29-K31 PolarHBondContact O-N 3.41Å; K31-D33 VanDerWaalsContact C-N 3.34Å; K31-D33 PolarHBondContact O-N 3.34Å; K31-K34 PolarHBondContact O-N 3.38Å; K31-A35 PolarHBondContact O-N 2.7Å; K31-A35 VanDerWaalsContact O-N 3.14Å
32T84.4Confident89.9Confident40 Ų4072.2 Ų72.225%0.24535%0.353CS..Hα-helixtrans-55.9-40.1-176.142.90000114.1L25 D29 K34 A35 S36L25-T32 WeakPolarHBondContact CD2-O 3.09Å; D29-T32 WeakPolarHBondContact O-CG2 3.28Å; D29-T32 PolarHBondContact O-N 3Å; D29-T32 VanDerWaalsContact O-N 3.16Å; T32-K34 PolarHBondContact O-N 3.24Å; T32-A35 PolarHBondContact O-N 3.46Å; T32-S36 WeakPolarHBondContact O-CB 3.31Å; T32-S36 PolarHBondContact O-N 2.97Å
33D88.1Confident90Very high139 Ų13972 Ų7274%0.74335%0.352SS*.Hα-helixtrans-65.5-44.8-175.2-60.6-12.1000111.7K31 A35 S36 E37K31-D33 VanDerWaalsContact C-N 3.34Å; K31-D33 PolarHBondContact O-N 3.34Å; D33-A35 VanDerWaalsContact C-N 3.35Å; D33-S36 PolarHBondContact O-N 3.44Å; D33-E37 PolarHBondContact O-N 2.85Å
34K92.8Very high90.2Very high148 Ų14872.7 Ų72.764%0.64335%0.352SS*.Hα-helixtrans-66.4-38.5176-172.6176.5-178.2178.20111.6K31 T32 S36 E37 E38K31-K34 PolarHBondContact O-N 3.38Å; T32-K34 PolarHBondContact O-N 3.24Å; K34-S36 VanDerWaalsContact C-N 3.34Å; K34-E37 PolarHBondContact O-N 2.89Å; K34-E38 PolarHBondContact O-N 3Å; K34-E38 VanDerWaalsContact O-N 3.11Å
35A93.9Very high90.2Very high2 Ų272.2 Ų72.22%0.01735%0.352CS..Hα-helixtrans-65-40.3176.400000111.4N21 I24 L25 K31 T32 D33 E38 V39N21-A35 HydrophobicContact CB-CB 4.21Å; I24-A35 HydrophobicContact CB-CB 4Å; I24-A35 HydrophobicContact CG2-CB 3.77Å; L25-A35 HydrophobicContact CD2-CB 3.93Å; L25-A35 HydrophobicContact CG-CB 4.22Å; K31-A35 PolarHBondContact O-N 2.7Å; K31-A35 VanDerWaalsContact O-N 3.14Å; T32-A35 PolarHBondContact O-N 3.46Å; D33-A35 VanDerWaalsContact C-N 3.35Å; A35-E38 PolarHBondContact O-N 3.31Å; A35-V39 WeakPolarHBondContact O-CG2 3.19Å; A35-V39 PolarHBondContact O-N 3.39Å
36S94.4Very high90.4Very high27 Ų2771.7 Ų71.719%0.18935%0.35CS..Hα-helixtrans-61.2-47.9176.3-167.10000110.9T32 D33 K34 E38 V39 S40T32-S36 WeakPolarHBondContact O-CB 3.31Å; T32-S36 PolarHBondContact O-N 2.97Å; D33-S36 PolarHBondContact O-N 3.44Å; K34-S36 VanDerWaalsContact C-N 3.34Å; S36-E38 VanDerWaalsContact C-N 3.32Å; S36-E38 PolarHBondContact O-N 3.25Å; S36-V39 PolarHBondContact O-N 3.28Å; S36-S40 PolarHBondContact O-N 3.48Å; S36-S40 PolarHBondContact O-OG 3.15Å; S36-S40 VanDerWaalsContact O-OG 3.13Å
37E95.3Very high90.5Very high107 Ų10771.5 Ų71.550%0.535%0.345SS..Hα-helixtrans-59.4-41.9178-165.6-166.6154.300112.1D33 K34 S40 K41D33-E37 PolarHBondContact O-N 2.85Å; K34-E37 PolarHBondContact O-N 2.89Å; E37-S40 PolarHBondContact O-N 2.79Å; E37-K41 WeakPolarHBondContact O-CG 3.37Å; E37-K41 PolarHBondContact O-N 2.9Å; E37-K41 WeakPolarHBondContact OE1-CE 3.5Å; E37-K41 IonicContact OE1-NZ 3.41Å; E37-K41 PolarHBondContact OE1-NZ 2.94Å
38E96Very high90.7Very high37 Ų3769 Ų6917%0.17334%0.335CS..Hα-helixtrans-71.1-35.1177.3-73.8-53.914100113.3K9 K34 A35 S36 S40 K41 C42K9-E38 IonicContact NZ-OE2 3.53Å; K34-E38 PolarHBondContact O-N 3Å; K34-E38 VanDerWaalsContact O-N 3.11Å; A35-E38 PolarHBondContact O-N 3.31Å; S36-E38 VanDerWaalsContact C-N 3.32Å; S36-E38 PolarHBondContact O-N 3.25Å; E38-S40 VanDerWaalsContact C-N 3.35Å; E38-K41 PolarHBondContact O-N 2.65Å; E38-K41 IonicContact OE1-NZ 2.64Å; E38-K41 PolarHBondContact OE1-NZ 3.32Å; E38-C42 WeakPolarHBondContact O-CB 3.35Å; E38-C42 PolarHBondContact O-N 3.35Å; E38-C42 PolarHBondContact O-SG 3.35Å
39V97.1Very high91.4Very high1 Ų164 Ų641%0.00631%0.313CS..Hα-helixtrans-58.5-49.3170.9165.60000109.8L18 N21 L25 A35 S36 K41 C42 L43 I86L18-V39 HydrophobicContact CD1-CB 4.16Å; L18-V39 HydrophobicContact CD1-CG1 3.81Å; L18-V39 HydrophobicContact CD1-CG2 3.97Å; N21-V39 HydrophobicContact CB-CG2 3.77Å; L25-V39 HydrophobicContact CD1-CB 4.32Å; L25-V39 HydrophobicContact CD1-CG2 3.8Å; A35-V39 WeakPolarHBondContact O-CG2 3.19Å; A35-V39 PolarHBondContact O-N 3.39Å; S36-V39 PolarHBondContact O-N 3.28Å; V39-K41 PolarHBondContact O-N 3.47Å; V39-C42 PolarHBondContact O-N 3.21Å; V39-L43 HydrophobicContact CG1-CD1 3.89Å; V39-L43 HydrophobicContact CG1-CG 4.37Å; V39-L43 WeakPolarHBondContact O-CG 3.22Å; V39-L43 PolarHBondContact O-N 3.45Å; V39-I86 HydrophobicContact CG1-CG2 4.39Å
40S96.8Very high92.3Very high16 Ų1660.4 Ų60.411%0.11229%0.294CS..Hα-helixtrans-62-44.7179.7-56.70000112.5S36 E37 E38 C42 L43 V44 E87S36-S40 PolarHBondContact O-N 3.48Å; S36-S40 PolarHBondContact O-OG 3.15Å; S36-S40 VanDerWaalsContact O-OG 3.13Å; E37-S40 PolarHBondContact O-N 2.79Å; E38-S40 VanDerWaalsContact C-N 3.35Å; S40-C42 VanDerWaalsContact C-N 3.3Å; S40-C42 PolarHBondContact O-N 3.14Å; S40-L43 PolarHBondContact O-N 3.09Å; S40-V44 WeakPolarHBondContact O-CG2 3.48Å; S40-V44 PolarHBondContact O-N 3.3Å; S40-E87 VanDerWaalsContact CB-OE1 3.3Å; S40-E87 WeakPolarHBondContact CB-OE1 3.3Å; S40-E87 PolarHBondContact OG-OE1 3.25Å
41K96.6Very high93.4Very high88 Ų8855.2 Ų55.238%0.38327%0.269SS..Hα-helixtrans-59.2-40.7174.2-73.5172.5-171.2162.10112.2E37 E38 V39 S45E37-K41 WeakPolarHBondContact O-CG 3.37Å; E37-K41 PolarHBondContact O-N 2.9Å; E37-K41 WeakPolarHBondContact OE1-CE 3.5Å; E37-K41 IonicContact OE1-NZ 3.41Å; E37-K41 PolarHBondContact OE1-NZ 2.94Å; E38-K41 PolarHBondContact O-N 2.65Å; E38-K41 IonicContact OE1-NZ 2.64Å; E38-K41 PolarHBondContact OE1-NZ 3.32Å; V39-K41 PolarHBondContact O-N 3.47Å; K41-S45 WeakPolarHBondContact O-CB 3.49Å; K41-S45 PolarHBondContact O-N 2.82Å; K41-S45 PolarHBondContact O-OG 3Å
42C97.4Very high93.8Very high1 Ų148.5 Ų48.51%0.00725%0.245CC..Hα-helixtrans-66.2-44.9178.2-68.90000111.3I14 L18 E38 V39 S40 S45 M46I14-C42 HydrophobicContact CG2-CB 4.01Å; L18-C42 HydrophobicContact CB-CB 3.98Å; L18-C42 HydrophobicContact CD1-CB 4.28Å; L18-C42 HydrophobicContact CD2-CB 4.3Å; L18-C42 HydrophobicContact CG-CB 4.43Å; E38-C42 WeakPolarHBondContact O-CB 3.35Å; E38-C42 PolarHBondContact O-N 3.35Å; E38-C42 PolarHBondContact O-SG 3.35Å; V39-C42 PolarHBondContact O-N 3.21Å; S40-C42 VanDerWaalsContact C-N 3.3Å; S40-C42 PolarHBondContact O-N 3.14Å; C42-S45 WeakPolarHBondContact O-CB 3.32Å; C42-S45 PolarHBondContact O-N 3.22Å; C42-M46 VanDerWaalsContact O-CG 3.3Å; C42-M46 WeakPolarHBondContact O-CG 3.49Å; C42-M46 PolarHBondContact O-N 3.13Å
43L97.5Very high93.7Very high0 Ų049.2 Ų49.20%025%0.252CS..Hα-helixtrans-61.9-44.2177.7-68172.7000111.9L18 V39 S40 S45 M46 K47 L79 I86 D93 V94 I97L18-L43 HydrophobicContact CD2-CD2 3.97Å; V39-L43 HydrophobicContact CG1-CD1 3.89Å; V39-L43 HydrophobicContact CG1-CG 4.37Å; V39-L43 WeakPolarHBondContact O-CG 3.22Å; V39-L43 PolarHBondContact O-N 3.45Å; S40-L43 PolarHBondContact O-N 3.09Å; L43-S45 VanDerWaalsContact C-N 3.35Å; L43-S45 PolarHBondContact O-N 2.78Å; L43-M46 PolarHBondContact O-N 3.46Å; L43-K47 PolarHBondContact O-N 3.41Å; L43-L79 HydrophobicContact CD2-CD2 4.32Å; L43-I86 HydrophobicContact CD1-CG2 4.02Å; L43-D93 HydrophobicContact CB-CB 4.01Å; L43-V94 HydrophobicContact CD1-CG2 4.04Å; L43-V94 HydrophobicContact CD2-CG2 3.78Å; L43-I97 HydrophobicContact CB-CD1 4.31Å; L43-I97 HydrophobicContact CD2-CD1 3.78Å
44V95.9Very high92.6Very high62 Ų6249.8 Ų49.838%0.37626%0.255SS..Hα-helixtrans-60.5-45.1174172.10000110.8S40 M46 K47 E48S40-V44 WeakPolarHBondContact O-CG2 3.48Å; S40-V44 PolarHBondContact O-N 3.3Å; V44-M46 VanDerWaalsContact C-N 3.33Å; V44-M46 PolarHBondContact O-N 3.48Å; V44-K47 WeakPolarHBondContact O-CB 3.46Å; V44-K47 PolarHBondContact O-N 3.48Å; V44-K47 VanDerWaalsContact O-N 3.14Å; V44-E48 WeakPolarHBondContact O-CG 3.32Å; V44-E48 PolarHBondContact O-N 2.85Å
45S94.9Very high91.4Very high38 Ų3851.2 Ų51.227%0.26627%0.27SS..Hα-helixtrans-61.3-41177.8-55.20000112K41 C42 L43 E48 I49K41-S45 WeakPolarHBondContact O-CB 3.49Å; K41-S45 PolarHBondContact O-N 2.82Å; K41-S45 PolarHBondContact O-OG 3Å; C42-S45 WeakPolarHBondContact O-CB 3.32Å; C42-S45 PolarHBondContact O-N 3.22Å; L43-S45 VanDerWaalsContact C-N 3.35Å; L43-S45 PolarHBondContact O-N 2.78Å; S45-E48 PolarHBondContact O-N 3.48Å; S45-I49 WeakPolarHBondContact O-CG1 3.35Å; S45-I49 PolarHBondContact O-N 2.96Å; S45-I49 VanDerWaalsContact O-N 3.1Å
46M95.8Very high90.7Very high0 Ų058.4 Ų58.40%030%0.3CS..Hα-helixtrans-63.1-41.9174.8-69.9171.166.800111.5I14 I15 L18 C42 L43 V44 I49 L50 L66 L70 L75 I97I14-M46 HydrophobicContact CG2-CG 3.61Å; I14-M46 HydrophobicContact CG2-SD 4.18Å; I15-M46 HydrophobicContact CD1-CE 4.12Å; I15-M46 HydrophobicContact CD1-SD 4.43Å; L18-M46 HydrophobicContact CD2-SD 3.44Å; L18-M46 WeakPolarHBondContact CD2-SD 3.01Å; C42-M46 VanDerWaalsContact O-CG 3.3Å; C42-M46 WeakPolarHBondContact O-CG 3.49Å; C42-M46 PolarHBondContact O-N 3.13Å; L43-M46 PolarHBondContact O-N 3.46Å; V44-M46 VanDerWaalsContact C-N 3.33Å; V44-M46 PolarHBondContact O-N 3.48Å; M46-I49 PolarHBondContact O-N 3.32Å; M46-L50 VanDerWaalsContact O-CG 3.3Å; M46-L50 WeakPolarHBondContact O-CG 3.5Å; M46-L50 PolarHBondContact O-N 3.37Å; M46-L66 HydrophobicContact CB-CD2 4.27Å; M46-L66 HydrophobicContact CE-CD1 4.27Å; M46-L66 HydrophobicContact CG-CD1 4.18Å; M46-L66 HydrophobicContact CG-CD2 4.43Å; M46-L70 HydrophobicContact CE-CD1 4.32Å; M46-L70 HydrophobicContact CE-CD2 3.68Å; M46-L70 HydrophobicContact CE-CG 4.4Å; M46-L75 HydrophobicContact CE-CD2 4.44Å; M46-I97 HydrophobicContact CB-CD1 3.79Å; M46-I97 HydrophobicContact CB-CG1 4.29Å; M46-I97 HydrophobicContact CE-CD1 4.23Å; M46-I97 HydrophobicContact CE-CG2 3.76Å; M46-I97 HydrophobicContact SD-CD1 4.37Å
47K94.6Very high90.1Very high47 Ų4765.4 Ų65.420%0.20433%0.33CS..Hα-helixtrans-61.6-45.5174.7-81.9178.144.71710112.3L43 V44 I49 L50 Y51 D93 I97L43-K47 PolarHBondContact O-N 3.41Å; V44-K47 WeakPolarHBondContact O-CB 3.46Å; V44-K47 PolarHBondContact O-N 3.48Å; V44-K47 VanDerWaalsContact O-N 3.14Å; K47-I49 PolarHBondContact O-N 3.15Å; K47-L50 PolarHBondContact O-N 3.26Å; K47-Y51 HydrophobicContact CB-CD2 4.19Å; K47-Y51 HydrophobicContact CG-CD2 4.33Å; K47-Y51 HydrophobicContact CG-CE2 4.28Å; K47-Y51 WeakPolarHBondContact O-CB 3.36Å; K47-Y51 WeakPolarHBondContact O-CD2 3.35Å; K47-Y51 PolarHBondContact O-N 3.17Å; K47-D93 HydrophobicContact CD-CB 3.66Å; K47-D93 WeakPolarHBondContact CD-OD1 3.18Å; K47-D93 WeakPolarHBondContact CE-OD1 3.48Å; K47-D93 IonicContact NZ-OD1 3.84Å; K47-D93 PolarHBondContact NZ-OD1 3.12Å; K47-I97 HydrophobicContact CG-CD1 4.1Å; K47-I97 HydrophobicContact CG-CG1 3.7Å
48E93.3Very high89.8Confident97 Ų9762.7 Ų62.745%0.45332%0.322SS..Hα-helixtrans-59-37.3177-71.8178.7171.800111.5V44 S45 G52V44-E48 WeakPolarHBondContact O-CG 3.32Å; V44-E48 PolarHBondContact O-N 2.85Å; S45-E48 PolarHBondContact O-N 3.48Å; E48-G52 CarbonylContact O-C 3.59Å; E48-G52 WeakPolarHBondContact O-CA 3.38Å; E48-G52 PolarHBondContact O-N 2.87Å
49I94.1Very high89.4Confident30 Ų3067.5 Ų67.515%0.15434%0.344CS..Hα-helixtrans-63.9-42173.2-68.1166.6000111.5I14 S45 M46 K47 P58 T62 V63 L66I14-I49 HydrophobicContact CD1-CD1 3.67Å; S45-I49 WeakPolarHBondContact O-CG1 3.35Å; S45-I49 PolarHBondContact O-N 2.96Å; S45-I49 VanDerWaalsContact O-N 3.1Å; M46-I49 PolarHBondContact O-N 3.32Å; K47-I49 PolarHBondContact O-N 3.15Å; I49-P58 WeakPolarHBondContact O-CB 3.3Å; I49-T62 HydrophobicContact CD1-CG2 4.34Å; I49-T62 HydrophobicContact CG1-CG2 4.26Å; I49-T62 HydrophobicContact CG2-CG2 3.8Å; I49-V63 HydrophobicContact CG2-CG2 4.25Å; I49-V63 WeakPolarHBondContact O-CG2 3.45Å; I49-L66 HydrophobicContact CB-CD2 4.09Å; I49-L66 HydrophobicContact CD1-CD2 4.44Å; I49-L66 HydrophobicContact CG2-CB 4.31Å; I49-L66 HydrophobicContact CG2-CD2 3.78Å
50L93.8Very high89Confident7 Ų773 Ų734%0.03738%0.378CS..Hα-helixtrans-81.4-32.3-173.6-68.4175.7000114.5M46 K47 V63 L66 I97 N100 I101M46-L50 VanDerWaalsContact O-CG 3.3Å; M46-L50 WeakPolarHBondContact O-CG 3.5Å; M46-L50 PolarHBondContact O-N 3.37Å; K47-L50 PolarHBondContact O-N 3.26Å; L50-V63 HydrophobicContact CD2-CG1 4.05Å; L50-V63 HydrophobicContact CD2-CG2 4.5Å; L50-L66 HydrophobicContact CD1-CD2 4.36Å; L50-L66 HydrophobicContact CD2-CD2 3.93Å; L50-L66 HydrophobicContact CG-CD2 3.9Å; L50-I97 HydrophobicContact CD1-CB 4.15Å; L50-I97 HydrophobicContact CD1-CG1 4.11Å; L50-I97 HydrophobicContact CD1-CG2 3.88Å; L50-N100 HydrophobicContact CD1-CB 4.3Å; L50-N100 PolarHBondContact O-ND2 3.27Å; L50-I101 HydrophobicContact CD1-CG2 3.94Å; L50-I101 HydrophobicContact CD2-CG2 3.9Å
51Y91.3Very high88.7Confident112 Ų11279 Ų7944%0.43940%0.404SS..Hα-helixtrans-106.8-13.8-176.4-68-78.6000113.1K47 Q96 N100K47-Y51 HydrophobicContact CB-CD2 4.19Å; K47-Y51 HydrophobicContact CG-CD2 4.33Å; K47-Y51 HydrophobicContact CG-CE2 4.28Å; K47-Y51 WeakPolarHBondContact O-CB 3.36Å; K47-Y51 WeakPolarHBondContact O-CD2 3.35Å; K47-Y51 PolarHBondContact O-N 3.17Å; Y51-Q96 HydrophobicContact CE2-CB 4.15Å; Y51-Q96 PolarHBondContact OH-O 2.93Å; Y51-Q96 VanDerWaalsContact OH-O 3.07Å; Y51-N100 HydrophobicContact CE2-CB 4.39Å
52G86.3Confident88.5Confident20 Ų2077 Ų7721%0.20640%0.399CS..  trans83.6175.8-169.600000112.5E48 K56E48-G52 CarbonylContact O-C 3.59Å; E48-G52 WeakPolarHBondContact O-CA 3.38Å; E48-G52 PolarHBondContact O-N 2.87Å; G52-K56 VanDerWaalsContact CA-O 3.3Å; G52-K56 WeakPolarHBondContact CA-O 3.4Å
53S82.4Confident88.3Confident55 Ų5577.7 Ų77.739%0.38540%0.404SS..BIsolated β-bridgetrans-140.7141.2179.169.90000110.1D55 K56S53-D55 PolarHBondContact O-N 2.87Å; S53-K56 PolarHBondContact N-O 2.99Å; S53-K56 WeakPolarHBondContact O-CB 3.43Å; S53-K56 PolarHBondContact O-N 3.43Å; S53-K56 VanDerWaalsContact O-N 3.15Å
54N65Low88.1Confident151 Ų15179.2 Ų79.281%0.80742%0.416SS*.THydrogen-bonded Turntrans46.660.4171.7-59.6-31.8000113.5K56N54-K56 PolarHBondContact O-N 3.47Å; N54-K56 VanDerWaalsContact O-N 3.14Å
55D66.8Low88.1Confident178 Ų17880.4 Ų80.495%0.95242%0.418SS*.THydrogen-bonded Turntrans63.612.4177.7-54.6-43.4000116.3S53S53-D55 PolarHBondContact O-N 2.87Å
56K78.6Confident88.2Confident152 Ų15278.6 Ų78.666%0.66141%0.405SS*.BIsolated β-bridgetrans-99.5131.1172.2-63.7-176-179.7-179.10111.2G52 S53 N54G52-K56 VanDerWaalsContact CA-O 3.3Å; G52-K56 WeakPolarHBondContact CA-O 3.4Å; S53-K56 PolarHBondContact N-O 2.99Å; S53-K56 WeakPolarHBondContact O-CB 3.43Å; S53-K56 PolarHBondContact O-N 3.43Å; S53-K56 VanDerWaalsContact O-N 3.15Å; N54-K56 PolarHBondContact O-N 3.47Å; N54-K56 VanDerWaalsContact O-N 3.14Å
57E83.6Confident88.2Confident174 Ų17478.6 Ų78.681%0.81341%0.405SS*.PPolyproline II helixtrans-62.8148.2172-68.7-171.1162.900111.7H59E57-H59 PolarHBondContact O-N 3.26Å
58P87.5Confident88.2Confident50 Ų5080.9 Ų80.933%0.32542%0.416SS..PPolyproline II helixtrans-64.7133179.226.4-34.3000111.6I49 T60 V63I49-P58 WeakPolarHBondContact O-CB 3.3Å; P58-T60 PolarHBondContact O-N 2.91Å; P58-V63 HydrophobicContact CB-CG2 3.97Å
59H87.7Confident88.4Confident138 Ų13879 Ų7964%0.63941%0.407SS*.  trans-67.7114.9176.7-68.3-68.3000110.8E57 E61 T62 V63E57-H59 PolarHBondContact O-N 3.26Å; H59-E61 VanDerWaalsContact C-N 3.26Å; H59-E61 PolarHBondContact O-N 3.36Å; H59-T62 PolarHBondContact O-N 3.15Å; H59-T62 VanDerWaalsContact O-N 3.1Å; H59-V63 PolarHBondContact O-N 3.36Å
60T88.3Confident88.5Confident117 Ų11777.5 Ų77.572%0.71840%0.4SS*.Hα-helixtrans-56.1-37.6-173.5-48.70000113.5P58 A64P58-T60 PolarHBondContact O-N 2.91Å; T60-A64 WeakPolarHBondContact O-CB 3.19Å; T60-A64 PolarHBondContact O-N 3.36Å
61E90.9Very high88.6Confident143 Ų14378.4 Ų78.467%0.66840%0.403SS*.Hα-helixtrans-66.2-46.1178.3-172176.9-179.400111.7H59 V63 A64 Q65H59-E61 VanDerWaalsContact C-N 3.26Å; H59-E61 PolarHBondContact O-N 3.36Å; E61-V63 VanDerWaalsContact C-N 3.33Å; E61-V63 PolarHBondContact O-N 3.09Å; E61-A64 WeakPolarHBondContact O-CB 3.41Å; E61-A64 PolarHBondContact O-N 2.7Å; E61-A64 VanDerWaalsContact O-N 3.12Å; E61-Q65 WeakPolarHBondContact O-CG 3.41Å; E61-Q65 PolarHBondContact O-N 2.95Å
62T92.4Very high88.7Confident44 Ų4478.1 Ų78.127%0.2741%0.409SS..Hα-helixtrans-64.2-38.4177.7-44.60000111.7P11 I49 H59 A64 Q65 L66P11-T62 HydrophobicContact CG-CG2 3.81Å; I49-T62 HydrophobicContact CD1-CG2 4.34Å; I49-T62 HydrophobicContact CG1-CG2 4.26Å; I49-T62 HydrophobicContact CG2-CG2 3.8Å; H59-T62 PolarHBondContact O-N 3.15Å; H59-T62 VanDerWaalsContact O-N 3.1Å; T62-A64 VanDerWaalsContact C-N 3.34Å; T62-Q65 PolarHBondContact O-N 2.99Å; T62-L66 WeakPolarHBondContact O-CB 3.16Å; T62-L66 PolarHBondContact O-N 2.78Å
63V93.8Very high89.1Confident17 Ų1779.8 Ų79.810%0.10341%0.413CS..Hα-helixtrans-62.9-41.8172.7172.40000111.1I49 L50 P58 H59 E61 L66 A67I49-V63 HydrophobicContact CG2-CG2 4.25Å; I49-V63 WeakPolarHBondContact O-CG2 3.45Å; L50-V63 HydrophobicContact CD2-CG1 4.05Å; L50-V63 HydrophobicContact CD2-CG2 4.5Å; P58-V63 HydrophobicContact CB-CG2 3.97Å; H59-V63 PolarHBondContact O-N 3.36Å; E61-V63 VanDerWaalsContact C-N 3.33Å; E61-V63 PolarHBondContact O-N 3.09Å; V63-L66 PolarHBondContact O-N 3.48Å; V63-A67 WeakPolarHBondContact O-CB 3.48Å; V63-A67 PolarHBondContact O-N 3.43Å
64A93.6Very high89.7Confident32 Ų3278.1 Ų78.126%0.26440%0.404SS..Hα-helixtrans-64.5-43.2177.500000112.2T60 E61 T62 A67 Q68 R104T60-A64 WeakPolarHBondContact O-CB 3.19Å; T60-A64 PolarHBondContact O-N 3.36Å; E61-A64 WeakPolarHBondContact O-CB 3.41Å; E61-A64 PolarHBondContact O-N 2.7Å; E61-A64 VanDerWaalsContact O-N 3.12Å; T62-A64 VanDerWaalsContact C-N 3.34Å; A64-A67 PolarHBondContact O-N 2.92Å; A64-Q68 WeakPolarHBondContact O-CB 3.35Å; A64-Q68 PolarHBondContact O-N 3.14Å; A64-R104 VanDerWaalsContact CB-NH2 3.26Å
65Q95.3Very high91Very high87 Ų8770.9 Ų70.941%0.40737%0.366SS..Hα-helixtrans-61.2-47.8174.5-70.9174.72.200111.2P11 E61 T62 A67 Q68 E69P11-Q65 HydrophobicContact CB-CB 4.42Å; P11-Q65 HydrophobicContact CG-CB 4.13Å; E61-Q65 WeakPolarHBondContact O-CG 3.41Å; E61-Q65 PolarHBondContact O-N 2.95Å; T62-Q65 PolarHBondContact O-N 2.99Å; Q65-A67 PolarHBondContact O-N 3.34Å; Q65-Q68 PolarHBondContact O-N 2.68Å; Q65-E69 WeakPolarHBondContact O-CG 3.46Å; Q65-E69 PolarHBondContact O-N 2.9Å
66L96.4Very high92.3Very high0 Ų062.5 Ų62.50%032%0.321CS..Hα-helixtrans-59.5-46177.4-179.862.2000111.9P11 I15 M46 I49 L50 T62 V63 Q68 E69 L70P11-L66 HydrophobicContact CB-CB 4.11Å; P11-L66 HydrophobicContact CB-CD1 4.23Å; I15-L66 HydrophobicContact CD1-CD1 3.88Å; I15-L66 HydrophobicContact CG1-CD1 4.09Å; M46-L66 HydrophobicContact CB-CD2 4.27Å; M46-L66 HydrophobicContact CE-CD1 4.27Å; M46-L66 HydrophobicContact CG-CD1 4.18Å; M46-L66 HydrophobicContact CG-CD2 4.43Å; I49-L66 HydrophobicContact CB-CD2 4.09Å; I49-L66 HydrophobicContact CD1-CD2 4.44Å; I49-L66 HydrophobicContact CG2-CB 4.31Å; I49-L66 HydrophobicContact CG2-CD2 3.78Å; L50-L66 HydrophobicContact CD1-CD2 4.36Å; L50-L66 HydrophobicContact CD2-CD2 3.93Å; L50-L66 HydrophobicContact CG-CD2 3.9Å; T62-L66 WeakPolarHBondContact O-CB 3.16Å; T62-L66 PolarHBondContact O-N 2.78Å; V63-L66 PolarHBondContact O-N 3.48Å; L66-Q68 PolarHBondContact O-N 3.16Å; L66-E69 PolarHBondContact O-N 2.92Å; L66-L70 HydrophobicContact CG-CD1 4.24Å; L66-L70 VanDerWaalsContact O-CG 3.27Å; L66-L70 WeakPolarHBondContact O-CG 3.34Å; L66-L70 PolarHBondContact O-N 3.42Å
67A96Very high93.1Very high0 Ų056.7 Ų56.70%030%0.297CS..Hα-helixtrans-60.6-44.3177.400000111.8V63 A64 Q65 E69 L70 Y71 R104V63-A67 WeakPolarHBondContact O-CB 3.48Å; V63-A67 PolarHBondContact O-N 3.43Å; A64-A67 PolarHBondContact O-N 2.92Å; Q65-A67 PolarHBondContact O-N 3.34Å; A67-E69 VanDerWaalsContact C-N 3.35Å; A67-E69 PolarHBondContact O-N 3.41Å; A67-L70 WeakPolarHBondContact O-CB 3.28Å; A67-L70 PolarHBondContact O-N 2.92Å; A67-Y71 HydrophobicContact CB-CE2 4.01Å; A67-Y71 WeakPolarHBondContact O-CD2 3.5Å; A67-Y71 VanDerWaalsContact O-CE2 3.25Å; A67-Y71 WeakPolarHBondContact O-CE2 3.26Å; A67-Y71 PolarHBondContact O-N 3.45Å; A67-Y71 VanDerWaalsContact O-N 3.14Å; A67-R104 VanDerWaalsContact CB-NH1 3.34Å
68Q95.6Very high93.6Very high95 Ų9549.3 Ų49.344%0.44427%0.266SS..Hα-helixtrans-61.9-43.4177.9-169.963.153.100111.9A64 Q65 L66 L70 Y71 N72A64-Q68 WeakPolarHBondContact O-CB 3.35Å; A64-Q68 PolarHBondContact O-N 3.14Å; Q65-Q68 PolarHBondContact O-N 2.68Å; L66-Q68 PolarHBondContact O-N 3.16Å; Q68-L70 VanDerWaalsContact C-N 3.34Å; Q68-L70 PolarHBondContact O-N 3.39Å; Q68-Y71 PolarHBondContact O-N 3.34Å; Q68-N72 PolarHBondContact NE2-OD1 3.42Å; Q68-N72 WeakPolarHBondContact O-CB 3.33Å; Q68-N72 VanDerWaalsContact O-CG 3.23Å; Q68-N72 PolarHBondContact O-N 3.2Å
69E96.6Very high94.1Very high56 Ų5647.1 Ų47.126%0.26225%0.251SS..Hα-helixtrans-65.6-36.2177-70.3-60.2148.700112.2A12 I15 Q65 L66 A67 Y71 N73A12-E69 HydrophobicContact CB-CG 4.33Å; I15-E69 HydrophobicContact CB-CB 4.45Å; I15-E69 HydrophobicContact CG1-CB 3.86Å; Q65-E69 WeakPolarHBondContact O-CG 3.46Å; Q65-E69 PolarHBondContact O-N 2.9Å; L66-E69 PolarHBondContact O-N 2.92Å; A67-E69 VanDerWaalsContact C-N 3.35Å; A67-E69 PolarHBondContact O-N 3.41Å; E69-Y71 VanDerWaalsContact C-N 3.34Å; E69-Y71 PolarHBondContact O-N 2.96Å; E69-N73 VanDerWaalsContact O-CB 3.28Å; E69-N73 WeakPolarHBondContact O-CB 3.18Å; E69-N73 PolarHBondContact O-N 2.87Å; E69-N73 VanDerWaalsContact O-N 3.09Å; E69-N73 PolarHBondContact O-ND2 3.36Å; E69-N73 PolarHBondContact OE2-ND2 2.63Å
70L96.1Very high94.5Very high0 Ų040.7 Ų40.70%022%0.221CC..Hα-helixtrans-59.3-44.6174-76.3170000112.1I15 M46 L66 A67 Q68 G74 L75 L76 I101I15-L70 HydrophobicContact CD1-CD2 3.57Å; I15-L70 HydrophobicContact CD1-CG 3.97Å; M46-L70 HydrophobicContact CE-CD1 4.32Å; M46-L70 HydrophobicContact CE-CD2 3.68Å; M46-L70 HydrophobicContact CE-CG 4.4Å; L66-L70 HydrophobicContact CG-CD1 4.24Å; L66-L70 VanDerWaalsContact O-CG 3.27Å; L66-L70 WeakPolarHBondContact O-CG 3.34Å; L66-L70 PolarHBondContact O-N 3.42Å; A67-L70 WeakPolarHBondContact O-CB 3.28Å; A67-L70 PolarHBondContact O-N 2.92Å; Q68-L70 VanDerWaalsContact C-N 3.34Å; Q68-L70 PolarHBondContact O-N 3.39Å; L70-G74 PolarHBondContact O-N 3.42Å; L70-L75 HydrophobicContact CD2-CB 3.84Å; L70-L75 HydrophobicContact CD2-CD2 3.7Å; L70-L75 HydrophobicContact CD2-CG 4.02Å; L70-L75 PolarHBondContact O-N 2.93Å; L70-L76 HydrophobicContact CB-CD2 4.31Å; L70-L76 HydrophobicContact CB-CG 4.43Å; L70-L76 HydrophobicContact CD1-CD2 4.31Å; L70-L76 HydrophobicContact CD2-CD2 3.95Å; L70-L76 HydrophobicContact CG-CD2 4.44Å; L70-I101 HydrophobicContact CD1-CD1 3.75Å; L70-I101 HydrophobicContact CD1-CG2 3.91Å
71Y95.4Very high94.8Very high25 Ų2539.7 Ų39.710%0.09821%0.209CC..Hα-helixtrans-70.4-51.8179.1-50.4-40.2000111.5A67 Q68 E69 N73 G74 L76 P111 T112 Y115A67-Y71 HydrophobicContact CB-CE2 4.01Å; A67-Y71 WeakPolarHBondContact O-CD2 3.5Å; A67-Y71 VanDerWaalsContact O-CE2 3.25Å; A67-Y71 WeakPolarHBondContact O-CE2 3.26Å; A67-Y71 PolarHBondContact O-N 3.45Å; A67-Y71 VanDerWaalsContact O-N 3.14Å; Q68-Y71 PolarHBondContact O-N 3.34Å; E69-Y71 VanDerWaalsContact C-N 3.34Å; E69-Y71 PolarHBondContact O-N 2.96Å; Y71-N73 PolarHBondContact O-N 3.5Å; Y71-G74 PolarHBondContact O-N 3.22Å; Y71-G74 VanDerWaalsContact O-N 3.1Å; Y71-L76 HydrophobicContact CD1-CD1 4.27Å; Y71-L76 HydrophobicContact CE1-CD1 4.21Å; Y71-P111 HydrophobicContact CE2-CB 4.4Å; Y71-T112 HydrophobicContact CE1-CG2 4.28Å; Y71-T112 PolarHBondContact OH-OG1 3.29Å; Y71-Y115 HydrophobicContact CD1-CD1 4.09Å; Y71-Y115 AromaticContact CD1-CD2 3.79Å; Y71-Y115 HydrophobicContact CD1-CD2 3.79Å; Y71-Y115 HydrophobicContact CD1-CE2 4.24Å; Y71-Y115 AromaticContact CD1-CG 3.7Å; Y71-Y115 HydrophobicContact CD1-CG 3.7Å; Y71-Y115 HydrophobicContact CE1-CG 4.3Å; Y71-Y115 AromaticContact CG-CD2 3.94Å; Y71-Y115 HydrophobicContact CG-CD2 3.94Å; Y71-Y115 HydrophobicContact CG-CE2 4.39Å; Y71-Y115 HydrophobicContact CG-CG 4.27Å
72N95.1Very high95.1Very high107 Ų10734.5 Ų34.557%0.57219%0.185SC*.Hα-helixtrans-61.4-32.1-175.3-72.2-6.2000112.9Q68Q68-N72 PolarHBondContact NE2-OD1 3.42Å; Q68-N72 WeakPolarHBondContact O-CB 3.33Å; Q68-N72 VanDerWaalsContact O-CG 3.23Å; Q68-N72 PolarHBondContact O-N 3.2Å
73N94.7Very high95.3Very high55 Ų5532.4 Ų32.429%0.29417%0.173SC..THydrogen-bonded Turntrans-96.21.7-178.3-68.9-85.2000113.2I15 K19 E69 Y71 L75I15-N73 HydrophobicContact CG2-CB 3.89Å; K19-N73 HydrophobicContact CD-CB 3.97Å; K19-N73 PolarHBondContact NZ-O 2.9Å; E69-N73 VanDerWaalsContact O-CB 3.28Å; E69-N73 WeakPolarHBondContact O-CB 3.18Å; E69-N73 PolarHBondContact O-N 2.87Å; E69-N73 VanDerWaalsContact O-N 3.09Å; E69-N73 PolarHBondContact O-ND2 3.36Å; E69-N73 PolarHBondContact OE2-ND2 2.63Å; Y71-N73 PolarHBondContact O-N 3.5Å; N73-L75 PolarHBondContact O-N 3.35Å
74G93.4Very high95.4Very high19 Ų1935 Ų3520%0.19618%0.184CC..THydrogen-bonded Turntrans55.535.6-175.900000112.4L70 Y71 L76 I77 A78L70-G74 PolarHBondContact O-N 3.42Å; Y71-G74 PolarHBondContact O-N 3.22Å; Y71-G74 VanDerWaalsContact O-N 3.1Å; G74-L76 VanDerWaalsContact C-N 3.31Å; G74-L76 PolarHBondContact O-N 3.04Å; G74-I77 WeakPolarHBondContact O-CG2 3.32Å; G74-A78 PolarHBondContact O-N 3.33Å
75L93.9Very high95.5Very high0 Ų037 Ų370%019%0.185CC..Hα-helixtrans-73.6-27.4-175.2-175.559.8000111.7I15 L18 K19 M46 L70 N73 A78 L79I15-L75 HydrophobicContact CD1-CD2 3.27Å; I15-L75 HydrophobicContact CG1-CD2 4.46Å; I15-L75 HydrophobicContact CG2-CD2 4.23Å; L18-L75 HydrophobicContact CD2-CD2 3.74Å; L18-L75 HydrophobicContact CG-CD1 4.45Å; L18-L75 HydrophobicContact CG-CD2 4.2Å; K19-L75 HydrophobicContact CD-CD1 4.39Å; K19-L75 HydrophobicContact CG-CD1 3.67Å; M46-L75 HydrophobicContact CE-CD2 4.44Å; L70-L75 HydrophobicContact CD2-CB 3.84Å; L70-L75 HydrophobicContact CD2-CD2 3.7Å; L70-L75 HydrophobicContact CD2-CG 4.02Å; L70-L75 PolarHBondContact O-N 2.93Å; N73-L75 PolarHBondContact O-N 3.35Å; L75-A78 HydrophobicContact CD1-CB 4.33Å; L75-A78 PolarHBondContact O-N 2.7Å; L75-L79 HydrophobicContact CD1-CD1 4.42Å; L75-L79 HydrophobicContact CD1-CD2 4.4Å; L75-L79 HydrophobicContact CD1-CG 3.95Å; L75-L79 HydrophobicContact CD2-CD1 4.24Å; L75-L79 HydrophobicContact CG-CD1 3.88Å; L75-L79 HydrophobicContact CG-CG 3.93Å; L75-L79 WeakPolarHBondContact O-CB 3.31Å; L75-L79 WeakPolarHBondContact O-CG 3.42Å; L75-L79 PolarHBondContact O-N 3.21Å
76L92.9Very high95.6Very high2 Ų233 Ų331%0.0117%0.166CC..Hα-helixtrans-62.3-47.4179.5-59.4-173.5000112.3L70 Y71 G74 V80 I101 T112 Y115L70-L76 HydrophobicContact CB-CD2 4.31Å; L70-L76 HydrophobicContact CB-CG 4.43Å; L70-L76 HydrophobicContact CD1-CD2 4.31Å; L70-L76 HydrophobicContact CD2-CD2 3.95Å; L70-L76 HydrophobicContact CG-CD2 4.44Å; Y71-L76 HydrophobicContact CD1-CD1 4.27Å; Y71-L76 HydrophobicContact CE1-CD1 4.21Å; G74-L76 VanDerWaalsContact C-N 3.31Å; G74-L76 PolarHBondContact O-N 3.04Å; L76-V80 VanDerWaalsContact O-CG2 3.31Å; L76-V80 WeakPolarHBondContact O-CG2 3.33Å; L76-V80 PolarHBondContact O-N 3.17Å; L76-I101 HydrophobicContact CD1-CD1 3.72Å; L76-I101 HydrophobicContact CD2-CD1 3.2Å; L76-I101 HydrophobicContact CG-CD1 4.08Å; L76-T112 HydrophobicContact CD1-CG2 4.32Å; L76-Y115 HydrophobicContact CD1-CD1 4.27Å; L76-Y115 HydrophobicContact CD1-CE1 4.16Å
77I94.9Very high95.5Very high30 Ų3037.1 Ų37.115%0.15419%0.185CC..Hα-helixtrans-63.6-46175-170.4-178.7000110.5G74 L79 V80 E81 E121 V122G74-I77 WeakPolarHBondContact O-CG2 3.32Å; I77-L79 VanDerWaalsContact C-N 3.33Å; I77-L79 PolarHBondContact O-N 3.37Å; I77-V80 PolarHBondContact O-N 2.95Å; I77-V80 VanDerWaalsContact O-N 3.09Å; I77-E81 HydrophobicContact CG1-CG 3.96Å; I77-E81 WeakPolarHBondContact O-CG 3.31Å; I77-E81 PolarHBondContact O-N 3.06Å; I77-E121 HydrophobicContact CD1-CB 4.44Å; I77-E121 HydrophobicContact CD1-CG 3.29Å; I77-E121 HydrophobicContact CG1-CG 4.34Å; I77-V122 HydrophobicContact CB-CG2 3.75Å; I77-V122 HydrophobicContact CG1-CG2 4.13Å
78A95.9Very high95.5Very high19 Ų1943.6 Ų43.616%0.15721%0.214CC..Hα-helixtrans-61.5-39-177.700000112.8L22 G74 L75 N82L22-A78 HydrophobicContact CD2-CB 4.41Å; G74-A78 PolarHBondContact O-N 3.33Å; L75-A78 HydrophobicContact CD1-CB 4.33Å; L75-A78 PolarHBondContact O-N 2.7Å; A78-N82 WeakPolarHBondContact O-CB 3.26Å; A78-N82 PolarHBondContact O-N 3.33Å; A78-N82 VanDerWaalsContact O-N 3.15Å; A78-N82 PolarHBondContact O-ND2 3.08Å
79L96.4Very high95.5Very high4 Ų443.7 Ų43.72%0.02122%0.215CC..Hα-helixtrans-66.5-38.2176-74.5173.2000112.2L18 L22 L43 L75 I77 L83 I86 V94L18-L79 HydrophobicContact CD1-CD2 4.44Å; L18-L79 HydrophobicContact CD2-CD2 4.25Å; L18-L79 HydrophobicContact CG-CD2 4.44Å; L22-L79 HydrophobicContact CD2-CD2 4.26Å; L43-L79 HydrophobicContact CD2-CD2 4.32Å; L75-L79 HydrophobicContact CD1-CD1 4.42Å; L75-L79 HydrophobicContact CD1-CD2 4.4Å; L75-L79 HydrophobicContact CD1-CG 3.95Å; L75-L79 HydrophobicContact CD2-CD1 4.24Å; L75-L79 HydrophobicContact CG-CD1 3.88Å; L75-L79 HydrophobicContact CG-CG 3.93Å; L75-L79 WeakPolarHBondContact O-CB 3.31Å; L75-L79 WeakPolarHBondContact O-CG 3.42Å; L75-L79 PolarHBondContact O-N 3.21Å; I77-L79 VanDerWaalsContact C-N 3.33Å; I77-L79 PolarHBondContact O-N 3.37Å; L79-L83 WeakPolarHBondContact O-CA 3.35Å; L79-L83 WeakPolarHBondContact O-CB 3.49Å; L79-L83 PolarHBondContact O-N 3.43Å; L79-L83 VanDerWaalsContact O-N 3.12Å; L79-I86 HydrophobicContact CD2-CD1 4.02Å; L79-V94 HydrophobicContact CB-CG1 4.09Å; L79-V94 HydrophobicContact CD2-CG2 4.13Å
80V95.9Very high95.5Very high2 Ų241.1 Ų41.11%0.01220%0.203CC..Hα-helixtrans-72.4-46.9179.3174.80000111L76 I77 N82 L83 F98 V125 L126 M142L76-V80 VanDerWaalsContact O-CG2 3.31Å; L76-V80 WeakPolarHBondContact O-CG2 3.33Å; L76-V80 PolarHBondContact O-N 3.17Å; I77-V80 PolarHBondContact O-N 2.95Å; I77-V80 VanDerWaalsContact O-N 3.09Å; V80-N82 VanDerWaalsContact C-N 3.26Å; V80-N82 PolarHBondContact O-N 3.03Å; V80-L83 WeakPolarHBondContact O-CB 3.48Å; V80-L83 PolarHBondContact O-N 2.96Å; V80-F98 HydrophobicContact CG2-CD2 4.39Å; V80-F98 HydrophobicContact CG2-CE2 4.34Å; V80-V125 HydrophobicContact CG1-CB 4.11Å; V80-V125 HydrophobicContact CG1-CG1 3.66Å; V80-L126 HydrophobicContact CG1-CD2 3.58Å; V80-L126 HydrophobicContact CG1-CG 3.81Å; V80-L126 HydrophobicContact CG2-CD2 4.02Å; V80-L126 HydrophobicContact CG2-CG 4.45Å; V80-M142 HydrophobicContact CG2-CE 4.4Å; V80-M142 HydrophobicContact CG2-SD 4.46Å
81E95.9Very high95.6Very high97 Ų9742.1 Ų42.145%0.45321%0.207SC..Hα-helixtrans-60.3-36.5178.7-74.6-179.7148.800112.7I77 V125I77-E81 HydrophobicContact CG1-CG 3.96Å; I77-E81 WeakPolarHBondContact O-CG 3.31Å; I77-E81 PolarHBondContact O-N 3.06Å; E81-V125 HydrophobicContact CB-CG1 4.49Å; E81-V125 HydrophobicContact CG-CG1 3.89Å; E81-V125 HydrophobicContact CG-CG2 4.02Å
82N96.4Very high95.7Very high33 Ų3344.6 Ų44.618%0.17622%0.218CC..THydrogen-bonded Turntrans-103.512.9-175-59-67.8000112.9L22 V26 A78 V80 Q84 Y85L22-N82 HydrophobicContact CD1-CB 3.85Å; L22-N82 HydrophobicContact CD2-CB 4.07Å; L22-N82 HydrophobicContact CG-CB 4.01Å; V26-N82 HydrophobicContact CG2-CB 3.95Å; V26-N82 WeakPolarHBondContact CG2-OD1 2.95Å; A78-N82 WeakPolarHBondContact O-CB 3.26Å; A78-N82 PolarHBondContact O-N 3.33Å; A78-N82 VanDerWaalsContact O-N 3.15Å; A78-N82 PolarHBondContact O-ND2 3.08Å; V80-N82 VanDerWaalsContact C-N 3.26Å; V80-N82 PolarHBondContact O-N 3.03Å; N82-Q84 PolarHBondContact O-N 3.04Å; N82-Q84 VanDerWaalsContact O-N 3.07Å; N82-Y85 HydrophobicContact CB-CD2 4.03Å; N82-Y85 PolarHBondContact O-N 3.48Å
83L97.3Very high95.9Very high0 Ų040.1 Ų40.10%019%0.194CC..G310 helixtrans-56.4-31.2-174.9-171.261.2000112.8L79 V80 Y85 I86 K91 V94 I135 N138 M142L79-L83 WeakPolarHBondContact O-CA 3.35Å; L79-L83 WeakPolarHBondContact O-CB 3.49Å; L79-L83 PolarHBondContact O-N 3.43Å; L79-L83 VanDerWaalsContact O-N 3.12Å; V80-L83 WeakPolarHBondContact O-CB 3.48Å; V80-L83 PolarHBondContact O-N 2.96Å; L83-Y85 PolarHBondContact O-N 2.86Å; L83-I86 HydrophobicContact CD1-CD1 4.32Å; L83-I86 PolarHBondContact O-N 2.95Å; L83-K91 HydrophobicContact CD1-CB 4.09Å; L83-K91 HydrophobicContact CD1-CG 3.91Å; L83-K91 HydrophobicContact CG-CG 4.17Å; L83-K91 VanDerWaalsContact O-CE 3.27Å; L83-K91 WeakPolarHBondContact O-CE 3.31Å; L83-V94 HydrophobicContact CD1-CB 4Å; L83-V94 HydrophobicContact CD1-CG1 3.96Å; L83-V94 HydrophobicContact CD1-CG2 4.23Å; L83-I135 HydrophobicContact CB-CD1 4.46Å; L83-I135 HydrophobicContact CB-CG2 4.09Å; L83-I135 HydrophobicContact CD2-CB 4.01Å; L83-I135 HydrophobicContact CD2-CG2 4.06Å; L83-I135 HydrophobicContact CG-CB 4.3Å; L83-I135 HydrophobicContact CG-CG2 3.78Å; L83-N138 HydrophobicContact CD2-CB 3.9Å; L83-M142 HydrophobicContact CD2-CE 3.79Å
84Q96.3Very high96Very high72 Ų7237.6 Ų37.634%0.33618%0.181SC..G310 helixtrans-62.3-29.4178.562.3179.9-9.500113.9N82 Q134 I135N82-Q84 PolarHBondContact O-N 3.04Å; N82-Q84 VanDerWaalsContact O-N 3.07Å; Q84-Q134 HydrophobicContact CB-CG 4.28Å; Q84-I135 HydrophobicContact CB-CG2 4.26Å
85Y95.4Very high96.3Very high73 Ų7337 Ų3729%0.28617%0.174SC..G310 helixtrans-85.7-13-178.5-56.4-71.9000113.3V26 H28 N82 L83V26-Y85 HydrophobicContact CB-CD2 4.48Å; V26-Y85 HydrophobicContact CB-CE2 4.38Å; V26-Y85 HydrophobicContact CG1-CE2 4.24Å; V26-Y85 HydrophobicContact CG2-CD2 3.71Å; V26-Y85 HydrophobicContact CG2-CE2 3.91Å; V26-Y85 HydrophobicContact CG2-CG 4.4Å; H28-Y85 AromaticContact NE2-CD1 3.71Å; H28-Y85 AromaticContact NE2-CE1 3.37Å; H28-Y85 WeakPolarHBondContact NE2-CE1 3.44Å; N82-Y85 HydrophobicContact CB-CD2 4.03Å; N82-Y85 PolarHBondContact O-N 3.48Å; L83-Y85 PolarHBondContact O-N 2.86Å
86I96.1Very high96.5Very high3 Ų340.8 Ų40.82%0.01519%0.191CC..SBendtrans-80.8142.7178.5-58.1177.7000108.9L22 V39 L43 L79 L83 G90 K91 V94L22-I86 HydrophobicContact CD1-CD1 4.23Å; L22-I86 HydrophobicContact CD1-CG1 4.03Å; V39-I86 HydrophobicContact CG1-CG2 4.39Å; L43-I86 HydrophobicContact CD1-CG2 4.02Å; L79-I86 HydrophobicContact CD2-CD1 4.02Å; L83-I86 HydrophobicContact CD1-CD1 4.32Å; L83-I86 PolarHBondContact O-N 2.95Å; I86-G90 VanDerWaalsContact CG2-C 3.45Å; I86-K91 HydrophobicContact CB-CG 4.38Å; I86-K91 PolarHBondContact O-NZ 2.77Å; I86-V94 HydrophobicContact CD1-CG2 3.83Å
87E95.4Very high96.7Very high87 Ų8740.7 Ų40.741%0.40719%0.191SC..  trans-63.5166.2177.769.2178.1-173.300113.2S40 E89 G90 K91S40-E87 VanDerWaalsContact CB-OE1 3.3Å; S40-E87 WeakPolarHBondContact CB-OE1 3.3Å; S40-E87 PolarHBondContact OG-OE1 3.25Å; E87-E89 PolarHBondContact O-N 2.86Å; E87-G90 PolarHBondContact O-N 3.38Å; E87-G90 VanDerWaalsContact O-N 3.13Å; E87-K91 WeakPolarHBondContact O-CG 3.35Å; E87-K91 PolarHBondContact O-N 3.04Å
88F94.8Very high96.9Very high137 Ų13739.5 Ų39.560%0.60118%0.184SC*.Hα-helixtrans-56.3-48.2-172.3178.5-103.4000114.3K91F88-K91 PolarHBondContact O-N 3.38Å
89E96.1Very high97Very high97 Ų9739.5 Ų39.545%0.45318%0.182SC..Hα-helixtrans-68.9-38.6176.2-71.6-57.5137.400111.6E87 K91 K92 D93E87-E89 PolarHBondContact O-N 2.86Å; E89-K91 VanDerWaalsContact C-N 3.29Å; E89-K91 PolarHBondContact O-N 3.49Å; E89-K92 WeakPolarHBondContact O-CA 3.24Å; E89-K92 WeakPolarHBondContact O-CB 3.35Å; E89-K92 PolarHBondContact O-N 3.02Å; E89-K92 IonicContact OE1-NZ 3.39Å; E89-K92 PolarHBondContact OE1-NZ 3.36Å; E89-K92 WeakPolarHBondContact OE2-CD 3.16Å; E89-K92 IonicContact OE2-NZ 2.69Å; E89-D93 PolarHBondContact O-N 3.5Å
90G97.5Very high97Very high1 Ų141 Ų411%0.0119%0.19CC..Hα-helixtrans-58.6-37.3174.400000113.2I86 E87 K92 D93 V94I86-G90 VanDerWaalsContact CG2-C 3.45Å; E87-G90 PolarHBondContact O-N 3.38Å; E87-G90 VanDerWaalsContact O-N 3.13Å; G90-K92 VanDerWaalsContact C-N 3.3Å; G90-K92 PolarHBondContact O-N 3.33Å; G90-D93 PolarHBondContact O-N 3.15Å; G90-V94 WeakPolarHBondContact O-CG2 3.16Å; G90-V94 PolarHBondContact O-N 2.87Å
91K98.1Very high97.1Very high22 Ų2241 Ų4110%0.09619%0.19CC..Hα-helixtrans-60.6-38.8173.5-68.2179.1174.982.30111.9L83 I86 E87 F88 E89 C95 I135 N138L83-K91 HydrophobicContact CD1-CB 4.09Å; L83-K91 HydrophobicContact CD1-CG 3.91Å; L83-K91 HydrophobicContact CG-CG 4.17Å; L83-K91 VanDerWaalsContact O-CE 3.27Å; L83-K91 WeakPolarHBondContact O-CE 3.31Å; I86-K91 HydrophobicContact CB-CG 4.38Å; I86-K91 PolarHBondContact O-NZ 2.77Å; E87-K91 WeakPolarHBondContact O-CG 3.35Å; E87-K91 PolarHBondContact O-N 3.04Å; F88-K91 PolarHBondContact O-N 3.38Å; E89-K91 VanDerWaalsContact C-N 3.29Å; E89-K91 PolarHBondContact O-N 3.49Å; K91-C95 PolarHBondContact O-N 3.46Å; K91-C95 PolarHBondContact O-SG 3.45Å; K91-C95 VanDerWaalsContact O-SG 3.35Å; K91-I135 HydrophobicContact CD-CG2 4.06Å; K91-I135 VanDerWaalsContact CE-CG2 3.46Å; K91-N138 PolarHBondContact O-ND2 3.45Å
92K97.7Very high97.2Very high76 Ų7636.3 Ų36.333%0.3317%0.168SC..Hα-helixtrans-68.4-40.2175.9-62.7176.7-176.8168.10111.2E89 G90 V94 C95 Q96E89-K92 WeakPolarHBondContact O-CA 3.24Å; E89-K92 WeakPolarHBondContact O-CB 3.35Å; E89-K92 PolarHBondContact O-N 3.02Å; E89-K92 IonicContact OE1-NZ 3.39Å; E89-K92 PolarHBondContact OE1-NZ 3.36Å; E89-K92 WeakPolarHBondContact OE2-CD 3.16Å; E89-K92 IonicContact OE2-NZ 2.69Å; G90-K92 VanDerWaalsContact C-N 3.3Å; G90-K92 PolarHBondContact O-N 3.33Å; K92-V94 VanDerWaalsContact C-N 3.35Å; K92-C95 WeakPolarHBondContact O-CB 3.12Å; K92-C95 PolarHBondContact O-N 3.3Å; K92-Q96 WeakPolarHBondContact O-CG 3.37Å; K92-Q96 PolarHBondContact O-N 3.29Å
93D98Very high97.2Very high14 Ų1440.7 Ų40.78%0.07518%0.182CC..Hα-helixtrans-63-41.9176.9-71.1-15.3000111.6L43 K47 E89 G90 C95 Q96 I97L43-D93 HydrophobicContact CB-CB 4.01Å; K47-D93 HydrophobicContact CD-CB 3.66Å; K47-D93 WeakPolarHBondContact CD-OD1 3.18Å; K47-D93 WeakPolarHBondContact CE-OD1 3.48Å; K47-D93 IonicContact NZ-OD1 3.84Å; K47-D93 PolarHBondContact NZ-OD1 3.12Å; E89-D93 PolarHBondContact O-N 3.5Å; G90-D93 PolarHBondContact O-N 3.15Å; D93-C95 PolarHBondContact O-N 2.87Å; D93-Q96 PolarHBondContact O-N 3.28Å; D93-I97 WeakPolarHBondContact O-CB 3.42Å; D93-I97 WeakPolarHBondContact O-CD1 3.32Å; D93-I97 VanDerWaalsContact O-CG1 3.24Å; D93-I97 WeakPolarHBondContact O-CG1 3.34Å; D93-I97 PolarHBondContact O-N 3.48Å
94V98.4Very high97.1Very high2 Ų242.8 Ų42.81%0.01219%0.19CC..Hα-helixtrans-57.3-47.5172.8171.70000111.1L43 L79 L83 I86 G90 K92 Q96 I97 F98 M142L43-V94 HydrophobicContact CD1-CG2 4.04Å; L43-V94 HydrophobicContact CD2-CG2 3.78Å; L79-V94 HydrophobicContact CB-CG1 4.09Å; L79-V94 HydrophobicContact CD2-CG2 4.13Å; L83-V94 HydrophobicContact CD1-CB 4Å; L83-V94 HydrophobicContact CD1-CG1 3.96Å; L83-V94 HydrophobicContact CD1-CG2 4.23Å; I86-V94 HydrophobicContact CD1-CG2 3.83Å; G90-V94 WeakPolarHBondContact O-CG2 3.16Å; G90-V94 PolarHBondContact O-N 2.87Å; K92-V94 VanDerWaalsContact C-N 3.35Å; V94-Q96 VanDerWaalsContact C-N 3.31Å; V94-Q96 PolarHBondContact O-N 2.97Å; V94-I97 PolarHBondContact O-N 3.42Å; V94-F98 WeakPolarHBondContact O-CB 3.42Å; V94-F98 PolarHBondContact O-N 3.18Å; V94-M142 HydrophobicContact CG1-SD 4.26Å
95C98.2Very high97Very high6 Ų645.5 Ų45.54%0.04120%0.203CC..Hα-helixtrans-58.4-43.4176.6-660000112.1K91 K92 D93 N99 N138 I141 M142K91-C95 PolarHBondContact O-N 3.46Å; K91-C95 PolarHBondContact O-SG 3.45Å; K91-C95 VanDerWaalsContact O-SG 3.35Å; K92-C95 WeakPolarHBondContact O-CB 3.12Å; K92-C95 PolarHBondContact O-N 3.3Å; D93-C95 PolarHBondContact O-N 2.87Å; C95-N99 VanDerWaalsContact O-CB 3.25Å; C95-N99 WeakPolarHBondContact O-CB 3.35Å; C95-N99 PolarHBondContact O-N 2.75Å; C95-N99 PolarHBondContact O-ND2 3.21Å; C95-N138 VanDerWaalsContact SG-CB 3.57Å; C95-N138 PolarHBondContact SG-ND2 3.13Å; C95-I141 HydrophobicContact CB-CG2 4.43Å; C95-M142 HydrophobicContact CB-CG 4.16Å
96Q97.9Very high96.8Very high79 Ų7946.6 Ų46.637%0.36921%0.212SC..Hα-helixtrans-65.3-47.9-179.9-73.5-178.9-4.200111.7Y51 K92 D93 V94 N99 N100Y51-Q96 HydrophobicContact CE2-CB 4.15Å; Y51-Q96 PolarHBondContact OH-O 2.93Å; Y51-Q96 VanDerWaalsContact OH-O 3.07Å; K92-Q96 WeakPolarHBondContact O-CG 3.37Å; K92-Q96 PolarHBondContact O-N 3.29Å; D93-Q96 PolarHBondContact O-N 3.28Å; V94-Q96 VanDerWaalsContact C-N 3.31Å; V94-Q96 PolarHBondContact O-N 2.97Å; Q96-N99 PolarHBondContact O-N 2.94Å; Q96-N100 VanDerWaalsContact O-CB 3.27Å; Q96-N100 WeakPolarHBondContact O-CB 3.31Å; Q96-N100 PolarHBondContact O-N 3Å
97I98.2Very high96.6Very high1 Ų149.8 Ų49.81%0.00525%0.246CC..Hα-helixtrans-57.8-52.9176.2-69.6162.9000110.1L43 M46 K47 L50 D93 V94 N99 N100 I101L43-I97 HydrophobicContact CB-CD1 4.31Å; L43-I97 HydrophobicContact CD2-CD1 3.78Å; M46-I97 HydrophobicContact CB-CD1 3.79Å; M46-I97 HydrophobicContact CB-CG1 4.29Å; M46-I97 HydrophobicContact CE-CD1 4.23Å; M46-I97 HydrophobicContact CE-CG2 3.76Å; M46-I97 HydrophobicContact SD-CD1 4.37Å; K47-I97 HydrophobicContact CG-CD1 4.1Å; K47-I97 HydrophobicContact CG-CG1 3.7Å; L50-I97 HydrophobicContact CD1-CB 4.15Å; L50-I97 HydrophobicContact CD1-CG1 4.11Å; L50-I97 HydrophobicContact CD1-CG2 3.88Å; D93-I97 WeakPolarHBondContact O-CB 3.42Å; D93-I97 WeakPolarHBondContact O-CD1 3.32Å; D93-I97 VanDerWaalsContact O-CG1 3.24Å; D93-I97 WeakPolarHBondContact O-CG1 3.34Å; D93-I97 PolarHBondContact O-N 3.48Å; V94-I97 PolarHBondContact O-N 3.42Å; I97-N99 PolarHBondContact O-N 3.04Å; I97-N100 PolarHBondContact O-N 3.37Å; I97-I101 WeakPolarHBondContact O-CG1 3.49Å; I97-I101 PolarHBondContact O-N 2.84Å
98F98.6Very high96.5Very high4 Ų450.6 Ų50.62%0.01827%0.268CS..Hα-helixtrans-57.6-46.4-178.9-175.4-80.1000111.7V80 V94 I101 L102 L116 V122 L126 M142 C146V80-F98 HydrophobicContact CG2-CD2 4.39Å; V80-F98 HydrophobicContact CG2-CE2 4.34Å; V94-F98 WeakPolarHBondContact O-CB 3.42Å; V94-F98 PolarHBondContact O-N 3.18Å; F98-I101 WeakPolarHBondContact O-CG1 3.36Å; F98-L102 HydrophobicContact CE1-CD2 4.14Å; F98-L102 WeakPolarHBondContact O-CB 3.49Å; F98-L102 PolarHBondContact O-N 3.25Å; F98-L116 HydrophobicContact CZ-CD1 4.17Å; F98-V122 HydrophobicContact CE2-CG1 4Å; F98-V122 HydrophobicContact CZ-CG1 4.29Å; F98-L126 HydrophobicContact CE1-CD1 4.45Å; F98-L126 HydrophobicContact CZ-CD1 4.01Å; F98-M142 HydrophobicContact CB-CG 4.23Å; F98-M142 HydrophobicContact CB-SD 3.7Å; F98-M142 HydrophobicContact CD1-CB 3.92Å; F98-M142 HydrophobicContact CD1-CG 3.87Å; F98-M142 HydrophobicContact CD1-SD 4.04Å; F98-M142 HydrophobicContact CD2-SD 4.11Å; F98-M142 HydrophobicContact CE1-CB 4.09Å; F98-M142 HydrophobicContact CG-CG 4.11Å; F98-M142 HydrophobicContact CG-SD 3.68Å; F98-C146 VanDerWaalsContact CE1-SG 3.5Å
99N98.2Very high96.5Very high19 Ų1951.5 Ų51.510%0.10227%0.267CS..Hα-helixtrans-70.4-35.5-179.1-67.9-15.8000112.3C95 Q96 I97 R103 E145C95-N99 VanDerWaalsContact O-CB 3.25Å; C95-N99 WeakPolarHBondContact O-CB 3.35Å; C95-N99 PolarHBondContact O-N 2.75Å; C95-N99 PolarHBondContact O-ND2 3.21Å; Q96-N99 PolarHBondContact O-N 2.94Å; I97-N99 PolarHBondContact O-N 3.04Å; N99-R103 VanDerWaalsContact O-CG 3.25Å; N99-R103 WeakPolarHBondContact O-CG 3.39Å; N99-R103 PolarHBondContact O-N 3.49Å; N99-R103 VanDerWaalsContact O-N 3.16Å; N99-E145 HydrophobicContact CB-CG 4.3Å; N99-E145 WeakPolarHBondContact OD1-CB 3.19Å
100N97.7Very high96.5Very high37 Ų3747.7 Ų47.720%0.19825%0.252CS..Hα-helixtrans-64.1-52.8177.3-179.1-64.9000110.9L50 Y51 Q96 I97 L102 R103 R104L50-N100 HydrophobicContact CD1-CB 4.3Å; L50-N100 PolarHBondContact O-ND2 3.27Å; Y51-N100 HydrophobicContact CE2-CB 4.39Å; Q96-N100 VanDerWaalsContact O-CB 3.27Å; Q96-N100 WeakPolarHBondContact O-CB 3.31Å; Q96-N100 PolarHBondContact O-N 3Å; I97-N100 PolarHBondContact O-N 3.37Å; N100-L102 VanDerWaalsContact C-N 3.29Å; N100-L102 PolarHBondContact O-N 3.42Å; N100-R103 PolarHBondContact O-N 3.25Å; N100-R103 VanDerWaalsContact O-N 3.16Å; N100-R104 PolarHBondContact O-N 3.37Å
101I97.1Very high96.5Very high0 Ų048.7 Ų48.70%026%0.258CS..Hα-helixtrans-65.5-33.517965.4-175.2000111.7L50 L70 L76 I97 F98 R103 R104 T112L50-I101 HydrophobicContact CD1-CG2 3.94Å; L50-I101 HydrophobicContact CD2-CG2 3.9Å; L70-I101 HydrophobicContact CD1-CD1 3.75Å; L70-I101 HydrophobicContact CD1-CG2 3.91Å; L76-I101 HydrophobicContact CD1-CD1 3.72Å; L76-I101 HydrophobicContact CD2-CD1 3.2Å; L76-I101 HydrophobicContact CG-CD1 4.08Å; I97-I101 WeakPolarHBondContact O-CG1 3.49Å; I97-I101 PolarHBondContact O-N 2.84Å; F98-I101 WeakPolarHBondContact O-CG1 3.36Å; I101-R103 VanDerWaalsContact C-N 3.26Å; I101-R103 PolarHBondContact O-N 3.31Å; I101-R104 WeakPolarHBondContact O-CB 3.4Å; I101-R104 PolarHBondContact O-N 3.39Å; I101-R104 VanDerWaalsContact O-N 3.16Å; I101-T112 HydrophobicContact CG1-CG2 4.39Å; I101-T112 WeakPolarHBondContact O-CB 3.45Å; I101-T112 PolarHBondContact O-OG1 3.28Å
102L98Very high96.5Very high0 Ų047.7 Ų47.70%025%0.253CS..Hα-helixtrans-61-38.9175.9176.761.2000111.4F98 N100 R104 T112 V113 L116 E145 C146 Y149 L152F98-L102 HydrophobicContact CE1-CD2 4.14Å; F98-L102 WeakPolarHBondContact O-CB 3.49Å; F98-L102 PolarHBondContact O-N 3.25Å; N100-L102 VanDerWaalsContact C-N 3.29Å; N100-L102 PolarHBondContact O-N 3.42Å; L102-R104 VanDerWaalsContact C-N 3.27Å; L102-R104 PolarHBondContact O-N 3.18Å; L102-T112 HydrophobicContact CB-CG2 4.24Å; L102-T112 HydrophobicContact CD1-CG2 4.01Å; L102-V113 HydrophobicContact CD1-CG2 3.91Å; L102-L116 HydrophobicContact CD1-CD1 3.89Å; L102-E145 HydrophobicContact CD2-CB 3.95Å; L102-C146 HydrophobicContact CD2-CB 4.45Å; L102-Y149 HydrophobicContact CD1-CD2 4.19Å; L102-Y149 HydrophobicContact CD1-CE2 4Å; L102-Y149 HydrophobicContact CD2-CD2 4.44Å; L102-Y149 HydrophobicContact CD2-CE2 4.09Å; L102-Y149 HydrophobicContact CG-CD2 4.31Å; L102-Y149 HydrophobicContact CG-CE2 3.74Å; L102-Y149 PolarHBondContact O-OH 3.26Å; L102-L152 HydrophobicContact CD1-CD1 4.1Å
103R97.1Very high96.6Very high124 Ų12444.6 Ų44.647%0.46824%0.241SC..Hα-helixtrans-77.6-8.5178.4-67.9171.4-176.4-1782.6114.2N99 N100 I101 Q105 E145 Y149N99-R103 VanDerWaalsContact O-CG 3.25Å; N99-R103 WeakPolarHBondContact O-CG 3.39Å; N99-R103 PolarHBondContact O-N 3.49Å; N99-R103 VanDerWaalsContact O-N 3.16Å; N100-R103 PolarHBondContact O-N 3.25Å; N100-R103 VanDerWaalsContact O-N 3.16Å; I101-R103 VanDerWaalsContact C-N 3.26Å; I101-R103 PolarHBondContact O-N 3.31Å; R103-Q105 PolarHBondContact O-N 2.93Å; R103-E145 IonicContact CZ-OE1 2.97Å; R103-E145 IonicContact CZ-OE2 3.6Å; R103-E145 IonicContact NE-OE2 3.27Å; R103-E145 PolarHBondContact NE-OE2 3.29Å; R103-E145 IonicContact NH2-OE1 2.71Å; R103-E145 PolarHBondContact NH2-OE1 3.41Å; R103-E145 IonicContact NH2-OE2 3.87Å; R103-E145 PolarHBondContact NH2-OE2 3.33Å; R103-Y149 WeakPolarHBondContact CA-OH 3.37Å
104R94.5Very high96.5Very high45 Ų4547.5 Ų47.517%0.1725%0.254CS..  trans-63.6133.1-179-174.1175.7171-112.7-3.9111.3A64 A67 N100 I101 L102A64-R104 VanDerWaalsContact CB-NH2 3.26Å; A67-R104 VanDerWaalsContact CB-NH1 3.34Å; N100-R104 PolarHBondContact O-N 3.37Å; I101-R104 WeakPolarHBondContact O-CB 3.4Å; I101-R104 PolarHBondContact O-N 3.39Å; I101-R104 VanDerWaalsContact O-N 3.16Å; L102-R104 VanDerWaalsContact C-N 3.27Å; L102-R104 PolarHBondContact O-N 3.18Å
105Q93.3Very high96.5Very high129 Ų12948.5 Ų48.560%0.60326%0.258SS*.  trans-121.3146.4176.5-69.6-177.8-32.300111.3R103 R109R103-Q105 PolarHBondContact O-N 2.93Å; Q105-R109 CarbonylContact C-O 3.56Å; Q105-R109 VanDerWaalsContact CA-O 3.29Å; Q105-R109 WeakPolarHBondContact CA-O 3.24Å
106I92Very high96.5Very high95 Ų9548.2 Ų48.249%0.48726%0.256SS..BIsolated β-bridgetrans-126.399.5169.6-56.7178.5000106.6A108 R109 P111I106-A108 PolarHBondContact O-N 3.06Å; I106-R109 PolarHBondContact N-O 2.97Å; I106-R109 PolarHBondContact O-N 3.21Å; I106-R109 VanDerWaalsContact O-N 3.13Å; I106-P111 HydrophobicContact CB-CG 4.39Å; I106-P111 HydrophobicContact CD1-CG 3.63Å; I106-P111 HydrophobicContact CG1-CG 3.84Å
107G92.5Very high96.5Very high70 Ų7046.5 Ų46.572%0.72225%0.252SS*.THydrogen-bonded Turntrans60-127.5-165.800000110.5R109G107-R109 VanDerWaalsContact C-N 3.34Å
108A93Very high96.4Very high105 Ų10550.4 Ų50.487%0.86828%0.279SS*.THydrogen-bonded Turntrans-84.7-3.7177.100000114.1I106I106-A108 PolarHBondContact O-N 3.06Å
109R94.8Very high96.4Very high155 Ų15553.1 Ų53.159%0.58529%0.292SS*.BIsolated β-bridgetrans-92.7148.9-176.2-66.6-178.568.5-177.63.6111.4Q105 I106 G107 P111 E114Q105-R109 CarbonylContact C-O 3.56Å; Q105-R109 VanDerWaalsContact CA-O 3.29Å; Q105-R109 WeakPolarHBondContact CA-O 3.24Å; I106-R109 PolarHBondContact N-O 2.97Å; I106-R109 PolarHBondContact O-N 3.21Å; I106-R109 VanDerWaalsContact O-N 3.13Å; G107-R109 VanDerWaalsContact C-N 3.34Å; R109-P111 WeakPolarHBondContact O-CD 3.47Å; R109-E114 IonicContact CZ-OE1 2.7Å; R109-E114 IonicContact CZ-OE2 3.98Å; R109-E114 IonicContact NE-OE1 3.04Å; R109-E114 PolarHBondContact NE-OE1 3.43Å; R109-E114 IonicContact NE-OE2 2.63Å; R109-E114 PolarHBondContact NE-OE2 2.73Å; R109-E114 IonicContact NH2-OE1 3.98Å; R109-E114 PolarHBondContact NH2-OE1 3.08Å; R109-E114 IonicContact NH2-OE2 3.56Å; R109-E114 PolarHBondContact NH2-OE2 3.39Å
110S96.9Very high96.3Very high18 Ų1856 Ų5613%0.12631%0.305CS..  trans-116.689.1173-71.10000109.3T112 V113 E114S110-T112 VanDerWaalsContact C-N 3.29Å; S110-T112 PolarHBondContact O-N 3.25Å; S110-V113 WeakPolarHBondContact O-CB 3.23Å; S110-V113 PolarHBondContact O-N 3.21Å; S110-E114 PolarHBondContact O-N 2.84Å; S110-E114 VanDerWaalsContact O-N 3.1Å
111P97Very high96.3Very high22 Ų2257.8 Ų57.814%0.14331%0.312CS..Hα-helixtrans-56.7-38.8-171.7-26.334.1000114Y71 I106 R109 V113 E114 Y115Y71-P111 HydrophobicContact CE2-CB 4.4Å; I106-P111 HydrophobicContact CB-CG 4.39Å; I106-P111 HydrophobicContact CD1-CG 3.63Å; I106-P111 HydrophobicContact CG1-CG 3.84Å; R109-P111 WeakPolarHBondContact O-CD 3.47Å; P111-V113 VanDerWaalsContact C-N 3.34Å; P111-V113 PolarHBondContact O-N 3.48Å; P111-E114 PolarHBondContact O-N 2.84Å; P111-Y115 WeakPolarHBondContact O-CB 3.39Å; P111-Y115 PolarHBondContact O-N 2.99Å
112T98Very high96.3Very high0 Ų057.8 Ų57.80%031%0.312CS..Hα-helixtrans-68.4-34.2178.4-51.20000112.1Y71 L76 I101 L102 S110 Y115 L116Y71-T112 HydrophobicContact CE1-CG2 4.28Å; Y71-T112 PolarHBondContact OH-OG1 3.29Å; L76-T112 HydrophobicContact CD1-CG2 4.32Å; I101-T112 HydrophobicContact CG1-CG2 4.39Å; I101-T112 WeakPolarHBondContact O-CB 3.45Å; I101-T112 PolarHBondContact O-OG1 3.28Å; L102-T112 HydrophobicContact CB-CG2 4.24Å; L102-T112 HydrophobicContact CD1-CG2 4.01Å; S110-T112 VanDerWaalsContact C-N 3.29Å; S110-T112 PolarHBondContact O-N 3.25Å; T112-Y115 PolarHBondContact O-N 3.46Å; T112-L116 HydrophobicContact CG2-CD1 4.26Å; T112-L116 HydrophobicContact CG2-CG 4.42Å; T112-L116 WeakPolarHBondContact O-CB 3.4Å; T112-L116 VanDerWaalsContact O-CG 3.27Å; T112-L116 WeakPolarHBondContact O-CG 2.96Å; T112-L116 PolarHBondContact O-N 2.82Å
113V98.4Very high96.3Very high12 Ų1257.8 Ų57.87%0.07331%0.312CS..Hα-helixtrans-65.4-45.1174.8176.10000109.7L102 S110 P111 Y115 L116 C117 Y149 P151 L152L102-V113 HydrophobicContact CD1-CG2 3.91Å; S110-V113 WeakPolarHBondContact O-CB 3.23Å; S110-V113 PolarHBondContact O-N 3.21Å; P111-V113 VanDerWaalsContact C-N 3.34Å; P111-V113 PolarHBondContact O-N 3.48Å; V113-Y115 VanDerWaalsContact C-N 3.34Å; V113-Y115 PolarHBondContact O-N 2.95Å; V113-L116 PolarHBondContact O-N 2.93Å; V113-C117 PolarHBondContact O-N 3.34Å; V113-C117 PolarHBondContact O-SG 3.32Å; V113-Y149 HydrophobicContact CG1-CG 4.47Å; V113-Y149 HydrophobicContact CG2-CD1 3.47Å; V113-Y149 VanDerWaalsContact CG2-CD1 3.47Å; V113-Y149 HydrophobicContact CG2-CD2 3.93Å; V113-Y149 HydrophobicContact CG2-CE1 3.77Å; V113-Y149 HydrophobicContact CG2-CE2 4.23Å; V113-Y149 HydrophobicContact CG2-CG 3.54Å; V113-P151 HydrophobicContact CG1-CG 4.46Å; V113-L152 HydrophobicContact CG1-CD1 4.33Å; V113-L152 HydrophobicContact CG1-CD2 4.29Å; V113-L152 HydrophobicContact CG1-CG 4.09Å; V113-L152 HydrophobicContact CG2-CD1 4.41Å
114E97.8Very high96.4Very high75 Ų7554 Ų5435%0.3530%0.299SS..Hα-helixtrans-62-41.5176-62.9170.9-173.600112R109 S110 P111 C117 S118R109-E114 IonicContact CZ-OE1 2.7Å; R109-E114 IonicContact CZ-OE2 3.98Å; R109-E114 IonicContact NE-OE1 3.04Å; R109-E114 PolarHBondContact NE-OE1 3.43Å; R109-E114 IonicContact NE-OE2 2.63Å; R109-E114 PolarHBondContact NE-OE2 2.73Å; R109-E114 IonicContact NH2-OE1 3.98Å; R109-E114 PolarHBondContact NH2-OE1 3.08Å; R109-E114 IonicContact NH2-OE2 3.56Å; R109-E114 PolarHBondContact NH2-OE2 3.39Å; S110-E114 PolarHBondContact O-N 2.84Å; S110-E114 VanDerWaalsContact O-N 3.1Å; P111-E114 PolarHBondContact O-N 2.84Å; E114-C117 PolarHBondContact O-N 3.34Å; E114-S118 PolarHBondContact O-N 2.9Å; E114-S118 PolarHBondContact O-OG 3.13Å
115Y98.1Very high96.5Very high23 Ų2353.8 Ų53.89%0.0930%0.303CS..Hα-helixtrans-59-50173.3174.5-90.9000111.3Y71 L76 P111 T112 V113 C117 S118 H119Y71-Y115 HydrophobicContact CD1-CD1 4.09Å; Y71-Y115 AromaticContact CD1-CD2 3.79Å; Y71-Y115 HydrophobicContact CD1-CD2 3.79Å; Y71-Y115 HydrophobicContact CD1-CE2 4.24Å; Y71-Y115 AromaticContact CD1-CG 3.7Å; Y71-Y115 HydrophobicContact CD1-CG 3.7Å; Y71-Y115 HydrophobicContact CE1-CG 4.3Å; Y71-Y115 AromaticContact CG-CD2 3.94Å; Y71-Y115 HydrophobicContact CG-CD2 3.94Å; Y71-Y115 HydrophobicContact CG-CE2 4.39Å; Y71-Y115 HydrophobicContact CG-CG 4.27Å; L76-Y115 HydrophobicContact CD1-CD1 4.27Å; L76-Y115 HydrophobicContact CD1-CE1 4.16Å; P111-Y115 WeakPolarHBondContact O-CB 3.39Å; P111-Y115 PolarHBondContact O-N 2.99Å; T112-Y115 PolarHBondContact O-N 3.46Å; V113-Y115 VanDerWaalsContact C-N 3.34Å; V113-Y115 PolarHBondContact O-N 2.95Å; Y115-C117 VanDerWaalsContact C-N 3.29Å; Y115-C117 PolarHBondContact O-N 3.33Å; Y115-S118 CarbonylContact O-C 3.28Å; Y115-S118 PolarHBondContact O-N 3.39Å; Y115-S118 PolarHBondContact O-OG 3.5Å; Y115-H119 AromaticContact CD2-CE1 3.9Å; Y115-H119 AromaticContact CD2-ND1 3.7Å; Y115-H119 HydrophobicContact CE1-CB 4.05Å; Y115-H119 AromaticContact CE2-CE1 3.56Å; Y115-H119 AromaticContact CE2-CG 3.99Å; Y115-H119 AromaticContact CE2-ND1 3.55Å; Y115-H119 AromaticContact CE2-NE2 3.98Å; Y115-H119 AromaticContact CZ-CG 3.75Å; Y115-H119 AromaticContact CZ-ND1 3.78Å; Y115-H119 PolarHBondContact O-N 3.45Å; Y115-H119 PolarHBondContact O-ND1 3.21Å
116L98.1Very high96.8Very high0 Ų047.7 Ų47.70%027%0.274CS..Hα-helixtrans-67.2-27.7-179.8-68.5175.6000113.1F98 L102 T112 V113 S118 H119 Q120 V122 L152F98-L116 HydrophobicContact CZ-CD1 4.17Å; L102-L116 HydrophobicContact CD1-CD1 3.89Å; T112-L116 HydrophobicContact CG2-CD1 4.26Å; T112-L116 HydrophobicContact CG2-CG 4.42Å; T112-L116 WeakPolarHBondContact O-CB 3.4Å; T112-L116 VanDerWaalsContact O-CG 3.27Å; T112-L116 WeakPolarHBondContact O-CG 2.96Å; T112-L116 PolarHBondContact O-N 2.82Å; V113-L116 PolarHBondContact O-N 2.93Å; L116-S118 PolarHBondContact O-N 3.32Å; L116-H119 CarbonylContact O-C 3.37Å; L116-H119 VanDerWaalsContact O-C 3.28Å; L116-H119 PolarHBondContact O-N 2.82Å; L116-Q120 PolarHBondContact O-N 3.02Å; L116-V122 HydrophobicContact CD2-CB 3.73Å; L116-V122 HydrophobicContact CD2-CG1 3.71Å; L116-V122 HydrophobicContact CD2-CG2 3.97Å; L116-L152 HydrophobicContact CB-CD1 4.24Å; L116-L152 HydrophobicContact CB-CD2 3.62Å; L116-L152 HydrophobicContact CD1-CD1 3.79Å
117C97.9Very high97.1Very high43 Ų4343.2 Ų43.229%0.29125%0.251SS..Hα-helixtrans-63.9-30.4171.2-73.60000112.9V113 E114 Y115 Q120 I155V113-C117 PolarHBondContact O-N 3.34Å; V113-C117 PolarHBondContact O-SG 3.32Å; E114-C117 PolarHBondContact O-N 3.34Å; Y115-C117 VanDerWaalsContact C-N 3.29Å; Y115-C117 PolarHBondContact O-N 3.33Å; C117-Q120 WeakPolarHBondContact O-CG 3.19Å; C117-Q120 PolarHBondContact O-NE2 2.86Å; C117-I155 HydrophobicContact CB-CD1 4.41Å
118S96.6Very high97.4Very high82 Ų8246 Ų4657%0.57324%0.243SC*.Hα-helixtrans-92.8-9.6176.353.60000114E114 Y115 L116E114-S118 PolarHBondContact O-N 2.9Å; E114-S118 PolarHBondContact O-OG 3.13Å; Y115-S118 CarbonylContact O-C 3.28Å; Y115-S118 PolarHBondContact O-N 3.39Å; Y115-S118 PolarHBondContact O-OG 3.5Å; L116-S118 PolarHBondContact O-N 3.32Å
119H96.6Very high97.6Very high62 Ų6241.1 Ų41.129%0.28720%0.204SC..  trans-132.259.6-178.4-62.281.4000109.7Y115 L116 E121 V122Y115-H119 AromaticContact CD2-CE1 3.9Å; Y115-H119 AromaticContact CD2-ND1 3.7Å; Y115-H119 HydrophobicContact CE1-CB 4.05Å; Y115-H119 AromaticContact CE2-CE1 3.56Å; Y115-H119 AromaticContact CE2-CG 3.99Å; Y115-H119 AromaticContact CE2-ND1 3.55Å; Y115-H119 AromaticContact CE2-NE2 3.98Å; Y115-H119 AromaticContact CZ-CG 3.75Å; Y115-H119 AromaticContact CZ-ND1 3.78Å; Y115-H119 PolarHBondContact O-N 3.45Å; Y115-H119 PolarHBondContact O-ND1 3.21Å; L116-H119 CarbonylContact O-C 3.37Å; L116-H119 VanDerWaalsContact O-C 3.28Å; L116-H119 PolarHBondContact O-N 2.82Å; H119-E121 VanDerWaalsContact C-CD 3.49Å; H119-E121 WeakPolarHBondContact CA-OE2 3.19Å; H119-E121 WeakPolarHBondContact CB-OE1 3.3Å; H119-E121 IonicContact CD2-OE1 3.76Å; H119-E121 IonicContact CG-OE1 2.77Å; H119-E121 PolarHBondContact O-N 3.44Å; H119-V122 WeakPolarHBondContact O-CG2 3.46Å; H119-V122 PolarHBondContact O-N 3.26Å
120Q97.1Very high97.8Very high79 Ų7933.8 Ų33.837%0.36918%0.176SC..THydrogen-bonded Turntrans-65.3-23.7-170.6-57-173.60.600113L116 C117 V122 L123 F124 I155L116-Q120 PolarHBondContact O-N 3.02Å; C117-Q120 WeakPolarHBondContact O-CG 3.19Å; C117-Q120 PolarHBondContact O-NE2 2.86Å; Q120-V122 PolarHBondContact O-N 3.21Å; Q120-V122 VanDerWaalsContact O-N 3.12Å; Q120-L123 WeakPolarHBondContact O-CB 3.23Å; Q120-L123 PolarHBondContact O-N 3.42Å; Q120-F124 HydrophobicContact CB-CE2 3.89Å; Q120-F124 HydrophobicContact CB-CZ 4.2Å; Q120-F124 PolarHBondContact O-N 2.88Å; Q120-I155 HydrophobicContact CB-CG2 3.98Å; Q120-I155 HydrophobicContact CG-CD1 3.99Å; Q120-I155 HydrophobicContact CG-CG1 4.47Å; Q120-I155 HydrophobicContact CG-CG2 3.98Å
121E96.8Very high97.8Very high75 Ų7537.8 Ų37.835%0.3519%0.192SC..Hα-helixtrans-53.5-31.7176.966.9-77.9179.600112.4I77 H119 L123 F124 V125I77-E121 HydrophobicContact CD1-CB 4.44Å; I77-E121 HydrophobicContact CD1-CG 3.29Å; I77-E121 HydrophobicContact CG1-CG 4.34Å; H119-E121 VanDerWaalsContact C-CD 3.49Å; H119-E121 WeakPolarHBondContact CA-OE2 3.19Å; H119-E121 WeakPolarHBondContact CB-OE1 3.3Å; H119-E121 IonicContact CD2-OE1 3.76Å; H119-E121 IonicContact CG-OE1 2.77Å; H119-E121 PolarHBondContact O-N 3.44Å; E121-L123 VanDerWaalsContact C-N 3.28Å; E121-L123 PolarHBondContact O-N 3.22Å; E121-F124 PolarHBondContact O-N 3.14Å; E121-F124 VanDerWaalsContact O-N 3.12Å; E121-V125 WeakPolarHBondContact O-CG2 3.26Å; E121-V125 PolarHBondContact O-N 2.91Å
122V97.8Very high97.8Very high0 Ų038.5 Ų38.50%020%0.196CC..Hα-helixtrans-57.6-42.8175-179.90000111.3I77 F98 L116 H119 Q120 F124 L126I77-V122 HydrophobicContact CB-CG2 3.75Å; I77-V122 HydrophobicContact CG1-CG2 4.13Å; F98-V122 HydrophobicContact CE2-CG1 4Å; F98-V122 HydrophobicContact CZ-CG1 4.29Å; L116-V122 HydrophobicContact CD2-CB 3.73Å; L116-V122 HydrophobicContact CD2-CG1 3.71Å; L116-V122 HydrophobicContact CD2-CG2 3.97Å; H119-V122 WeakPolarHBondContact O-CG2 3.46Å; H119-V122 PolarHBondContact O-N 3.26Å; Q120-V122 PolarHBondContact O-N 3.21Å; Q120-V122 VanDerWaalsContact O-N 3.12Å; V122-F124 VanDerWaalsContact C-N 3.31Å; V122-F124 PolarHBondContact O-N 2.93Å; V122-L126 HydrophobicContact CG1-CD1 4.4Å; V122-L126 WeakPolarHBondContact O-CB 3.44Å; V122-L126 VanDerWaalsContact O-CG 3.32Å; V122-L126 WeakPolarHBondContact O-CG 3.33Å; V122-L126 PolarHBondContact O-N 3.42Å
123L98.5Very high97.6Very high0 Ų042.4 Ų42.40%022%0.222CC..Hα-helixtrans-66.4-36.8179.6-57.6173.4000111.2Q120 E121 L127 C146 L152 I155 V156Q120-L123 WeakPolarHBondContact O-CB 3.23Å; Q120-L123 PolarHBondContact O-N 3.42Å; E121-L123 VanDerWaalsContact C-N 3.28Å; E121-L123 PolarHBondContact O-N 3.22Å; L123-L127 WeakPolarHBondContact O-CB 3.37Å; L123-L127 PolarHBondContact O-N 2.66Å; L123-C146 HydrophobicContact CD2-CB 3.7Å; L123-L152 HydrophobicContact CD1-CB 4.23Å; L123-L152 HydrophobicContact CD1-CD2 4.24Å; L123-L152 HydrophobicContact CD2-CB 4.47Å; L123-I155 HydrophobicContact CD1-CB 4Å; L123-I155 HydrophobicContact CD1-CD1 4.32Å; L123-I155 HydrophobicContact CD1-CG2 3.75Å; L123-V156 HydrophobicContact CB-CG2 3.99Å; L123-V156 HydrophobicContact CD1-CG2 4.12Å; L123-V156 HydrophobicContact CG-CG2 4.48Å
124F98.2Very high97.5Very high44 Ų4446.9 Ų46.919%0.19324%0.242CC..Hα-helixtrans-76-35.7-179.5-52.5-40.1000112.3Q120 E121 V122 L127 K128 I155 H161Q120-F124 HydrophobicContact CB-CE2 3.89Å; Q120-F124 HydrophobicContact CB-CZ 4.2Å; Q120-F124 PolarHBondContact O-N 2.88Å; E121-F124 PolarHBondContact O-N 3.14Å; E121-F124 VanDerWaalsContact O-N 3.12Å; V122-F124 VanDerWaalsContact C-N 3.31Å; V122-F124 PolarHBondContact O-N 2.93Å; F124-L127 PolarHBondContact O-N 3.44Å; F124-K128 WeakPolarHBondContact O-CB 3.33Å; F124-K128 PolarHBondContact O-N 2.94Å; F124-I155 HydrophobicContact CE1-CG2 4.16Å; F124-I155 HydrophobicContact CZ-CG2 3.87Å; F124-H161 HydrophobicContact CD1-CB 4.36Å; F124-H161 AromaticContact CD1-CD2 3.4Å; F124-H161 VanDerWaalsContact CD1-CD2 3.4Å; F124-H161 WeakPolarHBondContact CD1-CD2 3.35Å; F124-H161 AromaticContact CE1-CD2 3.85Å; F124-H161 AromaticContact CG-CD2 3.53Å; F124-H161 AromaticContact CG-NE2 3.94Å
125V98.1Very high97.5Very high41 Ų4143.9 Ų43.925%0.24823%0.228CC..Hα-helixtrans-64.9-42.7171-179.20000110.3V80 E81 E121 L127 K128 G129V80-V125 HydrophobicContact CG1-CB 4.11Å; V80-V125 HydrophobicContact CG1-CG1 3.66Å; E81-V125 HydrophobicContact CB-CG1 4.49Å; E81-V125 HydrophobicContact CG-CG1 3.89Å; E81-V125 HydrophobicContact CG-CG2 4.02Å; E121-V125 WeakPolarHBondContact O-CG2 3.26Å; E121-V125 PolarHBondContact O-N 2.91Å; V125-L127 PolarHBondContact O-N 2.86Å; V125-K128 PolarHBondContact O-N 3.37Å; V125-G129 PolarHBondContact O-N 2.78Å
126L98.6Very high97.5Very high0 Ų042.8 Ų42.80%022%0.224CC..Hα-helixtrans-58-47.2173-75.7173.9000111.7V80 F98 V122 G129 C139 M142 L143V80-L126 HydrophobicContact CG1-CD2 3.58Å; V80-L126 HydrophobicContact CG1-CG 3.81Å; V80-L126 HydrophobicContact CG2-CD2 4.02Å; V80-L126 HydrophobicContact CG2-CG 4.45Å; F98-L126 HydrophobicContact CE1-CD1 4.45Å; F98-L126 HydrophobicContact CZ-CD1 4.01Å; V122-L126 HydrophobicContact CG1-CD1 4.4Å; V122-L126 WeakPolarHBondContact O-CB 3.44Å; V122-L126 VanDerWaalsContact O-CG 3.32Å; V122-L126 WeakPolarHBondContact O-CG 3.33Å; V122-L126 PolarHBondContact O-N 3.42Å; L126-G129 PolarHBondContact O-N 2.93Å; L126-C139 HydrophobicContact CD2-CB 4.37Å; L126-C139 VanDerWaalsContact O-CB 3.32Å; L126-C139 WeakPolarHBondContact O-CB 3.37Å; L126-M142 HydrophobicContact CD1-CB 4.12Å; L126-M142 HydrophobicContact CD2-CB 3.73Å; L126-M142 HydrophobicContact CD2-CE 3.59Å; L126-M142 HydrophobicContact CD2-SD 4.22Å; L126-L143 HydrophobicContact CB-CB 4.27Å; L126-L143 HydrophobicContact CB-CD1 4.38Å
127L98.4Very high97.5Very high1 Ų145.9 Ų45.91%0.00524%0.24CC..Hα-helixtrans-61.9-46.6178.3-178154.3000111.6L123 F124 V125 G129 Y130 L143 V156 H161 F165 Y168L123-L127 WeakPolarHBondContact O-CB 3.37Å; L123-L127 PolarHBondContact O-N 2.66Å; F124-L127 PolarHBondContact O-N 3.44Å; V125-L127 PolarHBondContact O-N 2.86Å; L127-G129 PolarHBondContact O-N 3.13Å; L127-Y130 WeakPolarHBondContact O-CD2 3.33Å; L127-Y130 PolarHBondContact O-N 3.12Å; L127-L143 HydrophobicContact CB-CD2 4.03Å; L127-V156 HydrophobicContact CD1-CG1 3.96Å; L127-H161 HydrophobicContact CD1-CB 4.03Å; L127-H161 HydrophobicContact CD2-CB 3.97Å; L127-F165 HydrophobicContact CD1-CD2 4.36Å; L127-F165 HydrophobicContact CD1-CE2 3.64Å; L127-F165 HydrophobicContact CD1-CZ 4.19Å; L127-F165 HydrophobicContact CG-CE2 4.24Å; L127-F165 HydrophobicContact CG-CZ 4.37Å; L127-Y168 HydrophobicContact CD2-CE2 3.71Å; L127-Y168 HydrophobicContact CG-CE2 4.3Å
128K98Very high97.6Very high129 Ų12945 Ų4556%0.56123%0.232SC*.Hα-helixtrans-64.1-22177.6-168.5174.9-179.4178.60112.6F124 V125 Y130 E131F124-K128 WeakPolarHBondContact O-CB 3.33Å; F124-K128 PolarHBondContact O-N 2.94Å; V125-K128 PolarHBondContact O-N 3.37Å; K128-Y130 PolarHBondContact O-N 2.98Å; K128-E131 VanDerWaalsContact CE-OE2 3.25Å; K128-E131 WeakPolarHBondContact CE-OE2 3.3Å; K128-E131 WeakPolarHBondContact CG-OE2 3.37Å; K128-E131 VanDerWaalsContact O-CB 3.31Å; K128-E131 WeakPolarHBondContact O-CB 3.27Å; K128-E131 PolarHBondContact O-N 3.42Å
129G97.8Very high97.7Very high3 Ų341.1 Ų41.13%0.03121%0.205CC..G310 helixtrans-54.2-24.2174.600000114.5V125 L126 L127 E131 T132 A136V125-G129 PolarHBondContact O-N 2.78Å; L126-G129 PolarHBondContact O-N 2.93Å; L127-G129 PolarHBondContact O-N 3.13Å; G129-E131 PolarHBondContact O-N 3.4Å; G129-T132 PolarHBondContact O-N 3.3Å; G129-A136 WeakPolarHBondContact O-CA 3.46Å
130Y98.3Very high97.8Very high0 Ų038.1 Ų38.10%019%0.192CC..G310 helixtrans-59.8-24.5172-80.7-68000113.7L127 K128 T132 A136 G140 L143 F165 Y168 I176 D179 A180 T183L127-Y130 WeakPolarHBondContact O-CD2 3.33Å; L127-Y130 PolarHBondContact O-N 3.12Å; K128-Y130 PolarHBondContact O-N 2.98Å; Y130-T132 PolarHBondContact O-N 3.4Å; Y130-A136 HydrophobicContact CD1-CB 4.25Å; Y130-G140 VanDerWaalsContact OH-CA 3.24Å; Y130-G140 WeakPolarHBondContact OH-CA 3.43Å; Y130-L143 HydrophobicContact CE2-CD2 4.42Å; Y130-F165 HydrophobicContact CD2-CE1 4.34Å; Y130-F165 AromaticContact CE2-CE1 3.89Å; Y130-F165 HydrophobicContact CE2-CE1 3.89Å; Y130-F165 HydrophobicContact CE2-CZ 4.39Å; Y130-Y168 HydrophobicContact CD2-CD2 4.01Å; Y130-Y168 HydrophobicContact CD2-CE2 4.31Å; Y130-Y168 HydrophobicContact CG-CD2 4.1Å; Y130-Y168 HydrophobicContact CG-CG 4.45Å; Y130-I176 HydrophobicContact CD1-CG2 3.93Å; Y130-D179 HydrophobicContact CE1-CB 4.36Å; Y130-D179 VanDerWaalsContact CE1-OD1 3.29Å; Y130-D179 WeakPolarHBondContact CE1-OD1 3.44Å; Y130-D179 PolarHBondContact OH-O 3.36Å; Y130-D179 PolarHBondContact OH-OD1 3.3Å; Y130-A180 HydrophobicContact CD1-CB 3.92Å; Y130-A180 HydrophobicContact CE1-CB 3.72Å; Y130-A180 HydrophobicContact CG-CB 4.43Å; Y130-T183 PolarHBondContact OH-OG1 2.69Å
131E97.3Very high97.8Very high102 Ų10237.8 Ų37.848%0.47719%0.192SC..G310 helixtrans-75.1-11.2176.3-62.9171.3-168.800112.9K128 G129 Y168K128-E131 VanDerWaalsContact CE-OE2 3.25Å; K128-E131 WeakPolarHBondContact CE-OE2 3.3Å; K128-E131 WeakPolarHBondContact CG-OE2 3.37Å; K128-E131 VanDerWaalsContact O-CB 3.31Å; K128-E131 WeakPolarHBondContact O-CB 3.27Å; K128-E131 PolarHBondContact O-N 3.42Å; G129-E131 PolarHBondContact O-N 3.4Å; E131-Y168 HydrophobicContact CG-CE1 3.64Å; E131-Y168 PolarHBondContact OE1-OH 3.44Å
132T96.8Very high97.9Very high37 Ų3734.2 Ų34.223%0.22718%0.175CC..SBendtrans-115.899.4-176.5-55.10000110.3G129 Y130 Q134 I135 A136G129-T132 PolarHBondContact O-N 3.3Å; Y130-T132 PolarHBondContact O-N 3.4Å; T132-Q134 VanDerWaalsContact C-N 3.27Å; T132-Q134 VanDerWaalsContact CG2-CD 3.44Å; T132-Q134 HydrophobicContact CG2-CG 3.88Å; T132-Q134 VanDerWaalsContact CG2-NE2 3.25Å; T132-Q134 PolarHBondContact O-N 3.04Å; T132-Q134 VanDerWaalsContact O-N 3.08Å; T132-I135 HydrophobicContact CG2-CD1 4.09Å; T132-I135 HydrophobicContact CG2-CG1 3.73Å; T132-I135 WeakPolarHBondContact O-CG1 3.37Å; T132-I135 PolarHBondContact O-N 3.15Å; T132-A136 PolarHBondContact O-N 3.1Å
133P95.5Very high98Very high82 Ų8234.2 Ų34.253%0.53218%0.175SC..THydrogen-bonded Turntrans-52.9-38.1-171-30.436000115.1I135 I176P133-I135 PolarHBondContact O-N 2.83Å; P133-I176 HydrophobicContact CB-CD1 3.94Å; P133-I176 HydrophobicContact CG-CD1 4.41Å
134Q95.8Very high98Very high107 Ų10736.9 Ų36.950%0.519%0.185SC..THydrogen-bonded Turntrans-66.9-14.5-178.666.7-109.815.100115.5Q84 T132Q84-Q134 HydrophobicContact CB-CG 4.28Å; T132-Q134 VanDerWaalsContact C-N 3.27Å; T132-Q134 VanDerWaalsContact CG2-CD 3.44Å; T132-Q134 HydrophobicContact CG2-CG 3.88Å; T132-Q134 VanDerWaalsContact CG2-NE2 3.25Å; T132-Q134 PolarHBondContact O-N 3.04Å; T132-Q134 VanDerWaalsContact O-N 3.08Å
135I97.9Very high98Very high11 Ų1136.2 Ų36.26%0.05618%0.182CC..THydrogen-bonded Turntrans-128.6-9.1-178.160169.6000113.7L83 Q84 K91 T132 P133 L137 N138 C139L83-I135 HydrophobicContact CB-CD1 4.46Å; L83-I135 HydrophobicContact CB-CG2 4.09Å; L83-I135 HydrophobicContact CD2-CB 4.01Å; L83-I135 HydrophobicContact CD2-CG2 4.06Å; L83-I135 HydrophobicContact CG-CB 4.3Å; L83-I135 HydrophobicContact CG-CG2 3.78Å; Q84-I135 HydrophobicContact CB-CG2 4.26Å; K91-I135 HydrophobicContact CD-CG2 4.06Å; K91-I135 VanDerWaalsContact CE-CG2 3.46Å; T132-I135 HydrophobicContact CG2-CD1 4.09Å; T132-I135 HydrophobicContact CG2-CG1 3.73Å; T132-I135 WeakPolarHBondContact O-CG1 3.37Å; T132-I135 PolarHBondContact O-N 3.15Å; P133-I135 PolarHBondContact O-N 2.83Å; I135-L137 VanDerWaalsContact C-N 3.3Å; I135-L137 PolarHBondContact O-N 3.45Å; I135-N138 WeakPolarHBondContact O-CB 3.37Å; I135-N138 PolarHBondContact O-N 3.17Å; I135-C139 PolarHBondContact O-N 2.93Å
136A98.1Very high98Very high0 Ų034.2 Ų34.20%017%0.171CC..Hα-helixtrans-50.1-46.8-173.300000113.3G129 Y130 T132 C139 G140 I176G129-A136 WeakPolarHBondContact O-CA 3.46Å; Y130-A136 HydrophobicContact CD1-CB 4.25Å; T132-A136 PolarHBondContact O-N 3.1Å; A136-C139 PolarHBondContact O-N 2.97Å; A136-G140 PolarHBondContact O-N 3.27Å; A136-I176 HydrophobicContact CB-CD1 3.95Å; A136-I176 HydrophobicContact CB-CG1 4.03Å; A136-I176 HydrophobicContact CB-CG2 3.93Å
137L98.3Very high98Very high65 Ų6534.3 Ų34.334%0.3417%0.171SC..Hα-helixtrans-68.9-36.2-180-57.7-177.4000112.7I135 G140 I141 D179I135-L137 VanDerWaalsContact C-N 3.3Å; I135-L137 PolarHBondContact O-N 3.45Å; L137-G140 PolarHBondContact O-N 3.49Å; L137-I141 WeakPolarHBondContact O-CD1 3.39Å; L137-I141 VanDerWaalsContact O-CG1 3.27Å; L137-I141 WeakPolarHBondContact O-CG1 3.41Å; L137-I141 PolarHBondContact O-N 3.02Å; L137-D179 HydrophobicContact CD2-CB 3.62Å
138N98.7Very high98Very high24 Ų2439.8 Ų39.813%0.12819%0.191CC..Hα-helixtrans-64.7-44.9174.9-68.592.5000111L83 K91 C95 I135 I141 M142L83-N138 HydrophobicContact CD2-CB 3.9Å; K91-N138 PolarHBondContact O-ND2 3.45Å; C95-N138 VanDerWaalsContact SG-CB 3.57Å; C95-N138 PolarHBondContact SG-ND2 3.13Å; I135-N138 WeakPolarHBondContact O-CB 3.37Å; I135-N138 PolarHBondContact O-N 3.17Å; N138-I141 PolarHBondContact O-N 3.19Å; N138-M142 PolarHBondContact O-N 2.84Å; N138-M142 VanDerWaalsContact O-N 3.14Å
139C98.6Very high98.1Very high1 Ų135.9 Ų35.91%0.00717%0.174CC..Hα-helixtrans-61.5-44.3175-71.70000111.7L126 I135 A136 I141 M142 L143L126-C139 HydrophobicContact CD2-CB 4.37Å; L126-C139 VanDerWaalsContact O-CB 3.32Å; L126-C139 WeakPolarHBondContact O-CB 3.37Å; I135-C139 PolarHBondContact O-N 2.93Å; A136-C139 PolarHBondContact O-N 2.97Å; C139-I141 PolarHBondContact O-N 3.41Å; C139-M142 PolarHBondContact O-N 3.17Å; C139-L143 VanDerWaalsContact O-CB 3.25Å; C139-L143 WeakPolarHBondContact O-CB 3.38Å; C139-L143 PolarHBondContact O-N 3.45Å
140G98.5Very high98.1Very high0 Ų040 Ų400%019%0.192CC..Hα-helixtrans-58.9-42.717500000113.3Y130 A136 L137 R144Y130-G140 VanDerWaalsContact OH-CA 3.24Å; Y130-G140 WeakPolarHBondContact OH-CA 3.43Å; A136-G140 PolarHBondContact O-N 3.27Å; L137-G140 PolarHBondContact O-N 3.49Å; G140-R144 WeakPolarHBondContact O-CB 3.18Å; G140-R144 WeakPolarHBondContact O-CG 3.2Å; G140-R144 PolarHBondContact O-N 2.96Å; G140-R144 PolarHBondContact O-NH1 3.45Å
141I98.6Very high98.1Very high72 Ų7243 Ų4337%0.36921%0.212SC..Hα-helixtrans-59.6-50175.3-71.5163000111.4C95 L137 N138 C139 E145C95-I141 HydrophobicContact CB-CG2 4.43Å; L137-I141 WeakPolarHBondContact O-CD1 3.39Å; L137-I141 VanDerWaalsContact O-CG1 3.27Å; L137-I141 WeakPolarHBondContact O-CG1 3.41Å; L137-I141 PolarHBondContact O-N 3.02Å; N138-I141 PolarHBondContact O-N 3.19Å; C139-I141 PolarHBondContact O-N 3.41Å; I141-E145 PolarHBondContact O-N 3.39Å
142M98.8Very high98.2Very high0 Ų038.1 Ų38.10%019%0.189CC..Hα-helixtrans-68.4-40.7-179.1-70.6-174.6-75.300112V80 L83 V94 C95 F98 L126 N138 C139 E145 C146V80-M142 HydrophobicContact CG2-CE 4.4Å; V80-M142 HydrophobicContact CG2-SD 4.46Å; L83-M142 HydrophobicContact CD2-CE 3.79Å; V94-M142 HydrophobicContact CG1-SD 4.26Å; C95-M142 HydrophobicContact CB-CG 4.16Å; F98-M142 HydrophobicContact CB-CG 4.23Å; F98-M142 HydrophobicContact CB-SD 3.7Å; F98-M142 HydrophobicContact CD1-CB 3.92Å; F98-M142 HydrophobicContact CD1-CG 3.87Å; F98-M142 HydrophobicContact CD1-SD 4.04Å; F98-M142 HydrophobicContact CD2-SD 4.11Å; F98-M142 HydrophobicContact CE1-CB 4.09Å; F98-M142 HydrophobicContact CG-CG 4.11Å; F98-M142 HydrophobicContact CG-SD 3.68Å; L126-M142 HydrophobicContact CD1-CB 4.12Å; L126-M142 HydrophobicContact CD2-CB 3.73Å; L126-M142 HydrophobicContact CD2-CE 3.59Å; L126-M142 HydrophobicContact CD2-SD 4.22Å; N138-M142 PolarHBondContact O-N 2.84Å; N138-M142 VanDerWaalsContact O-N 3.14Å; C139-M142 PolarHBondContact O-N 3.17Å; M142-E145 PolarHBondContact O-N 2.64Å; M142-C146 PolarHBondContact O-N 3.1Å; M142-C146 PolarHBondContact O-SG 3.29Å
143L98.8Very high98.3Very high0 Ų036.6 Ų36.60%018%0.18CC..Hα-helixtrans-64.8-42.5178.1-174.657000111.3L126 L127 Y130 C139 E145 C146 I147 V156 F165 T183L126-L143 HydrophobicContact CB-CB 4.27Å; L126-L143 HydrophobicContact CB-CD1 4.38Å; L127-L143 HydrophobicContact CB-CD2 4.03Å; Y130-L143 HydrophobicContact CE2-CD2 4.42Å; C139-L143 VanDerWaalsContact O-CB 3.25Å; C139-L143 WeakPolarHBondContact O-CB 3.38Å; C139-L143 PolarHBondContact O-N 3.45Å; L143-E145 VanDerWaalsContact C-N 3.27Å; L143-E145 PolarHBondContact O-N 3.36Å; L143-C146 WeakPolarHBondContact O-CB 3.29Å; L143-C146 PolarHBondContact O-N 2.87Å; L143-C146 VanDerWaalsContact O-N 3.1Å; L143-I147 HydrophobicContact CD1-CG2 4.32Å; L143-I147 WeakPolarHBondContact O-CG2 3.47Å; L143-I147 PolarHBondContact O-N 3.47Å; L143-V156 HydrophobicContact CD1-CG2 4.16Å; L143-F165 HydrophobicContact CD2-CZ 4.11Å; L143-T183 HydrophobicContact CD2-CG2 3.93Å; L143-T183 HydrophobicContact CG-CG2 4.08Å
144R98.8Very high98.5Very high56 Ų5636.7 Ų36.721%0.21117%0.17CC..Hα-helixtrans-62.3-33.5175.3-77.9-166.8-61.4-83.22.9113G140 I147 R148 D179 T183G140-R144 WeakPolarHBondContact O-CB 3.18Å; G140-R144 WeakPolarHBondContact O-CG 3.2Å; G140-R144 PolarHBondContact O-N 2.96Å; G140-R144 PolarHBondContact O-NH1 3.45Å; R144-I147 HydrophobicContact CG-CD1 4.33Å; R144-I147 VanDerWaalsContact O-CG1 3.3Å; R144-I147 WeakPolarHBondContact O-CG1 3.26Å; R144-R148 WeakPolarHBondContact O-CG 3.39Å; R144-D179 IonicContact CZ-OD1 2.72Å; R144-D179 IonicContact CZ-OD2 3.85Å; R144-D179 VanDerWaalsContact CZ-OD2 3.27Å; R144-D179 PolarHBondContact NH1-O 2.92Å; R144-D179 IonicContact NH1-OD1 3.79Å; R144-D179 PolarHBondContact NH1-OD1 3.03Å; R144-D179 IonicContact NH1-OD2 2.64Å; R144-D179 PolarHBondContact NH1-OD2 3.4Å; R144-D179 IonicContact NH2-OD1 2.95Å; R144-D179 IonicContact NH2-OD2 3.58Å; R144-D179 PolarHBondContact NH2-OD2 3.05Å; R144-T183 HydrophobicContact CG-CG2 4.02Å; R144-T183 VanDerWaalsContact CG-OG1 3.25Å; R144-T183 WeakPolarHBondContact CG-OG1 3.49Å; R144-T183 PolarHBondContact NH1-OG1 3.21Å
145E98.6Very high98.6Very high29 Ų2932.9 Ų32.914%0.13615%0.152CC..Hα-helixtrans-69.8-38.9172-75-66.9138.400112.2N99 L102 R103 I141 M142 L143 R148N99-E145 HydrophobicContact CB-CG 4.3Å; N99-E145 WeakPolarHBondContact OD1-CB 3.19Å; L102-E145 HydrophobicContact CD2-CB 3.95Å; R103-E145 IonicContact CZ-OE1 2.97Å; R103-E145 IonicContact CZ-OE2 3.6Å; R103-E145 IonicContact NE-OE2 3.27Å; R103-E145 PolarHBondContact NE-OE2 3.29Å; R103-E145 IonicContact NH2-OE1 2.71Å; R103-E145 PolarHBondContact NH2-OE1 3.41Å; R103-E145 IonicContact NH2-OE2 3.87Å; R103-E145 PolarHBondContact NH2-OE2 3.33Å; I141-E145 PolarHBondContact O-N 3.39Å; M142-E145 PolarHBondContact O-N 2.64Å; L143-E145 VanDerWaalsContact C-N 3.27Å; L143-E145 PolarHBondContact O-N 3.36Å; E145-R148 WeakPolarHBondContact O-CB 3.42Å; E145-R148 PolarHBondContact O-N 3.16Å; E145-R148 IonicContact OE1-NH1 3.45Å; E145-R148 PolarHBondContact OE1-NH1 3.14Å; E145-R148 IonicContact OE2-CZ 2.83Å; E145-R148 IonicContact OE2-NH1 3.86Å; E145-R148 PolarHBondContact OE2-NH1 3.47Å; E145-R148 VanDerWaalsContact OE2-NH1 3.07Å
146C98.8Very high98.6Very high0 Ų032.3 Ų32.30%015%0.15CC..Hα-helixtrans-58.4-49.8174.7-65.10000111.8F98 L102 L123 M142 L143 R148 Y149 L152F98-C146 VanDerWaalsContact CE1-SG 3.5Å; L102-C146 HydrophobicContact CD2-CB 4.45Å; L123-C146 HydrophobicContact CD2-CB 3.7Å; M142-C146 PolarHBondContact O-N 3.1Å; M142-C146 PolarHBondContact O-SG 3.29Å; L143-C146 WeakPolarHBondContact O-CB 3.29Å; L143-C146 PolarHBondContact O-N 2.87Å; L143-C146 VanDerWaalsContact O-N 3.1Å; C146-R148 PolarHBondContact O-N 2.94Å; C146-Y149 WeakPolarHBondContact O-CD2 3.33Å; C146-Y149 PolarHBondContact O-N 3.36Å; C146-L152 HydrophobicContact CB-CB 4.44Å; C146-L152 HydrophobicContact CB-CD1 4.01Å
147I98.6Very high98.6Very high1 Ų132.5 Ų32.51%0.00515%0.151CC..THydrogen-bonded Turntrans-70.9-3.9-175.167.8178.4000113.2L143 R144 Y149 A153 V156 T183 D186 L187 R190 H191L143-I147 HydrophobicContact CD1-CG2 4.32Å; L143-I147 WeakPolarHBondContact O-CG2 3.47Å; L143-I147 PolarHBondContact O-N 3.47Å; R144-I147 HydrophobicContact CG-CD1 4.33Å; R144-I147 VanDerWaalsContact O-CG1 3.3Å; R144-I147 WeakPolarHBondContact O-CG1 3.26Å; I147-Y149 PolarHBondContact O-N 3.09Å; I147-A153 HydrophobicContact CB-CB 4.02Å; I147-A153 HydrophobicContact CG2-CB 4.45Å; I147-V156 HydrophobicContact CG2-CG2 4.48Å; I147-T183 HydrophobicContact CD1-CG2 4.07Å; I147-D186 HydrophobicContact CD1-CB 3.75Å; I147-D186 WeakPolarHBondContact CD1-OD2 3.15Å; I147-L187 HydrophobicContact CB-CD2 4.11Å; I147-L187 HydrophobicContact CD1-CD2 4.38Å; I147-L187 HydrophobicContact CD1-CG 3.94Å; I147-L187 HydrophobicContact CG2-CD2 3.64Å; I147-L187 HydrophobicContact CG2-CG 4.21Å; I147-R190 VanDerWaalsContact O-CD 3.32Å; I147-R190 WeakPolarHBondContact O-CD 3.5Å; I147-H191 PolarHBondContact O-NE2 3.24Å
148R98.6Very high98.6Very high116 Ų11633.5 Ų33.544%0.43815%0.15SC..THydrogen-bonded Turntrans-63.1-25166.7-64.9177.467176.60.3112.2R144 E145 C146 H191R144-R148 WeakPolarHBondContact O-CG 3.39Å; E145-R148 WeakPolarHBondContact O-CB 3.42Å; E145-R148 PolarHBondContact O-N 3.16Å; E145-R148 IonicContact OE1-NH1 3.45Å; E145-R148 PolarHBondContact OE1-NH1 3.14Å; E145-R148 IonicContact OE2-CZ 2.83Å; E145-R148 IonicContact OE2-NH1 3.86Å; E145-R148 PolarHBondContact OE2-NH1 3.47Å; E145-R148 VanDerWaalsContact OE2-NH1 3.07Å; C146-R148 PolarHBondContact O-N 2.94Å; R148-H191 PolarHBondContact O-CE1 3.1Å; R148-H191 VanDerWaalsContact O-CE1 3.26Å
149Y98.6Very high98.6Very high48 Ų4833.2 Ų33.219%0.18815%0.15CC..SBendtrans-95.8122.7177.3-58.9-88.2000109.7L102 R103 V113 C146 I147 P151 L152 A153L102-Y149 HydrophobicContact CD1-CD2 4.19Å; L102-Y149 HydrophobicContact CD1-CE2 4Å; L102-Y149 HydrophobicContact CD2-CD2 4.44Å; L102-Y149 HydrophobicContact CD2-CE2 4.09Å; L102-Y149 HydrophobicContact CG-CD2 4.31Å; L102-Y149 HydrophobicContact CG-CE2 3.74Å; L102-Y149 PolarHBondContact O-OH 3.26Å; R103-Y149 WeakPolarHBondContact CA-OH 3.37Å; V113-Y149 HydrophobicContact CG1-CG 4.47Å; V113-Y149 HydrophobicContact CG2-CD1 3.47Å; V113-Y149 VanDerWaalsContact CG2-CD1 3.47Å; V113-Y149 HydrophobicContact CG2-CD2 3.93Å; V113-Y149 HydrophobicContact CG2-CE1 3.77Å; V113-Y149 HydrophobicContact CG2-CE2 4.23Å; V113-Y149 HydrophobicContact CG2-CG 3.54Å; C146-Y149 WeakPolarHBondContact O-CD2 3.33Å; C146-Y149 PolarHBondContact O-N 3.36Å; I147-Y149 PolarHBondContact O-N 3.09Å; Y149-P151 VanDerWaalsContact C-CD 3.45Å; Y149-P151 VanDerWaalsContact C-N 3.35Å; Y149-L152 PolarHBondContact O-N 2.81Å; Y149-L152 VanDerWaalsContact O-N 3.16Å; Y149-A153 PolarHBondContact O-N 3.36Å
150E98.6Very high98.4Very high88 Ų8841.5 Ų41.541%0.41119%0.189SC..Hα-helixtrans-51.9-44.7-177.2-171.4-167.4137.400113.4L152 A153 R154 H191 V194E150-L152 VanDerWaalsContact C-N 3.33Å; E150-L152 PolarHBondContact O-N 3.02Å; E150-A153 PolarHBondContact O-N 3.24Å; E150-R154 WeakPolarHBondContact O-CB 3.4Å; E150-R154 PolarHBondContact O-N 3.13Å; E150-R154 IonicContact OE1-CZ 3.07Å; E150-R154 IonicContact OE1-NE 2.88Å; E150-R154 IonicContact OE1-NH2 3.52Å; E150-R154 PolarHBondContact OE1-NH2 3.38Å; E150-R154 VanDerWaalsContact OE1-NH2 3.08Å; E150-H191 HydrophobicContact CG-CB 4.24Å; E150-H191 PolarHBondContact N-CE1 3.42Å; E150-H191 PolarHBondContact N-NE2 2.85Å; E150-V194 HydrophobicContact CG-CG2 3.51Å; E150-V194 WeakPolarHBondContact OE1-CG2 3.38Å
151P98.6Very high98.3Very high64 Ų6445.5 Ų45.542%0.41621%0.207SC..Hα-helixtrans-59.4-40.9-179.4-25.636.2000113.4V113 Y149 R154 I155V113-P151 HydrophobicContact CG1-CG 4.46Å; Y149-P151 VanDerWaalsContact C-CD 3.45Å; Y149-P151 VanDerWaalsContact C-N 3.35Å; P151-R154 PolarHBondContact O-N 3.02Å; P151-I155 WeakPolarHBondContact O-CD1 3.47Å; P151-I155 WeakPolarHBondContact O-CG1 3.39Å; P151-I155 PolarHBondContact O-N 3.31Å; P151-I155 VanDerWaalsContact O-N 3.14Å
152L98.8Very high98.3Very high0 Ų042.1 Ų42.10%019%0.19CC..Hα-helixtrans-74.9-40.2-179.5-53.6-177.1000111.3L102 V113 L116 L123 C146 Y149 E150 R154 I155 V156L102-L152 HydrophobicContact CD1-CD1 4.1Å; V113-L152 HydrophobicContact CG1-CD1 4.33Å; V113-L152 HydrophobicContact CG1-CD2 4.29Å; V113-L152 HydrophobicContact CG1-CG 4.09Å; V113-L152 HydrophobicContact CG2-CD1 4.41Å; L116-L152 HydrophobicContact CB-CD1 4.24Å; L116-L152 HydrophobicContact CB-CD2 3.62Å; L116-L152 HydrophobicContact CD1-CD1 3.79Å; L123-L152 HydrophobicContact CD1-CB 4.23Å; L123-L152 HydrophobicContact CD1-CD2 4.24Å; L123-L152 HydrophobicContact CD2-CB 4.47Å; C146-L152 HydrophobicContact CB-CB 4.44Å; C146-L152 HydrophobicContact CB-CD1 4.01Å; Y149-L152 PolarHBondContact O-N 2.81Å; Y149-L152 VanDerWaalsContact O-N 3.16Å; E150-L152 VanDerWaalsContact C-N 3.33Å; E150-L152 PolarHBondContact O-N 3.02Å; L152-R154 VanDerWaalsContact C-N 3.28Å; L152-R154 PolarHBondContact O-N 3.44Å; L152-I155 HydrophobicContact CD2-CD1 4.3Å; L152-I155 PolarHBondContact O-N 3.04Å; L152-V156 WeakPolarHBondContact O-CG2 3.33Å; L152-V156 PolarHBondContact O-N 3.05Å; L152-V156 VanDerWaalsContact O-N 3.09Å
153A98.8Very high98.2Very high5 Ų545.1 Ų45.14%0.04120%0.204CC..Hα-helixtrans-59.5-41.2172.800000111.5I147 Y149 E150 V156 L157 L187 H191I147-A153 HydrophobicContact CB-CB 4.02Å; I147-A153 HydrophobicContact CG2-CB 4.45Å; Y149-A153 PolarHBondContact O-N 3.36Å; E150-A153 PolarHBondContact O-N 3.24Å; A153-V156 PolarHBondContact O-N 3.34Å; A153-L157 WeakPolarHBondContact O-CB 3.31Å; A153-L157 PolarHBondContact O-N 3.2Å; A153-L187 HydrophobicContact CB-CD2 4.37Å; A153-H191 WeakPolarHBondContact CB-CD2 3.5Å
154R98.7Very high98.2Very high84 Ų8446.7 Ų46.732%0.31722%0.215SC..Hα-helixtrans-61.6-43.7176.4-171.9-178.8-69.5-103.76.3111.4E150 P151 L152 V156 L157 Y158 V194 E197E150-R154 WeakPolarHBondContact O-CB 3.4Å; E150-R154 PolarHBondContact O-N 3.13Å; E150-R154 IonicContact OE1-CZ 3.07Å; E150-R154 IonicContact OE1-NE 2.88Å; E150-R154 IonicContact OE1-NH2 3.52Å; E150-R154 PolarHBondContact OE1-NH2 3.38Å; E150-R154 VanDerWaalsContact OE1-NH2 3.08Å; P151-R154 PolarHBondContact O-N 3.02Å; L152-R154 VanDerWaalsContact C-N 3.28Å; L152-R154 PolarHBondContact O-N 3.44Å; R154-V156 PolarHBondContact O-N 3.38Å; R154-L157 PolarHBondContact O-N 3.21Å; R154-Y158 HydrophobicContact CG-CD2 3.77Å; R154-Y158 HydrophobicContact CG-CE2 3.96Å; R154-Y158 WeakPolarHBondContact O-CB 3.35Å; R154-Y158 WeakPolarHBondContact O-CD2 3.32Å; R154-Y158 PolarHBondContact O-N 3Å; R154-V194 HydrophobicContact CB-CG1 4.19Å; R154-V194 HydrophobicContact CG-CG1 4.1Å; R154-V194 VanDerWaalsContact NH2-CG2 3.31Å; R154-E197 IonicContact CZ-OE2 2.73Å; R154-E197 IonicContact NH1-OE2 3.07Å; R154-E197 PolarHBondContact NH1-OE2 3.04Å
155I98.8Very high98.2Very high26 Ų2644 Ų4413%0.13321%0.205CC..Hα-helixtrans-58.7-48.9176.4-69.7158.9000110.9C117 Q120 L123 F124 P151 L152 S159C117-I155 HydrophobicContact CB-CD1 4.41Å; Q120-I155 HydrophobicContact CB-CG2 3.98Å; Q120-I155 HydrophobicContact CG-CD1 3.99Å; Q120-I155 HydrophobicContact CG-CG1 4.47Å; Q120-I155 HydrophobicContact CG-CG2 3.98Å; L123-I155 HydrophobicContact CD1-CB 4Å; L123-I155 HydrophobicContact CD1-CD1 4.32Å; L123-I155 HydrophobicContact CD1-CG2 3.75Å; F124-I155 HydrophobicContact CE1-CG2 4.16Å; F124-I155 HydrophobicContact CZ-CG2 3.87Å; P151-I155 WeakPolarHBondContact O-CD1 3.47Å; P151-I155 WeakPolarHBondContact O-CG1 3.39Å; P151-I155 PolarHBondContact O-N 3.31Å; P151-I155 VanDerWaalsContact O-N 3.14Å; L152-I155 HydrophobicContact CD2-CD1 4.3Å; L152-I155 PolarHBondContact O-N 3.04Å; I155-S159 WeakPolarHBondContact O-CB 3.5Å; I155-S159 PolarHBondContact O-N 3.33Å
156V98.6Very high98.1Very high0 Ų043.5 Ų43.50%020%0.202CC..Hα-helixtrans-65-48.6179.81780000110.9L123 L127 L143 I147 L152 A153 R154 Y158 S159 L187L123-V156 HydrophobicContact CB-CG2 3.99Å; L123-V156 HydrophobicContact CD1-CG2 4.12Å; L123-V156 HydrophobicContact CG-CG2 4.48Å; L127-V156 HydrophobicContact CD1-CG1 3.96Å; L143-V156 HydrophobicContact CD1-CG2 4.16Å; I147-V156 HydrophobicContact CG2-CG2 4.48Å; L152-V156 WeakPolarHBondContact O-CG2 3.33Å; L152-V156 PolarHBondContact O-N 3.05Å; L152-V156 VanDerWaalsContact O-N 3.09Å; A153-V156 PolarHBondContact O-N 3.34Å; R154-V156 PolarHBondContact O-N 3.38Å; V156-Y158 PolarHBondContact O-N 3.18Å; V156-S159 PolarHBondContact O-N 3.13Å; V156-S159 PolarHBondContact O-OG 2.97Å; V156-L187 HydrophobicContact CB-CD2 4.12Å; V156-L187 HydrophobicContact CG1-CD1 3.8Å; V156-L187 HydrophobicContact CG1-CD2 4.05Å
157L98.1Very high98.1Very high4 Ų447.5 Ų47.52%0.02123%0.23CC..Hα-helixtrans-62.7-39.4-174.7-173.164.3000112.7A153 R154 S159 F162 L188 V194 V195 F198A153-L157 WeakPolarHBondContact O-CB 3.31Å; A153-L157 PolarHBondContact O-N 3.2Å; R154-L157 PolarHBondContact O-N 3.21Å; L157-S159 VanDerWaalsContact C-N 3.34Å; L157-F162 HydrophobicContact CD1-CD2 3.86Å; L157-F162 HydrophobicContact CD1-CE1 4.44Å; L157-F162 HydrophobicContact CD1-CE2 3.59Å; L157-F162 HydrophobicContact CD1-CG 4.39Å; L157-F162 HydrophobicContact CD1-CZ 3.9Å; L157-L188 HydrophobicContact CD1-CD2 4.24Å; L157-V194 HydrophobicContact CD2-CG1 4.33Å; L157-V195 HydrophobicContact CD2-CG2 4.35Å; L157-F198 HydrophobicContact CD1-CD1 3.66Å; L157-F198 HydrophobicContact CD1-CE1 3.62Å; L157-F198 HydrophobicContact CD1-CE2 4.49Å; L157-F198 HydrophobicContact CD1-CG 4.13Å; L157-F198 HydrophobicContact CD1-CZ 4.06Å; L157-F198 HydrophobicContact CD2-CB 3.71Å; L157-F198 HydrophobicContact CD2-CD1 3.9Å; L157-F198 HydrophobicContact CD2-CD2 4.35Å; L157-F198 HydrophobicContact CD2-CG 3.72Å; L157-F198 HydrophobicContact CG-CB 4.16Å; L157-F198 HydrophobicContact CG-CD1 3.71Å; L157-F198 HydrophobicContact CG-CD2 3.86Å; L157-F198 HydrophobicContact CG-CE1 4.01Å; L157-F198 HydrophobicContact CG-CE2 4.16Å; L157-F198 HydrophobicContact CG-CG 3.62Å; L157-F198 HydrophobicContact CG-CZ 4.23Å; L157-F198 WeakPolarHBondContact O-CE2 3.37Å; L157-F198 WeakPolarHBondContact O-CZ 3.48Å
158Y98.2Very high98Very high85 Ų8548 Ų4833%0.33323%0.232SC..THydrogen-bonded Turntrans-87.91179.8-77.5-100.4000113.8R154 V156 V194 E197 F198R154-Y158 HydrophobicContact CG-CD2 3.77Å; R154-Y158 HydrophobicContact CG-CE2 3.96Å; R154-Y158 WeakPolarHBondContact O-CB 3.35Å; R154-Y158 WeakPolarHBondContact O-CD2 3.32Å; R154-Y158 PolarHBondContact O-N 3Å; V156-Y158 PolarHBondContact O-N 3.18Å; Y158-V194 HydrophobicContact CE2-CG1 4.01Å; Y158-E197 WeakPolarHBondContact OH-CG 3.49Å; Y158-F198 HydrophobicContact CD1-CD2 4.21Å; Y158-F198 HydrophobicContact CD2-CD2 4.18Å; Y158-F198 HydrophobicContact CE1-CD2 4.15Å; Y158-F198 HydrophobicContact CE2-CB 3.89Å; Y158-F198 HydrophobicContact CE2-CD2 4.13Å; Y158-F198 HydrophobicContact CE2-CG 4.43Å; Y158-F198 HydrophobicContact CG-CD2 4.24Å; Y158-F198 WeakPolarHBondContact OH-CA 3.39Å; Y158-F198 PolarHBondContact OH-N 3.16Å
159S97.7Very high98Very high18 Ų1842.5 Ų42.513%0.12621%0.211CC..SBendtrans-83.4153.6176.473.60000112.1I155 V156 L157 H161 F162I155-S159 WeakPolarHBondContact O-CB 3.5Å; I155-S159 PolarHBondContact O-N 3.33Å; V156-S159 PolarHBondContact O-N 3.13Å; V156-S159 PolarHBondContact O-OG 2.97Å; L157-S159 VanDerWaalsContact C-N 3.34Å; S159-H161 PolarHBondContact O-N 3.5Å; S159-H161 PolarHBondContact OG-N 2.93Å; S159-F162 WeakPolarHBondContact O-CB 3.28Å; S159-F162 PolarHBondContact O-N 3.46Å; S159-F162 VanDerWaalsContact O-N 3.12Å; S159-F162 PolarHBondContact OG-N 3.26Å
160E95.6Very high97.8Very high176 Ų17643.3 Ų43.382%0.82222%0.217SC*.G310 helixtrans-60.2-27.8171.5-61.9-173.3158.200112F162 H163E160-F162 PolarHBondContact O-N 3.22Å; E160-H163 PolarHBondContact O-N 3.47Å
161H96.5Very high97.6Very high84 Ų8441.2 Ų41.239%0.38921%0.208SC..G310 helixtrans-64.9-21.2177.9-58.1-61.7000113.6F124 L127 S159 H163 S164F124-H161 HydrophobicContact CD1-CB 4.36Å; F124-H161 AromaticContact CD1-CD2 3.4Å; F124-H161 VanDerWaalsContact CD1-CD2 3.4Å; F124-H161 WeakPolarHBondContact CD1-CD2 3.35Å; F124-H161 AromaticContact CE1-CD2 3.85Å; F124-H161 AromaticContact CG-CD2 3.53Å; F124-H161 AromaticContact CG-NE2 3.94Å; L127-H161 HydrophobicContact CD1-CB 4.03Å; L127-H161 HydrophobicContact CD2-CB 3.97Å; S159-H161 PolarHBondContact O-N 3.5Å; S159-H161 PolarHBondContact OG-N 2.93Å; H161-H163 PolarHBondContact O-N 2.83Å; H161-S164 WeakPolarHBondContact O-CB 3.47Å; H161-S164 PolarHBondContact O-N 3.5Å; H161-S164 VanDerWaalsContact O-N 3.11Å; H161-S164 PolarHBondContact O-OG 2.87Å
162F98.1Very high97.3Very high0 Ų044.1 Ų44.10%023%0.23CC..G310 helixtrans-55.6-37.3174.2171.6-106.2000111.9L157 S159 E160 S164 F165 F166 F184 L187 L188 F198 V206L157-F162 HydrophobicContact CD1-CD2 3.86Å; L157-F162 HydrophobicContact CD1-CE1 4.44Å; L157-F162 HydrophobicContact CD1-CE2 3.59Å; L157-F162 HydrophobicContact CD1-CG 4.39Å; L157-F162 HydrophobicContact CD1-CZ 3.9Å; S159-F162 WeakPolarHBondContact O-CB 3.28Å; S159-F162 PolarHBondContact O-N 3.46Å; S159-F162 VanDerWaalsContact O-N 3.12Å; S159-F162 PolarHBondContact OG-N 3.26Å; E160-F162 PolarHBondContact O-N 3.22Å; F162-S164 PolarHBondContact O-N 2.72Å; F162-F165 HydrophobicContact CD2-CD2 4.12Å; F162-F165 WeakPolarHBondContact O-CB 3.4Å; F162-F165 WeakPolarHBondContact O-CD2 3.42Å; F162-F165 PolarHBondContact O-N 2.93Å; F162-F165 VanDerWaalsContact O-N 3.12Å; F162-F166 HydrophobicContact CE1-CE2 4.26Å; F162-F184 HydrophobicContact CE1-CE2 4.34Å; F162-F184 AromaticContact CE2-CD2 3.86Å; F162-F184 HydrophobicContact CE2-CD2 3.86Å; F162-F184 AromaticContact CE2-CE2 3.78Å; F162-F184 HydrophobicContact CE2-CE2 3.78Å; F162-F184 HydrophobicContact CZ-CD2 4.06Å; F162-F184 AromaticContact CZ-CE2 3.48Å; F162-F184 HydrophobicContact CZ-CE2 3.48Å; F162-F184 VanDerWaalsContact CZ-CE2 3.48Å; F162-F184 HydrophobicContact CZ-CZ 4.48Å; F162-L187 HydrophobicContact CD2-CD1 4.32Å; F162-L187 HydrophobicContact CE2-CD1 4.47Å; F162-L188 HydrophobicContact CE2-CD2 4.46Å; F162-L188 HydrophobicContact CE2-CG 4.49Å; F162-L188 HydrophobicContact CZ-CD1 4.42Å; F162-L188 HydrophobicContact CZ-CD2 3.91Å; F162-L188 HydrophobicContact CZ-CG 4.21Å; F162-F198 HydrophobicContact CD1-CE1 4.29Å; F162-F198 AromaticContact CD1-CZ 3.77Å; F162-F198 HydrophobicContact CD1-CZ 3.77Å; F162-F198 AromaticContact CE1-CE1 3.78Å; F162-F198 HydrophobicContact CE1-CE1 3.78Å; F162-F198 AromaticContact CE1-CZ 3.72Å; F162-F198 HydrophobicContact CE1-CZ 3.72Å; F162-F198 HydrophobicContact CZ-CE1 4.17Å; F162-F198 HydrophobicContact CZ-CZ 4.46Å; F162-V206 HydrophobicContact CE1-CG2 4.44Å
163H96.8Very high97.1Very high63 Ų6346.9 Ų46.929%0.29225%0.246SC..G310 helixtrans-65.8-20.3-177.9-69.7-79.3000113.3E160 H161 F165 F166E160-H163 PolarHBondContact O-N 3.47Å; H161-H163 PolarHBondContact O-N 2.83Å; H163-F165 PolarHBondContact O-N 3.45Å; H163-F166 HydrophobicContact CB-CD2 4.49Å; H163-F166 AromaticContact ND1-CE2 3.89Å; H163-F166 WeakPolarHBondContact O-CD2 3.36Å; H163-F166 PolarHBondContact O-N 2.73Å; H163-F166 VanDerWaalsContact O-N 3.15Å
164S98.1Very high96.9Very high34 Ų3452.5 Ų52.524%0.23827%0.27CS..G310 helixtrans-62.2-24.4174.8-56.30000112.8H161 F162 F166 S167 Y168H161-S164 WeakPolarHBondContact O-CB 3.47Å; H161-S164 PolarHBondContact O-N 3.5Å; H161-S164 VanDerWaalsContact O-N 3.11Å; H161-S164 PolarHBondContact O-OG 2.87Å; F162-S164 PolarHBondContact O-N 2.72Å; S164-F166 PolarHBondContact O-N 3Å; S164-S167 WeakPolarHBondContact O-CB 3.42Å; S164-S167 PolarHBondContact O-N 3.07Å; S164-Y168 VanDerWaalsContact CB-CZ 3.44Å; S164-Y168 VanDerWaalsContact O-CG 3.29Å; S164-Y168 PolarHBondContact O-N 2.88Å
165F98.4Very high96.8Very high0 Ų052.3 Ų52.30%028%0.275CS..Hα-helixtrans-59.3-32.9175.1-80.1-70.3000112.8L127 Y130 L143 F162 H163 S167 Y168 V169 A180 T183 F184 L187L127-F165 HydrophobicContact CD1-CD2 4.36Å; L127-F165 HydrophobicContact CD1-CE2 3.64Å; L127-F165 HydrophobicContact CD1-CZ 4.19Å; L127-F165 HydrophobicContact CG-CE2 4.24Å; L127-F165 HydrophobicContact CG-CZ 4.37Å; Y130-F165 HydrophobicContact CD2-CE1 4.34Å; Y130-F165 AromaticContact CE2-CE1 3.89Å; Y130-F165 HydrophobicContact CE2-CE1 3.89Å; Y130-F165 HydrophobicContact CE2-CZ 4.39Å; L143-F165 HydrophobicContact CD2-CZ 4.11Å; F162-F165 HydrophobicContact CD2-CD2 4.12Å; F162-F165 WeakPolarHBondContact O-CB 3.4Å; F162-F165 WeakPolarHBondContact O-CD2 3.42Å; F162-F165 PolarHBondContact O-N 2.93Å; F162-F165 VanDerWaalsContact O-N 3.12Å; H163-F165 PolarHBondContact O-N 3.45Å; F165-S167 PolarHBondContact O-N 3.23Å; F165-Y168 HydrophobicContact CD1-CD2 4.2Å; F165-Y168 PolarHBondContact O-N 3.47Å; F165-V169 VanDerWaalsContact O-CG1 3.32Å; F165-V169 WeakPolarHBondContact O-CG1 3.07Å; F165-V169 WeakPolarHBondContact O-CG2 3.43Å; F165-V169 PolarHBondContact O-N 3.3Å; F165-A180 HydrophobicContact CD1-CB 4.49Å; F165-T183 HydrophobicContact CE1-CG2 3.91Å; F165-T183 HydrophobicContact CZ-CG2 3.65Å; F165-F184 HydrophobicContact CB-CB 4.17Å; F165-F184 HydrophobicContact CB-CD2 3.48Å; F165-F184 VanDerWaalsContact CB-CD2 3.48Å; F165-F184 HydrophobicContact CB-CE2 4.09Å; F165-F184 HydrophobicContact CB-CG 4.05Å; F165-F184 HydrophobicContact CD1-CB 3.94Å; F165-F184 HydrophobicContact CD2-CD2 4.38Å; F165-F184 HydrophobicContact CG-CB 4.09Å; F165-F184 AromaticContact CG-CD2 3.95Å; F165-F184 HydrophobicContact CG-CD2 3.95Å; F165-F184 HydrophobicContact CG-CG 4.42Å; F165-L187 HydrophobicContact CD2-CD1 4.18Å; F165-L187 HydrophobicContact CE2-CD1 3.49Å; F165-L187 VanDerWaalsContact CE2-CD1 3.49Å; F165-L187 HydrophobicContact CZ-CD1 3.97Å
166F97.8Very high96.7Very high18 Ų1851.2 Ų51.28%0.07927%0.269CS..Hα-helixtrans-62.1-26.3175.8-67.4-75.6000112.6F162 H163 S164 F184 V206 N209 Y210 L213F162-F166 HydrophobicContact CE1-CE2 4.26Å; H163-F166 HydrophobicContact CB-CD2 4.49Å; H163-F166 AromaticContact ND1-CE2 3.89Å; H163-F166 WeakPolarHBondContact O-CD2 3.36Å; H163-F166 PolarHBondContact O-N 2.73Å; H163-F166 VanDerWaalsContact O-N 3.15Å; S164-F166 PolarHBondContact O-N 3Å; F166-F184 HydrophobicContact CD1-CZ 4.35Å; F166-F184 HydrophobicContact CE1-CE2 4.41Å; F166-F184 AromaticContact CE1-CZ 3.77Å; F166-F184 HydrophobicContact CE1-CZ 3.77Å; F166-F184 HydrophobicContact CZ-CE2 4.23Å; F166-F184 AromaticContact CZ-CZ 3.94Å; F166-F184 HydrophobicContact CZ-CZ 3.94Å; F166-V206 HydrophobicContact CZ-CG1 4.32Å; F166-N209 HydrophobicContact CB-CB 4.48Å; F166-N209 HydrophobicContact CD1-CB 3.75Å; F166-N209 HydrophobicContact CD2-CB 3.72Å; F166-N209 HydrophobicContact CE1-CB 3.81Å; F166-N209 HydrophobicContact CE2-CB 3.79Å; F166-N209 HydrophobicContact CG-CB 3.72Å; F166-N209 HydrophobicContact CZ-CB 3.83Å; F166-Y210 HydrophobicContact CE1-CD2 4.12Å; F166-L213 HydrophobicContact CD1-CD1 3.72Å; F166-L213 HydrophobicContact CD1-CD2 4.34Å; F166-L213 HydrophobicContact CD1-CG 4Å; F166-L213 HydrophobicContact CE1-CD1 4.01Å
167S97.1Very high96.7Very high83 Ų8351.4 Ų51.458%0.5827%0.271SS*.Hα-helixtrans-87.2-41.2172.4-59.60000111.9S164 F165 V169 E170 M171S164-S167 WeakPolarHBondContact O-CB 3.42Å; S164-S167 PolarHBondContact O-N 3.07Å; F165-S167 PolarHBondContact O-N 3.23Å; S167-V169 VanDerWaalsContact C-N 3.33Å; S167-V169 PolarHBondContact O-N 3.1Å; S167-E170 PolarHBondContact O-N 3.47Å; S167-E170 VanDerWaalsContact O-N 3.1Å; S167-M171 PolarHBondContact O-N 2.9Å
168Y98Very high96.6Very high12 Ų1253.9 Ų53.95%0.04729%0.289CS..Hα-helixtrans-63.6-36.7-177.9-58.3-25.3000112.9L127 Y130 E131 S164 F165 E170 M171 A177L127-Y168 HydrophobicContact CD2-CE2 3.71Å; L127-Y168 HydrophobicContact CG-CE2 4.3Å; Y130-Y168 HydrophobicContact CD2-CD2 4.01Å; Y130-Y168 HydrophobicContact CD2-CE2 4.31Å; Y130-Y168 HydrophobicContact CG-CD2 4.1Å; Y130-Y168 HydrophobicContact CG-CG 4.45Å; E131-Y168 HydrophobicContact CG-CE1 3.64Å; E131-Y168 PolarHBondContact OE1-OH 3.44Å; S164-Y168 VanDerWaalsContact CB-CZ 3.44Å; S164-Y168 VanDerWaalsContact O-CG 3.29Å; S164-Y168 PolarHBondContact O-N 2.88Å; F165-Y168 HydrophobicContact CD1-CD2 4.2Å; F165-Y168 PolarHBondContact O-N 3.47Å; Y168-E170 PolarHBondContact O-N 2.99Å; Y168-M171 HydrophobicContact CD1-SD 4.27Å; Y168-M171 WeakPolarHBondContact O-CB 3.18Å; Y168-M171 VanDerWaalsContact O-CG 3.29Å; Y168-M171 WeakPolarHBondContact O-CG 3.42Å; Y168-M171 PolarHBondContact O-N 2.87Å; Y168-A177 WeakPolarHBondContact O-CA 3.49Å
169V97.5Very high96.7Very high1 Ų151 Ų511%0.00628%0.279CS..THydrogen-bonded Turntrans-71.4-10177-58.20000114.1F165 S167 A180 F181 F184 L213 T221F165-V169 VanDerWaalsContact O-CG1 3.32Å; F165-V169 WeakPolarHBondContact O-CG1 3.07Å; F165-V169 WeakPolarHBondContact O-CG2 3.43Å; F165-V169 PolarHBondContact O-N 3.3Å; S167-V169 VanDerWaalsContact C-N 3.33Å; S167-V169 PolarHBondContact O-N 3.1Å; V169-A180 HydrophobicContact CG1-CB 4.41Å; V169-F181 HydrophobicContact CB-CB 4.45Å; V169-F181 HydrophobicContact CB-CD2 4.02Å; V169-F181 HydrophobicContact CG1-CB 3.88Å; V169-F181 HydrophobicContact CG1-CD2 3.8Å; V169-F181 HydrophobicContact CG1-CG 4.28Å; V169-F184 HydrophobicContact CG1-CB 4.36Å; V169-F184 HydrophobicContact CG1-CD1 4.47Å; V169-L213 HydrophobicContact CG2-CD1 4.21Å; V169-L213 HydrophobicContact CG2-CD2 3.59Å; V169-T221 HydrophobicContact CB-CG2 4.37Å; V169-T221 HydrophobicContact CG2-CG2 4.03Å; V169-T221 PolarHBondContact O-OG1 2.81Å
170E95.5Very high96.7Very high65 Ų6550.1 Ų50.130%0.30427%0.273SS..THydrogen-bonded Turntrans-106.17.6177.2-65.3-69.6-18000112.3S167 Y168 L213 S216 T221S167-E170 PolarHBondContact O-N 3.47Å; S167-E170 VanDerWaalsContact O-N 3.1Å; Y168-E170 PolarHBondContact O-N 2.99Å; E170-L213 HydrophobicContact CG-CD2 3.99Å; E170-L213 WeakPolarHBondContact OE1-CD2 3.19Å; E170-S216 WeakPolarHBondContact OE1-CB 3.34Å; E170-S216 PolarHBondContact OE1-OG 3.07Å; E170-S216 PolarHBondContact OE2-OG 3.18Å; E170-T221 HydrophobicContact CG-CG2 4.41Å; E170-T221 VanDerWaalsContact OE1-CG2 3.23Å; E170-T221 WeakPolarHBondContact OE1-CG2 3.4Å
171M94.3Very high96.8Very high44 Ų4442.5 Ų42.522%0.21724%0.237CC..  trans-60.4145.9176.9-71.8177.171.600111.4S167 Y168 T173 I176 A177S167-M171 PolarHBondContact O-N 2.9Å; Y168-M171 HydrophobicContact CD1-SD 4.27Å; Y168-M171 WeakPolarHBondContact O-CB 3.18Å; Y168-M171 VanDerWaalsContact O-CG 3.29Å; Y168-M171 WeakPolarHBondContact O-CG 3.42Å; Y168-M171 PolarHBondContact O-N 2.87Å; M171-T173 VanDerWaalsContact C-N 3.27Å; M171-T173 PolarHBondContact O-N 3.42Å; M171-I176 HydrophobicContact CE-CG2 3.85Å; M171-I176 HydrophobicContact SD-CG2 3.75Å; M171-A177 HydrophobicContact CB-CB 4.19Å; M171-A177 WeakPolarHBondContact O-CB 3.16Å
172S92.8Very high96.9Very high125 Ų12540.7 Ų40.787%0.87424%0.237SC*.SBendtrans-69.3-25.6179.554.90000112.9F174S172-F174 PolarHBondContact O-N 3.2Å
173T94.5Very high97Very high57 Ų5740.7 Ų40.735%0.3524%0.237SC..SBendtrans-78.8105.1175.7-34.40000109.6M171 D175 I176 A177M171-T173 VanDerWaalsContact C-N 3.27Å; M171-T173 PolarHBondContact O-N 3.42Å; T173-D175 WeakPolarHBondContact CG2-OD1 3.49Å; T173-D175 PolarHBondContact O-N 2.98Å; T173-I176 HydrophobicContact CG2-CD1 4.02Å; T173-I176 HydrophobicContact CG2-CG1 4.17Å; T173-I176 PolarHBondContact O-N 3.27Å; T173-A177 PolarHBondContact O-N 2.81Å
174F93.9Very high97.1Very high124 Ų12437.7 Ų37.754%0.54422%0.223SC..Hα-helixtrans-58.5-44.5-168.9171.3-100.5000114.4S172 A177 S178 V220S172-F174 PolarHBondContact O-N 3.2Å; F174-A177 PolarHBondContact O-N 3.23Å; F174-S178 WeakPolarHBondContact O-CB 3.32Å; F174-S178 PolarHBondContact O-N 2.69Å; F174-V220 HydrophobicContact CE2-CB 4.26Å; F174-V220 HydrophobicContact CE2-CG1 4.11Å; F174-V220 HydrophobicContact CE2-CG2 3.97Å
175D95.6Very high97.1Very high79 Ų7938.9 Ų38.942%0.42222%0.224SC..Hα-helixtrans-61.5-44.5178.958.3-26.1000111.7T173 D179T173-D175 WeakPolarHBondContact CG2-OD1 3.49Å; T173-D175 PolarHBondContact O-N 2.98Å; D175-D179 VanDerWaalsContact O-CB 3.29Å; D175-D179 WeakPolarHBondContact O-CB 3.47Å; D175-D179 PolarHBondContact O-N 3.38Å
176I97.6Very high97.1Very high3 Ų340 Ų402%0.01523%0.23CC..Hα-helixtrans-65.5-48.5176.5-60.2179.5000111Y130 P133 A136 M171 T173 S178 D179 A180Y130-I176 HydrophobicContact CD1-CG2 3.93Å; P133-I176 HydrophobicContact CB-CD1 3.94Å; P133-I176 HydrophobicContact CG-CD1 4.41Å; A136-I176 HydrophobicContact CB-CD1 3.95Å; A136-I176 HydrophobicContact CB-CG1 4.03Å; A136-I176 HydrophobicContact CB-CG2 3.93Å; M171-I176 HydrophobicContact CE-CG2 3.85Å; M171-I176 HydrophobicContact SD-CG2 3.75Å; T173-I176 HydrophobicContact CG2-CD1 4.02Å; T173-I176 HydrophobicContact CG2-CG1 4.17Å; T173-I176 PolarHBondContact O-N 3.27Å; I176-S178 VanDerWaalsContact C-N 3.32Å; I176-S178 PolarHBondContact O-N 3.18Å; I176-D179 PolarHBondContact O-N 2.83Å; I176-A180 WeakPolarHBondContact O-CB 3.43Å; I176-A180 PolarHBondContact O-N 3.38Å
177A97.5Very high97.2Very high4 Ų439.2 Ų39.23%0.03323%0.227CC..Hα-helixtrans-61.8-40.5179.600000112.2Y168 M171 T173 F174 F181Y168-A177 WeakPolarHBondContact O-CA 3.49Å; M171-A177 HydrophobicContact CB-CB 4.19Å; M171-A177 WeakPolarHBondContact O-CB 3.16Å; T173-A177 PolarHBondContact O-N 2.81Å; F174-A177 PolarHBondContact O-N 3.23Å; A177-F181 WeakPolarHBondContact O-CB 3.46Å; A177-F181 PolarHBondContact O-N 3.45Å
178S97.8Very high97.2Very high57 Ų5735.3 Ų35.340%0.39920%0.199SC..Hα-helixtrans-66-43176.3-1750000111.9F174 I176 F181 A182F174-S178 WeakPolarHBondContact O-CB 3.32Å; F174-S178 PolarHBondContact O-N 2.69Å; I176-S178 VanDerWaalsContact C-N 3.32Å; I176-S178 PolarHBondContact O-N 3.18Å; S178-F181 PolarHBondContact O-N 3.12Å; S178-A182 PolarHBondContact O-N 3.36Å
179D98.5Very high97.2Very high24 Ų2435.9 Ų35.913%0.12820%0.204CC..Hα-helixtrans-64.6-43.4175.7-173.1-78.4000111.7Y130 L137 R144 D175 I176 F181 A182 T183Y130-D179 HydrophobicContact CE1-CB 4.36Å; Y130-D179 VanDerWaalsContact CE1-OD1 3.29Å; Y130-D179 WeakPolarHBondContact CE1-OD1 3.44Å; Y130-D179 PolarHBondContact OH-O 3.36Å; Y130-D179 PolarHBondContact OH-OD1 3.3Å; L137-D179 HydrophobicContact CD2-CB 3.62Å; R144-D179 IonicContact CZ-OD1 2.72Å; R144-D179 IonicContact CZ-OD2 3.85Å; R144-D179 VanDerWaalsContact CZ-OD2 3.27Å; R144-D179 PolarHBondContact NH1-O 2.92Å; R144-D179 IonicContact NH1-OD1 3.79Å; R144-D179 PolarHBondContact NH1-OD1 3.03Å; R144-D179 IonicContact NH1-OD2 2.64Å; R144-D179 PolarHBondContact NH1-OD2 3.4Å; R144-D179 IonicContact NH2-OD1 2.95Å; R144-D179 IonicContact NH2-OD2 3.58Å; R144-D179 PolarHBondContact NH2-OD2 3.05Å; D175-D179 VanDerWaalsContact O-CB 3.29Å; D175-D179 WeakPolarHBondContact O-CB 3.47Å; D175-D179 PolarHBondContact O-N 3.38Å; I176-D179 PolarHBondContact O-N 2.83Å; D179-F181 VanDerWaalsContact C-N 3.31Å; D179-F181 PolarHBondContact O-N 3.25Å; D179-A182 WeakPolarHBondContact O-CB 3.4Å; D179-A182 PolarHBondContact O-N 3.11Å; D179-T183 PolarHBondContact O-N 3.24Å; D179-T183 VanDerWaalsContact O-N 3.11Å; D179-T183 PolarHBondContact O-OG1 3.15Å
180A98.6Very high97.3Very high0 Ų040.9 Ų40.90%022%0.223CC..Hα-helixtrans-59.8-41.5173.100000111.6Y130 F165 V169 I176 A182 T183 F184Y130-A180 HydrophobicContact CD1-CB 3.92Å; Y130-A180 HydrophobicContact CE1-CB 3.72Å; Y130-A180 HydrophobicContact CG-CB 4.43Å; F165-A180 HydrophobicContact CD1-CB 4.49Å; V169-A180 HydrophobicContact CG1-CB 4.41Å; I176-A180 WeakPolarHBondContact O-CB 3.43Å; I176-A180 PolarHBondContact O-N 3.38Å; A180-A182 VanDerWaalsContact C-N 3.33Å; A180-A182 PolarHBondContact O-N 3.2Å; A180-T183 PolarHBondContact O-N 3.35Å; A180-F184 WeakPolarHBondContact O-CB 3.3Å; A180-F184 PolarHBondContact O-N 3.25Å
181F98.6Very high97.4Very high16 Ų1639.4 Ų39.47%0.0722%0.216CC..Hα-helixtrans-64.4-38.6176.5-165.6-79.5000111.6V169 A177 S178 D179 T183 F184 K185 Q224 L228V169-F181 HydrophobicContact CB-CB 4.45Å; V169-F181 HydrophobicContact CB-CD2 4.02Å; V169-F181 HydrophobicContact CG1-CB 3.88Å; V169-F181 HydrophobicContact CG1-CD2 3.8Å; V169-F181 HydrophobicContact CG1-CG 4.28Å; A177-F181 WeakPolarHBondContact O-CB 3.46Å; A177-F181 PolarHBondContact O-N 3.45Å; S178-F181 PolarHBondContact O-N 3.12Å; D179-F181 VanDerWaalsContact C-N 3.31Å; D179-F181 PolarHBondContact O-N 3.25Å; F181-T183 VanDerWaalsContact C-N 3.33Å; F181-T183 PolarHBondContact O-N 3.47Å; F181-F184 HydrophobicContact CE2-CD1 4.48Å; F181-F184 PolarHBondContact O-N 2.89Å; F181-K185 HydrophobicContact CD1-CB 4.41Å; F181-K185 HydrophobicContact CE1-CB 4.22Å; F181-K185 VanDerWaalsContact O-CB 3.29Å; F181-K185 WeakPolarHBondContact O-CB 3.32Å; F181-K185 PolarHBondContact O-N 2.87Å; F181-Q224 HydrophobicContact CD1-CB 4.04Å; F181-Q224 HydrophobicContact CD2-CB 4.43Å; F181-Q224 HydrophobicContact CE1-CB 3.54Å; F181-Q224 HydrophobicContact CE2-CB 3.96Å; F181-Q224 HydrophobicContact CG-CB 4.49Å; F181-Q224 HydrophobicContact CZ-CB 3.5Å; F181-Q224 WeakPolarHBondContact CZ-O 3.25Å; F181-L228 HydrophobicContact CE1-CD2 4.32Å; F181-L228 HydrophobicContact CZ-CB 4.2Å; F181-L228 HydrophobicContact CZ-CD2 3.94Å
182A98.6Very high97.6Very high46 Ų4640.9 Ų40.938%0.3822%0.221SC..Hα-helixtrans-60.7-43.6175.400000111.5S178 D179 A180 D186S178-A182 PolarHBondContact O-N 3.36Å; D179-A182 WeakPolarHBondContact O-CB 3.4Å; D179-A182 PolarHBondContact O-N 3.11Å; A180-A182 VanDerWaalsContact C-N 3.33Å; A180-A182 PolarHBondContact O-N 3.2Å; A182-D186 WeakPolarHBondContact O-CB 3.2Å; A182-D186 PolarHBondContact O-N 3.36Å
183T98.8Very high97.9Very high0 Ų039.8 Ų39.80%021%0.209CC..Hα-helixtrans-66.7-44.4176-52.60000112Y130 L143 R144 I147 F165 D179 A180 F181 K185 D186 L187Y130-T183 PolarHBondContact OH-OG1 2.69Å; L143-T183 HydrophobicContact CD2-CG2 3.93Å; L143-T183 HydrophobicContact CG-CG2 4.08Å; R144-T183 HydrophobicContact CG-CG2 4.02Å; R144-T183 VanDerWaalsContact CG-OG1 3.25Å; R144-T183 WeakPolarHBondContact CG-OG1 3.49Å; R144-T183 PolarHBondContact NH1-OG1 3.21Å; I147-T183 HydrophobicContact CD1-CG2 4.07Å; F165-T183 HydrophobicContact CE1-CG2 3.91Å; F165-T183 HydrophobicContact CZ-CG2 3.65Å; D179-T183 PolarHBondContact O-N 3.24Å; D179-T183 VanDerWaalsContact O-N 3.11Å; D179-T183 PolarHBondContact O-OG1 3.15Å; A180-T183 PolarHBondContact O-N 3.35Å; F181-T183 VanDerWaalsContact C-N 3.33Å; F181-T183 PolarHBondContact O-N 3.47Å; T183-K185 PolarHBondContact O-N 3.42Å; T183-D186 PolarHBondContact O-N 3.2Å; T183-L187 HydrophobicContact CG2-CD1 4.46Å; T183-L187 PolarHBondContact O-N 2.92Å
184F98.8Very high98.1Very high0 Ų037.2 Ų37.20%019%0.193CC..Hα-helixtrans-59.2-46.3176.2179-119.2000112.1F162 F165 F166 V169 A180 F181 L187 L188 Y210 L213 L228F162-F184 HydrophobicContact CE1-CE2 4.34Å; F162-F184 AromaticContact CE2-CD2 3.86Å; F162-F184 HydrophobicContact CE2-CD2 3.86Å; F162-F184 AromaticContact CE2-CE2 3.78Å; F162-F184 HydrophobicContact CE2-CE2 3.78Å; F162-F184 HydrophobicContact CZ-CD2 4.06Å; F162-F184 AromaticContact CZ-CE2 3.48Å; F162-F184 HydrophobicContact CZ-CE2 3.48Å; F162-F184 VanDerWaalsContact CZ-CE2 3.48Å; F162-F184 HydrophobicContact CZ-CZ 4.48Å; F165-F184 HydrophobicContact CB-CB 4.17Å; F165-F184 HydrophobicContact CB-CD2 3.48Å; F165-F184 VanDerWaalsContact CB-CD2 3.48Å; F165-F184 HydrophobicContact CB-CE2 4.09Å; F165-F184 HydrophobicContact CB-CG 4.05Å; F165-F184 HydrophobicContact CD1-CB 3.94Å; F165-F184 HydrophobicContact CD2-CD2 4.38Å; F165-F184 HydrophobicContact CG-CB 4.09Å; F165-F184 AromaticContact CG-CD2 3.95Å; F165-F184 HydrophobicContact CG-CD2 3.95Å; F165-F184 HydrophobicContact CG-CG 4.42Å; F166-F184 HydrophobicContact CD1-CZ 4.35Å; F166-F184 HydrophobicContact CE1-CE2 4.41Å; F166-F184 AromaticContact CE1-CZ 3.77Å; F166-F184 HydrophobicContact CE1-CZ 3.77Å; F166-F184 HydrophobicContact CZ-CE2 4.23Å; F166-F184 AromaticContact CZ-CZ 3.94Å; F166-F184 HydrophobicContact CZ-CZ 3.94Å; V169-F184 HydrophobicContact CG1-CB 4.36Å; V169-F184 HydrophobicContact CG1-CD1 4.47Å; A180-F184 WeakPolarHBondContact O-CB 3.3Å; A180-F184 PolarHBondContact O-N 3.25Å; F181-F184 HydrophobicContact CE2-CD1 4.48Å; F181-F184 PolarHBondContact O-N 2.89Å; F184-L187 PolarHBondContact O-N 3.12Å; F184-L188 HydrophobicContact CD1-CD1 4.22Å; F184-L188 HydrophobicContact CD2-CD1 4.09Å; F184-L188 HydrophobicContact CE1-CD1 3.73Å; F184-L188 HydrophobicContact CE2-CD1 3.61Å; F184-L188 HydrophobicContact CE2-CG 4.38Å; F184-L188 HydrophobicContact CG-CD1 4.39Å; F184-L188 HydrophobicContact CZ-CD1 3.4Å; F184-L188 VanDerWaalsContact CZ-CD1 3.4Å; F184-L188 WeakPolarHBondContact O-CG 3.47Å; F184-L188 PolarHBondContact O-N 3.25Å; F184-L188 VanDerWaalsContact O-N 3.13Å; F184-Y210 HydrophobicContact CE1-CE2 4.09Å; F184-Y210 HydrophobicContact CZ-CD2 4.35Å; F184-Y210 HydrophobicContact CZ-CE2 4.26Å; F184-L213 HydrophobicContact CE1-CD1 4.19Å; F184-L228 HydrophobicContact CD1-CD2 4.26Å; F184-L228 HydrophobicContact CE1-CD2 4.23Å
185K98.7Very high98.3Very high58 Ų5831.5 Ų31.525%0.25217%0.168SC..Hα-helixtrans-60.6-45.6174.4170.5165.5176.7162.70111.3F181 T183 L188 T189 L228 E231F181-K185 HydrophobicContact CD1-CB 4.41Å; F181-K185 HydrophobicContact CE1-CB 4.22Å; F181-K185 VanDerWaalsContact O-CB 3.29Å; F181-K185 WeakPolarHBondContact O-CB 3.32Å; F181-K185 PolarHBondContact O-N 2.87Å; T183-K185 PolarHBondContact O-N 3.42Å; K185-L188 CarbonylContact O-C 3.59Å; K185-L188 PolarHBondContact O-N 3.07Å; K185-T189 HydrophobicContact CG-CG2 4.36Å; K185-T189 WeakPolarHBondContact O-CB 3.49Å; K185-T189 WeakPolarHBondContact O-CG2 3.28Å; K185-T189 PolarHBondContact O-N 3.37Å; K185-T189 PolarHBondContact O-OG1 2.61Å; K185-L228 HydrophobicContact CB-CD1 4.48Å; K185-L228 HydrophobicContact CB-CD2 4.23Å; K185-L228 HydrophobicContact CD-CD1 4.35Å; K185-L228 HydrophobicContact CG-CD1 3.99Å; K185-E231 WeakPolarHBondContact CE-OE2 3.32Å; K185-E231 IonicContact NZ-OE1 3.99Å; K185-E231 PolarHBondContact NZ-OE1 2.91Å; K185-E231 IonicContact NZ-OE2 2.81Å; K185-E231 PolarHBondContact NZ-OE2 3.07Å
186D98.7Very high98.4Very high24 Ų2428.1 Ų28.113%0.12815%0.151CC..Hα-helixtrans-64.1-42.9-177.5-163.128000111.6I147 A182 T183 L188 T189 R190I147-D186 HydrophobicContact CD1-CB 3.75Å; I147-D186 WeakPolarHBondContact CD1-OD2 3.15Å; A182-D186 WeakPolarHBondContact O-CB 3.2Å; A182-D186 PolarHBondContact O-N 3.36Å; T183-D186 PolarHBondContact O-N 3.2Å; D186-L188 VanDerWaalsContact C-N 3.28Å; D186-L188 PolarHBondContact O-N 3Å; D186-T189 PolarHBondContact O-N 2.63Å; D186-R190 VanDerWaalsContact CG-NE 3.32Å; D186-R190 WeakPolarHBondContact O-CB 3.47Å; D186-R190 PolarHBondContact O-N 3.36Å; D186-R190 IonicContact OD1-CZ 2.75Å; D186-R190 IonicContact OD1-NE 2.78Å; D186-R190 PolarHBondContact OD1-NE 3.48Å; D186-R190 IonicContact OD1-NH2 3.46Å; D186-R190 PolarHBondContact OD1-NH2 3Å; D186-R190 IonicContact OD2-CZ 3.08Å; D186-R190 VanDerWaalsContact OD2-CZ 3.32Å; D186-R190 IonicContact OD2-NE 2.82Å; D186-R190 PolarHBondContact OD2-NE 3.23Å; D186-R190 IonicContact OD2-NH2 3.74Å; D186-R190 PolarHBondContact OD2-NH2 3.36Å
187L98.8Very high98.5Very high2 Ų231 Ų311%0.0116%0.164CC..Hα-helixtrans-55.7-41.9171.9-82.7166.9000112.6I147 A153 V156 F162 F165 T183 F184 V195I147-L187 HydrophobicContact CB-CD2 4.11Å; I147-L187 HydrophobicContact CD1-CD2 4.38Å; I147-L187 HydrophobicContact CD1-CG 3.94Å; I147-L187 HydrophobicContact CG2-CD2 3.64Å; I147-L187 HydrophobicContact CG2-CG 4.21Å; A153-L187 HydrophobicContact CB-CD2 4.37Å; V156-L187 HydrophobicContact CB-CD2 4.12Å; V156-L187 HydrophobicContact CG1-CD1 3.8Å; V156-L187 HydrophobicContact CG1-CD2 4.05Å; F162-L187 HydrophobicContact CD2-CD1 4.32Å; F162-L187 HydrophobicContact CE2-CD1 4.47Å; F165-L187 HydrophobicContact CD2-CD1 4.18Å; F165-L187 HydrophobicContact CE2-CD1 3.49Å; F165-L187 VanDerWaalsContact CE2-CD1 3.49Å; F165-L187 HydrophobicContact CZ-CD1 3.97Å; T183-L187 HydrophobicContact CG2-CD1 4.46Å; T183-L187 PolarHBondContact O-N 2.92Å; F184-L187 PolarHBondContact O-N 3.12Å; L187-V195 WeakPolarHBondContact O-CG2 3.29Å
188L98.7Very high98.5Very high1 Ų131 Ų311%0.00516%0.164CC..THydrogen-bonded Turntrans-85.4-1.7-177.9-72.6177.6000114.5L157 F162 F184 K185 D186 V195 L199 L228 L232L157-L188 HydrophobicContact CD1-CD2 4.24Å; F162-L188 HydrophobicContact CE2-CD2 4.46Å; F162-L188 HydrophobicContact CE2-CG 4.49Å; F162-L188 HydrophobicContact CZ-CD1 4.42Å; F162-L188 HydrophobicContact CZ-CD2 3.91Å; F162-L188 HydrophobicContact CZ-CG 4.21Å; F184-L188 HydrophobicContact CD1-CD1 4.22Å; F184-L188 HydrophobicContact CD2-CD1 4.09Å; F184-L188 HydrophobicContact CE1-CD1 3.73Å; F184-L188 HydrophobicContact CE2-CD1 3.61Å; F184-L188 HydrophobicContact CE2-CG 4.38Å; F184-L188 HydrophobicContact CG-CD1 4.39Å; F184-L188 HydrophobicContact CZ-CD1 3.4Å; F184-L188 VanDerWaalsContact CZ-CD1 3.4Å; F184-L188 WeakPolarHBondContact O-CG 3.47Å; F184-L188 PolarHBondContact O-N 3.25Å; F184-L188 VanDerWaalsContact O-N 3.13Å; K185-L188 CarbonylContact O-C 3.59Å; K185-L188 PolarHBondContact O-N 3.07Å; D186-L188 VanDerWaalsContact C-N 3.28Å; D186-L188 PolarHBondContact O-N 3Å; L188-V195 WeakPolarHBondContact O-CG1 3.38Å; L188-L199 HydrophobicContact CD2-CD2 4.09Å; L188-L228 HydrophobicContact CD1-CD2 4.28Å; L188-L232 HydrophobicContact CB-CD2 4.34Å; L188-L232 WeakPolarHBondContact O-CD2 3.41Å
189T98.4Very high98.6Very high24 Ų2428.3 Ų28.315%0.14715%0.145CC..THydrogen-bonded Turntrans-137.5-15.8-173.760.50000115.4K185 D186 K192 L228 L232K185-T189 HydrophobicContact CG-CG2 4.36Å; K185-T189 WeakPolarHBondContact O-CB 3.49Å; K185-T189 WeakPolarHBondContact O-CG2 3.28Å; K185-T189 PolarHBondContact O-N 3.37Å; K185-T189 PolarHBondContact O-OG1 2.61Å; D186-T189 PolarHBondContact O-N 2.63Å; T189-K192 VanDerWaalsContact O-CD 3.23Å; T189-K192 WeakPolarHBondContact O-CD 3.2Å; T189-K192 WeakPolarHBondContact O-CE 3.29Å; T189-K192 PolarHBondContact O-NZ 3.37Å; T189-L228 HydrophobicContact CG2-CD1 3.57Å; T189-L232 HydrophobicContact CG2-CD2 4.22Å
190R98.3Very high98.5Very high105 Ų10531.3 Ų31.340%0.39616%0.158SC..SBendtrans-73.7-60.8-177.1-176.7178.1-67.7-73.2-5.7113.1I147 D186 K192I147-R190 VanDerWaalsContact O-CD 3.32Å; I147-R190 WeakPolarHBondContact O-CD 3.5Å; D186-R190 VanDerWaalsContact CG-NE 3.32Å; D186-R190 WeakPolarHBondContact O-CB 3.47Å; D186-R190 PolarHBondContact O-N 3.36Å; D186-R190 IonicContact OD1-CZ 2.75Å; D186-R190 IonicContact OD1-NE 2.78Å; D186-R190 PolarHBondContact OD1-NE 3.48Å; D186-R190 IonicContact OD1-NH2 3.46Å; D186-R190 PolarHBondContact OD1-NH2 3Å; D186-R190 IonicContact OD2-CZ 3.08Å; D186-R190 VanDerWaalsContact OD2-CZ 3.32Å; D186-R190 IonicContact OD2-NE 2.82Å; D186-R190 PolarHBondContact OD2-NE 3.23Å; D186-R190 IonicContact OD2-NH2 3.74Å; D186-R190 PolarHBondContact OD2-NH2 3.36Å; R190-K192 PolarHBondContact O-N 2.85Å
191H98.6Very high98.5Very high34 Ų3437.7 Ų37.716%0.15719%0.186CC..SBendtrans-95.878.2-172.5-58.6-62.6000110.6I147 R148 E150 A153 V193 V194 V195I147-H191 PolarHBondContact O-NE2 3.24Å; R148-H191 PolarHBondContact O-CE1 3.1Å; R148-H191 VanDerWaalsContact O-CE1 3.26Å; E150-H191 HydrophobicContact CG-CB 4.24Å; E150-H191 PolarHBondContact N-CE1 3.42Å; E150-H191 PolarHBondContact N-NE2 2.85Å; A153-H191 WeakPolarHBondContact CB-CD2 3.5Å; H191-V193 VanDerWaalsContact C-N 3.33Å; H191-V193 PolarHBondContact O-N 3.28Å; H191-V193 VanDerWaalsContact O-N 3.15Å; H191-V194 HydrophobicContact CB-CB 4.14Å; H191-V194 HydrophobicContact CB-CG2 4.08Å; H191-V194 PolarHBondContact O-N 3.47Å; H191-V195 WeakPolarHBondContact O-CG2 3.3Å; H191-V195 PolarHBondContact O-N 2.67Å
192K98.4Very high98.5Very high76 Ų7639.6 Ų39.633%0.3320%0.197SC..Hα-helixtrans-47.9-46.8-166.5-57-56.7-170167.80115.1T189 R190 A196 D235 H237T189-K192 VanDerWaalsContact O-CD 3.23Å; T189-K192 WeakPolarHBondContact O-CD 3.2Å; T189-K192 WeakPolarHBondContact O-CE 3.29Å; T189-K192 PolarHBondContact O-NZ 3.37Å; R190-K192 PolarHBondContact O-N 2.85Å; K192-A196 WeakPolarHBondContact O-CB 3.42Å; K192-A196 PolarHBondContact O-N 3.23Å; K192-D235 VanDerWaalsContact CD-OD2 3.26Å; K192-D235 WeakPolarHBondContact CD-OD2 3.28Å; K192-D235 WeakPolarHBondContact CE-OD2 3.42Å; K192-D235 IonicContact NZ-OD2 3.54Å; K192-D235 PolarHBondContact NZ-OD2 2.96Å; K192-H237 HydrophobicContact CB-CB 4.42Å
193V98.3Very high98.4Very high102 Ų10238.1 Ų38.162%0.61818%0.182SC*.Hα-helixtrans-66.4-44.4-178.6-1800000111.2H191 A196 E197H191-V193 VanDerWaalsContact C-N 3.33Å; H191-V193 PolarHBondContact O-N 3.28Å; H191-V193 VanDerWaalsContact O-N 3.15Å; V193-A196 PolarHBondContact O-N 3.27Å; V193-E197 WeakPolarHBondContact O-CB 3.42Å; V193-E197 PolarHBondContact O-N 3.36Å
194V98.4Very high98.3Very high3 Ų342.6 Ų42.62%0.01821%0.205CC..Hα-helixtrans-65.8-41.8179.3-174.20000111.5E150 R154 L157 Y158 H191 F198E150-V194 HydrophobicContact CG-CG2 3.51Å; E150-V194 WeakPolarHBondContact OE1-CG2 3.38Å; R154-V194 HydrophobicContact CB-CG1 4.19Å; R154-V194 HydrophobicContact CG-CG1 4.1Å; R154-V194 VanDerWaalsContact NH2-CG2 3.31Å; L157-V194 HydrophobicContact CD2-CG1 4.33Å; Y158-V194 HydrophobicContact CE2-CG1 4.01Å; H191-V194 HydrophobicContact CB-CB 4.14Å; H191-V194 HydrophobicContact CB-CG2 4.08Å; H191-V194 PolarHBondContact O-N 3.47Å; V194-F198 VanDerWaalsContact O-CB 3.3Å; V194-F198 WeakPolarHBondContact O-CB 3.33Å; V194-F198 PolarHBondContact O-N 3.28Å
195V98.6Very high98.2Very high3 Ų344.9 Ų44.92%0.01822%0.224CC..Hα-helixtrans-63.2-47.7177.1170.30000110.7L157 L187 L188 H191 E197 F198 L199L157-V195 HydrophobicContact CD2-CG2 4.35Å; L187-V195 WeakPolarHBondContact O-CG2 3.29Å; L188-V195 WeakPolarHBondContact O-CG1 3.38Å; H191-V195 WeakPolarHBondContact O-CG2 3.3Å; H191-V195 PolarHBondContact O-N 2.67Å; V195-E197 PolarHBondContact O-N 2.63Å; V195-F198 PolarHBondContact O-N 3.43Å; V195-L199 HydrophobicContact CG1-CD1 3.7Å; V195-L199 HydrophobicContact CG1-CG 4.09Å; V195-L199 WeakPolarHBondContact O-CB 3.34Å; V195-L199 WeakPolarHBondContact O-CG 3.43Å; V195-L199 PolarHBondContact O-N 3.16Å
196A98.6Very high98.1Very high8 Ų842.1 Ų42.17%0.06621%0.213CC..Hα-helixtrans-58.5-48.9178.500000111K192 V193 F198 L199 E200 H237 N238K192-A196 WeakPolarHBondContact O-CB 3.42Å; K192-A196 PolarHBondContact O-N 3.23Å; V193-A196 PolarHBondContact O-N 3.27Å; A196-F198 VanDerWaalsContact C-N 3.3Å; A196-F198 PolarHBondContact O-N 3.4Å; A196-L199 PolarHBondContact O-N 3.16Å; A196-E200 WeakPolarHBondContact O-CB 3.47Å; A196-E200 VanDerWaalsContact O-CG 3.31Å; A196-E200 WeakPolarHBondContact O-CG 3.41Å; A196-E200 PolarHBondContact O-N 3.37Å; A196-H237 HydrophobicContact CB-CB 3.96Å; A196-H237 VanDerWaalsContact CB-O 3.3Å; A196-H237 WeakPolarHBondContact CB-O 3.29Å; A196-N238 WeakPolarHBondContact CA-OD1 3.29Å; A196-N238 WeakPolarHBondContact CB-OD1 3.45Å
197E98.5Very high98Very high63 Ų6341.7 Ų41.729%0.29421%0.21SC..Hα-helixtrans-56.7-44.2175.8-173.4-171.6-176.800111.9R154 Y158 V193 V195 K201R154-E197 IonicContact CZ-OE2 2.73Å; R154-E197 IonicContact NH1-OE2 3.07Å; R154-E197 PolarHBondContact NH1-OE2 3.04Å; Y158-E197 WeakPolarHBondContact OH-CG 3.49Å; V193-E197 WeakPolarHBondContact O-CB 3.42Å; V193-E197 PolarHBondContact O-N 3.36Å; V195-E197 PolarHBondContact O-N 2.63Å; E197-K201 HydrophobicContact CG-CD 4.32Å; E197-K201 WeakPolarHBondContact O-CG 3.48Å; E197-K201 PolarHBondContact O-N 3.5Å; E197-K201 IonicContact OE1-NZ 2.78Å; E197-K201 PolarHBondContact OE1-NZ 3.21Å
198F98.6Very high97.9Very high5 Ų545.6 Ų45.62%0.02223%0.234CC..Hα-helixtrans-65.6-48.6179.7169.7-101.3000112.3L157 Y158 F162 V194 V195 A196 E200 K201 N202 V206L157-F198 HydrophobicContact CD1-CD1 3.66Å; L157-F198 HydrophobicContact CD1-CE1 3.62Å; L157-F198 HydrophobicContact CD1-CE2 4.49Å; L157-F198 HydrophobicContact CD1-CG 4.13Å; L157-F198 HydrophobicContact CD1-CZ 4.06Å; L157-F198 HydrophobicContact CD2-CB 3.71Å; L157-F198 HydrophobicContact CD2-CD1 3.9Å; L157-F198 HydrophobicContact CD2-CD2 4.35Å; L157-F198 HydrophobicContact CD2-CG 3.72Å; L157-F198 HydrophobicContact CG-CB 4.16Å; L157-F198 HydrophobicContact CG-CD1 3.71Å; L157-F198 HydrophobicContact CG-CD2 3.86Å; L157-F198 HydrophobicContact CG-CE1 4.01Å; L157-F198 HydrophobicContact CG-CE2 4.16Å; L157-F198 HydrophobicContact CG-CG 3.62Å; L157-F198 HydrophobicContact CG-CZ 4.23Å; L157-F198 WeakPolarHBondContact O-CE2 3.37Å; L157-F198 WeakPolarHBondContact O-CZ 3.48Å; Y158-F198 HydrophobicContact CD1-CD2 4.21Å; Y158-F198 HydrophobicContact CD2-CD2 4.18Å; Y158-F198 HydrophobicContact CE1-CD2 4.15Å; Y158-F198 HydrophobicContact CE2-CB 3.89Å; Y158-F198 HydrophobicContact CE2-CD2 4.13Å; Y158-F198 HydrophobicContact CE2-CG 4.43Å; Y158-F198 HydrophobicContact CG-CD2 4.24Å; Y158-F198 WeakPolarHBondContact OH-CA 3.39Å; Y158-F198 PolarHBondContact OH-N 3.16Å; F162-F198 HydrophobicContact CD1-CE1 4.29Å; F162-F198 AromaticContact CD1-CZ 3.77Å; F162-F198 HydrophobicContact CD1-CZ 3.77Å; F162-F198 AromaticContact CE1-CE1 3.78Å; F162-F198 HydrophobicContact CE1-CE1 3.78Å; F162-F198 AromaticContact CE1-CZ 3.72Å; F162-F198 HydrophobicContact CE1-CZ 3.72Å; F162-F198 HydrophobicContact CZ-CE1 4.17Å; F162-F198 HydrophobicContact CZ-CZ 4.46Å; V194-F198 VanDerWaalsContact O-CB 3.3Å; V194-F198 WeakPolarHBondContact O-CB 3.33Å; V194-F198 PolarHBondContact O-N 3.28Å; V195-F198 PolarHBondContact O-N 3.43Å; A196-F198 VanDerWaalsContact C-N 3.3Å; A196-F198 PolarHBondContact O-N 3.4Å; F198-E200 VanDerWaalsContact C-N 3.34Å; F198-K201 PolarHBondContact O-N 3.01Å; F198-N202 VanDerWaalsContact CD2-ND2 3.27Å; F198-N202 WeakPolarHBondContact CD2-ND2 3.34Å; F198-N202 HydrophobicContact CE2-CB 4.18Å; F198-N202 WeakPolarHBondContact CE2-ND2 3.25Å; F198-N202 HydrophobicContact CZ-CB 4.34Å; F198-N202 WeakPolarHBondContact O-CB 3.31Å; F198-N202 PolarHBondContact O-N 3.26Å; F198-N202 PolarHBondContact O-ND2 2.97Å; F198-V206 HydrophobicContact CE1-CG2 3.69Å; F198-V206 HydrophobicContact CZ-CG2 3.84Å
199L98.6Very high97.9Very high1 Ų147.4 Ų47.41%0.00524%0.243CC..Hα-helixtrans-66.5-36.1-178.2-71.1179000111.9L188 V195 A196 Y203 V206 F207 L232 V241L188-L199 HydrophobicContact CD2-CD2 4.09Å; V195-L199 HydrophobicContact CG1-CD1 3.7Å; V195-L199 HydrophobicContact CG1-CG 4.09Å; V195-L199 WeakPolarHBondContact O-CB 3.34Å; V195-L199 WeakPolarHBondContact O-CG 3.43Å; V195-L199 PolarHBondContact O-N 3.16Å; A196-L199 PolarHBondContact O-N 3.16Å; L199-Y203 WeakPolarHBondContact O-CA 3.43Å; L199-Y203 WeakPolarHBondContact O-CB 3.27Å; L199-Y203 PolarHBondContact O-N 2.99Å; L199-V206 HydrophobicContact CD2-CB 4.47Å; L199-V206 HydrophobicContact CD2-CG1 3.81Å; L199-V206 HydrophobicContact CD2-CG2 4.49Å; L199-F207 HydrophobicContact CD2-CE2 4.47Å; L199-L232 HydrophobicContact CD1-CD2 4.24Å; L199-V241 HydrophobicContact CB-CG2 3.83Å
200E97.8Very high97.8Very high87 Ų8746.4 Ų46.441%0.40724%0.237SC..Hα-helixtrans-64.3-47.9174.4-73.9-178-179.300111.3A196 F198 T240 V241A196-E200 WeakPolarHBondContact O-CB 3.47Å; A196-E200 VanDerWaalsContact O-CG 3.31Å; A196-E200 WeakPolarHBondContact O-CG 3.41Å; A196-E200 PolarHBondContact O-N 3.37Å; F198-E200 VanDerWaalsContact C-N 3.34Å; E200-T240 HydrophobicContact CG-CG2 4.41Å; E200-T240 WeakPolarHBondContact OE1-CB 3.42Å; E200-T240 PolarHBondContact OE1-OG1 2.97Å; E200-V241 HydrophobicContact CB-CG2 4.42Å; E200-V241 HydrophobicContact CG-CG2 3.57Å
201K98.1Very high97.8Very high133 Ų13345.7 Ų45.758%0.57824%0.238SC*.Hα-helixtrans-70.8-32.8-178-70.7179.1-172.8174.50113.5E197 F198E197-K201 HydrophobicContact CG-CD 4.32Å; E197-K201 WeakPolarHBondContact O-CG 3.48Å; E197-K201 PolarHBondContact O-N 3.5Å; E197-K201 IonicContact OE1-NZ 2.78Å; E197-K201 PolarHBondContact OE1-NZ 3.21Å; F198-K201 PolarHBondContact O-N 3.01Å
202N97.9Very high97.7Very high56 Ų5650.2 Ų50.230%0.29926%0.257SS..THydrogen-bonded Turntrans-11323.1-173.1-58.1-79000112.8F198 D204 A205 V206F198-N202 VanDerWaalsContact CD2-ND2 3.27Å; F198-N202 WeakPolarHBondContact CD2-ND2 3.34Å; F198-N202 HydrophobicContact CE2-CB 4.18Å; F198-N202 WeakPolarHBondContact CE2-ND2 3.25Å; F198-N202 HydrophobicContact CZ-CB 4.34Å; F198-N202 WeakPolarHBondContact O-CB 3.31Å; F198-N202 PolarHBondContact O-N 3.26Å; F198-N202 PolarHBondContact O-ND2 2.97Å; N202-D204 PolarHBondContact O-N 3.24Å; N202-A205 PolarHBondContact O-N 3.11Å; N202-V206 HydrophobicContact CB-CG2 4.09Å; N202-V206 WeakPolarHBondContact O-CG2 3.47Å; N202-V206 PolarHBondContact O-N 2.9Å
203Y97.8Very high97.6Very high16 Ų1646.7 Ų46.76%0.06324%0.242CC..Hα-helixtrans-49.7-55.4-169.8-176-76.9000112.6L199 A205 V206 F207 V241 Y244 Y245L199-Y203 WeakPolarHBondContact O-CA 3.43Å; L199-Y203 WeakPolarHBondContact O-CB 3.27Å; L199-Y203 PolarHBondContact O-N 2.99Å; Y203-A205 PolarHBondContact O-N 3.18Å; Y203-V206 PolarHBondContact O-N 2.78Å; Y203-F207 HydrophobicContact CD1-CB 4.37Å; Y203-F207 AromaticContact CD1-CD2 3.97Å; Y203-F207 HydrophobicContact CD1-CD2 3.97Å; Y203-F207 AromaticContact CD2-CD2 3.53Å; Y203-F207 HydrophobicContact CD2-CD2 3.53Å; Y203-F207 AromaticContact CD2-CE2 3.62Å; Y203-F207 HydrophobicContact CD2-CE2 3.62Å; Y203-F207 HydrophobicContact CE1-CB 3.96Å; Y203-F207 AromaticContact CE1-CD2 3.87Å; Y203-F207 HydrophobicContact CE1-CD2 3.87Å; Y203-F207 HydrophobicContact CE1-CG 4.08Å; Y203-F207 AromaticContact CE2-CD2 3.46Å; Y203-F207 HydrophobicContact CE2-CD2 3.46Å; Y203-F207 VanDerWaalsContact CE2-CD2 3.46Å; Y203-F207 AromaticContact CE2-CE2 3.52Å; Y203-F207 HydrophobicContact CE2-CE2 3.52Å; Y203-F207 HydrophobicContact CE2-CG 4.19Å; Y203-F207 HydrophobicContact CE2-CZ 4.27Å; Y203-F207 AromaticContact CG-CD2 3.79Å; Y203-F207 HydrophobicContact CG-CD2 3.79Å; Y203-F207 HydrophobicContact CG-CE2 4.31Å; Y203-F207 AromaticContact CZ-CD2 3.63Å; Y203-F207 AromaticContact CZ-CG 3.92Å; Y203-F207 WeakPolarHBondContact O-CB 3.4Å; Y203-F207 WeakPolarHBondContact O-CD2 3.35Å; Y203-F207 PolarHBondContact O-N 3.29Å; Y203-V241 HydrophobicContact CD2-CG1 3.96Å; Y203-V241 HydrophobicContact CE2-CG1 3.8Å; Y203-Y244 AromaticContact CD1-CD1 3.59Å; Y203-Y244 HydrophobicContact CD1-CD1 3.59Å; Y203-Y244 AromaticContact CD1-CE1 3.38Å; Y203-Y244 HydrophobicContact CD1-CE1 3.38Å; Y203-Y244 AromaticContact CD2-CD1 3.73Å; Y203-Y244 HydrophobicContact CD2-CD1 3.73Å; Y203-Y244 HydrophobicContact CD2-CE1 4.36Å; Y203-Y244 AromaticContact CE1-CD1 3.43Å; Y203-Y244 HydrophobicContact CE1-CD1 3.43Å; Y203-Y244 VanDerWaalsContact CE1-CD1 3.43Å; Y203-Y244 AromaticContact CE1-CE1 3.38Å; Y203-Y244 HydrophobicContact CE1-CE1 3.38Å; Y203-Y244 AromaticContact CE2-CD1 3.52Å; Y203-Y244 HydrophobicContact CE2-CD1 3.52Å; Y203-Y244 HydrophobicContact CE2-CE1 4.32Å; Y203-Y244 HydrophobicContact CE2-CG 4.42Å; Y203-Y244 AromaticContact CG-CD1 3.76Å; Y203-Y244 HydrophobicContact CG-CD1 3.76Å; Y203-Y244 AromaticContact CG-CE1 3.92Å; Y203-Y244 HydrophobicContact CG-CE1 3.92Å; Y203-Y244 AromaticContact CZ-CD1 3.37Å; Y203-Y244 AromaticContact CZ-CE1 3.86Å; Y203-Y245 WeakPolarHBondContact OH-CA 3.45Å; Y203-Y245 WeakPolarHBondContact OH-CB 3.34Å; Y203-Y245 VanDerWaalsContact OH-CD2 3.24Å; Y203-Y245 WeakPolarHBondContact OH-CD2 3.41Å
204D96.3Very high97.6Very high93 Ų9342 Ų4250%0.49721%0.213SC..Hα-helixtrans-65.6-45-172.9-66.5-42.4000111.2N202 V206 T208 K248N202-D204 PolarHBondContact O-N 3.24Å; D204-V206 VanDerWaalsContact C-N 3.32Å; D204-V206 PolarHBondContact O-N 3.43Å; D204-T208 WeakPolarHBondContact O-CB 3.23Å; D204-T208 PolarHBondContact O-N 3.47Å; D204-T208 PolarHBondContact O-OG1 2.91Å; D204-K248 IonicContact OD1-NZ 3.44Å
205A95.3Very high97.4Very high48 Ų4845.7 Ų45.740%0.39723%0.23SC..Hα-helixtrans-60.8-39.717800000112.8N202 Y203 N209N202-A205 PolarHBondContact O-N 3.11Å; Y203-A205 PolarHBondContact O-N 3.18Å; A205-N209 PolarHBondContact O-ND2 2.97Å
206V97.6Very high97.3Very high1 Ų146.1 Ų46.11%0.00623%0.233CC..Hα-helixtrans-73.5-54.8178.9173.60000110.7F162 F166 F198 L199 N202 Y203 D204 T208 N209 Y210F162-V206 HydrophobicContact CE1-CG2 4.44Å; F166-V206 HydrophobicContact CZ-CG1 4.32Å; F198-V206 HydrophobicContact CE1-CG2 3.69Å; F198-V206 HydrophobicContact CZ-CG2 3.84Å; L199-V206 HydrophobicContact CD2-CB 4.47Å; L199-V206 HydrophobicContact CD2-CG1 3.81Å; L199-V206 HydrophobicContact CD2-CG2 4.49Å; N202-V206 HydrophobicContact CB-CG2 4.09Å; N202-V206 WeakPolarHBondContact O-CG2 3.47Å; N202-V206 PolarHBondContact O-N 2.9Å; Y203-V206 PolarHBondContact O-N 2.78Å; D204-V206 VanDerWaalsContact C-N 3.32Å; D204-V206 PolarHBondContact O-N 3.43Å; V206-T208 PolarHBondContact O-N 3.3Å; V206-N209 PolarHBondContact O-N 2.91Å; V206-Y210 WeakPolarHBondContact O-CB 3.42Å; V206-Y210 PolarHBondContact O-N 3.43Å
207F97.6Very high97Very high15 Ų1553.4 Ų53.47%0.06627%0.266CS..Hα-helixtrans-73.7-26.3-171.4-78.5-80.3000113.5L199 Y203 N209 Y210 E211 L229 V241 Y245L199-F207 HydrophobicContact CD2-CE2 4.47Å; Y203-F207 HydrophobicContact CD1-CB 4.37Å; Y203-F207 AromaticContact CD1-CD2 3.97Å; Y203-F207 HydrophobicContact CD1-CD2 3.97Å; Y203-F207 AromaticContact CD2-CD2 3.53Å; Y203-F207 HydrophobicContact CD2-CD2 3.53Å; Y203-F207 AromaticContact CD2-CE2 3.62Å; Y203-F207 HydrophobicContact CD2-CE2 3.62Å; Y203-F207 HydrophobicContact CE1-CB 3.96Å; Y203-F207 AromaticContact CE1-CD2 3.87Å; Y203-F207 HydrophobicContact CE1-CD2 3.87Å; Y203-F207 HydrophobicContact CE1-CG 4.08Å; Y203-F207 AromaticContact CE2-CD2 3.46Å; Y203-F207 HydrophobicContact CE2-CD2 3.46Å; Y203-F207 VanDerWaalsContact CE2-CD2 3.46Å; Y203-F207 AromaticContact CE2-CE2 3.52Å; Y203-F207 HydrophobicContact CE2-CE2 3.52Å; Y203-F207 HydrophobicContact CE2-CG 4.19Å; Y203-F207 HydrophobicContact CE2-CZ 4.27Å; Y203-F207 AromaticContact CG-CD2 3.79Å; Y203-F207 HydrophobicContact CG-CD2 3.79Å; Y203-F207 HydrophobicContact CG-CE2 4.31Å; Y203-F207 AromaticContact CZ-CD2 3.63Å; Y203-F207 AromaticContact CZ-CG 3.92Å; Y203-F207 WeakPolarHBondContact O-CB 3.4Å; Y203-F207 WeakPolarHBondContact O-CD2 3.35Å; Y203-F207 PolarHBondContact O-N 3.29Å; F207-N209 VanDerWaalsContact C-N 3.32Å; F207-Y210 PolarHBondContact O-N 2.93Å; F207-E211 WeakPolarHBondContact O-CB 3.25Å; F207-E211 PolarHBondContact O-N 3.48Å; F207-L229 HydrophobicContact CE1-CD1 3.86Å; F207-V241 HydrophobicContact CE2-CG1 3.55Å; F207-V241 HydrophobicContact CZ-CG1 3.64Å; F207-Y245 AromaticContact CD1-CD2 3.76Å; F207-Y245 HydrophobicContact CD1-CD2 3.76Å; F207-Y245 AromaticContact CD1-CE2 3.72Å; F207-Y245 HydrophobicContact CD1-CE2 3.72Å; F207-Y245 AromaticContact CE1-CD2 3.73Å; F207-Y245 HydrophobicContact CE1-CD2 3.73Å; F207-Y245 AromaticContact CE1-CE2 3.91Å; F207-Y245 HydrophobicContact CE1-CE2 3.91Å; F207-Y245 HydrophobicContact CG-CD2 4.47Å; F207-Y245 HydrophobicContact CZ-CD2 4.45Å
208T96.7Very high96.7Very high84 Ų8452.8 Ų52.852%0.51527%0.265SS..Hα-helixtrans-63.1-38.8169.2-67.50000111.8D204 V206D204-T208 WeakPolarHBondContact O-CB 3.23Å; D204-T208 PolarHBondContact O-N 3.47Å; D204-T208 PolarHBondContact O-OG1 2.91Å; V206-T208 PolarHBondContact O-N 3.3Å
209N96.9Very high96.5Very high39 Ų3956.4 Ų56.421%0.20928%0.279CS..Hα-helixtrans-77.6-36.3174.9-72.6-58000112F166 A205 V206 F207 E211 K212F166-N209 HydrophobicContact CB-CB 4.48Å; F166-N209 HydrophobicContact CD1-CB 3.75Å; F166-N209 HydrophobicContact CD2-CB 3.72Å; F166-N209 HydrophobicContact CE1-CB 3.81Å; F166-N209 HydrophobicContact CE2-CB 3.79Å; F166-N209 HydrophobicContact CG-CB 3.72Å; F166-N209 HydrophobicContact CZ-CB 3.83Å; A205-N209 PolarHBondContact O-ND2 2.97Å; V206-N209 PolarHBondContact O-N 2.91Å; F207-N209 VanDerWaalsContact C-N 3.32Å; N209-E211 VanDerWaalsContact C-N 3.29Å; N209-E211 PolarHBondContact O-N 3.18Å; N209-K212 VanDerWaalsContact O-CB 3.31Å; N209-K212 WeakPolarHBondContact O-CB 3.43Å; N209-K212 PolarHBondContact O-N 2.9Å; N209-K212 VanDerWaalsContact O-N 3.13Å; N209-K212 PolarHBondContact OD1-NZ 3.25Å
210Y98.1Very high96.3Very high3 Ų358.6 Ų58.61%0.01229%0.292CS..Hα-helixtrans-61.5-37.8176.7-153.3-75.9000112.2F166 F184 V206 F207 K212 L213 L214 S225 L228 L229 L232F166-Y210 HydrophobicContact CE1-CD2 4.12Å; F184-Y210 HydrophobicContact CE1-CE2 4.09Å; F184-Y210 HydrophobicContact CZ-CD2 4.35Å; F184-Y210 HydrophobicContact CZ-CE2 4.26Å; V206-Y210 WeakPolarHBondContact O-CB 3.42Å; V206-Y210 PolarHBondContact O-N 3.43Å; F207-Y210 PolarHBondContact O-N 2.93Å; Y210-K212 PolarHBondContact O-N 3.27Å; Y210-L213 WeakPolarHBondContact O-CB 2.89Å; Y210-L213 PolarHBondContact O-N 3.38Å; Y210-L214 HydrophobicContact CD1-CD1 4.47Å; Y210-L214 HydrophobicContact CD1-CD2 4.32Å; Y210-L214 HydrophobicContact CD1-CG 4.23Å; Y210-L214 HydrophobicContact CE1-CD2 4.06Å; Y210-L214 HydrophobicContact CE1-CG 4.47Å; Y210-L214 PolarHBondContact O-N 2.92Å; Y210-S225 WeakPolarHBondContact CE1-O 3.36Å; Y210-S225 PolarHBondContact OH-O 3.3Å; Y210-L228 HydrophobicContact CE2-CD2 4.41Å; Y210-L228 VanDerWaalsContact OH-CB 3.3Å; Y210-L228 WeakPolarHBondContact OH-CB 3.43Å; Y210-L228 WeakPolarHBondContact OH-CD2 3.34Å; Y210-L228 VanDerWaalsContact OH-CG 3.28Å; Y210-L228 WeakPolarHBondContact OH-CG 3.33Å; Y210-L229 HydrophobicContact CE1-CB 3.92Å; Y210-L229 HydrophobicContact CE1-CD1 4.4Å; Y210-L229 PolarHBondContact OH-N 3.46Å; Y210-L232 HydrophobicContact CE2-CD1 4.42Å
211E96.6Very high96.2Very high90 Ų9054.8 Ų54.842%0.42128%0.275SS..Hα-helixtrans-58.9-32.6176.6-175.3171.1-177.600112.4F207 N209 L213 L214 H215F207-E211 WeakPolarHBondContact O-CB 3.25Å; F207-E211 PolarHBondContact O-N 3.48Å; N209-E211 VanDerWaalsContact C-N 3.29Å; N209-E211 PolarHBondContact O-N 3.18Å; E211-L213 VanDerWaalsContact C-N 3.31Å; E211-L213 PolarHBondContact O-N 3.2Å; E211-L214 WeakPolarHBondContact O-CB 3.01Å; E211-L214 PolarHBondContact O-N 2.78Å; E211-H215 PolarHBondContact O-N 2.81Å; E211-H215 PolarHBondContact O-ND1 3.3Å; E211-H215 IonicContact OE1-CE1 3.2Å
212K97Very high96.1Very high129 Ų12948.8 Ų48.856%0.56125%0.249SC*.Hα-helixtrans-62.1-40.3174.7-57.7172.6-176.1165.80111.2N209 Y210 L214 H215 S216N209-K212 VanDerWaalsContact O-CB 3.31Å; N209-K212 WeakPolarHBondContact O-CB 3.43Å; N209-K212 PolarHBondContact O-N 2.9Å; N209-K212 VanDerWaalsContact O-N 3.13Å; N209-K212 PolarHBondContact OD1-NZ 3.25Å; Y210-K212 PolarHBondContact O-N 3.27Å; K212-L214 VanDerWaalsContact C-N 3.29Å; K212-L214 PolarHBondContact O-N 3Å; K212-H215 CarbonylContact O-C 3.52Å; K212-H215 WeakPolarHBondContact O-CA 3.42Å; K212-H215 PolarHBondContact O-N 3.24Å; K212-S216 PolarHBondContact O-N 2.92Å
213L97.5Very high96.1Very high2 Ų249.2 Ų49.21%0.0125%0.246CC..Hα-helixtrans-63.3-34.9176.9-53.9-177.4000112.2F166 V169 E170 F184 Y210 E211 H215 S216 T221 S225F166-L213 HydrophobicContact CD1-CD1 3.72Å; F166-L213 HydrophobicContact CD1-CD2 4.34Å; F166-L213 HydrophobicContact CD1-CG 4Å; F166-L213 HydrophobicContact CE1-CD1 4.01Å; V169-L213 HydrophobicContact CG2-CD1 4.21Å; V169-L213 HydrophobicContact CG2-CD2 3.59Å; E170-L213 HydrophobicContact CG-CD2 3.99Å; E170-L213 WeakPolarHBondContact OE1-CD2 3.19Å; F184-L213 HydrophobicContact CE1-CD1 4.19Å; Y210-L213 WeakPolarHBondContact O-CB 2.89Å; Y210-L213 PolarHBondContact O-N 3.38Å; E211-L213 VanDerWaalsContact C-N 3.31Å; E211-L213 PolarHBondContact O-N 3.2Å; L213-H215 PolarHBondContact O-N 3.12Å; L213-S216 VanDerWaalsContact O-CB 3.25Å; L213-S216 WeakPolarHBondContact O-CB 3.2Å; L213-S216 PolarHBondContact O-N 3.44Å; L213-T221 HydrophobicContact CD2-CG2 4.26Å; L213-S225 WeakPolarHBondContact CB-OG 3.34Å
214L96.6Very high96.1Very high3 Ų351 Ų512%0.01626%0.255CS..Hα-helixtrans-69.3-15.8175.5-55.9179.2000113Y210 E211 K212 K222 L226 L229 L254 M255 R258Y210-L214 HydrophobicContact CD1-CD1 4.47Å; Y210-L214 HydrophobicContact CD1-CD2 4.32Å; Y210-L214 HydrophobicContact CD1-CG 4.23Å; Y210-L214 HydrophobicContact CE1-CD2 4.06Å; Y210-L214 HydrophobicContact CE1-CG 4.47Å; Y210-L214 PolarHBondContact O-N 2.92Å; E211-L214 WeakPolarHBondContact O-CB 3.01Å; E211-L214 PolarHBondContact O-N 2.78Å; K212-L214 VanDerWaalsContact C-N 3.29Å; K212-L214 PolarHBondContact O-N 3Å; L214-K222 VanDerWaalsContact O-CE 3.28Å; L214-K222 WeakPolarHBondContact O-CE 3.43Å; L214-L226 HydrophobicContact CD2-CB 4.36Å; L214-L226 HydrophobicContact CD2-CD1 4.05Å; L214-L229 HydrophobicContact CD1-CD2 3.88Å; L214-L229 HydrophobicContact CD2-CD2 4.3Å; L214-L254 HydrophobicContact CB-CD2 4.22Å; L214-L254 HydrophobicContact CD1-CD2 3.76Å; L214-M255 HydrophobicContact CD1-CE 4.33Å; L214-R258 PolarHBondContact O-NE 3.17Å; L214-R258 PolarHBondContact O-NH2 2.84Å
215H95.4Very high96.2Very high81 Ų8146.5 Ų46.538%0.37523%0.231SC..Hα-helixtrans-100.3-13.1175.4-68.789.8000113.3E211 K212 L213 E217 K222 L254 R258E211-H215 PolarHBondContact O-N 2.81Å; E211-H215 PolarHBondContact O-ND1 3.3Å; E211-H215 IonicContact OE1-CE1 3.2Å; K212-H215 CarbonylContact O-C 3.52Å; K212-H215 WeakPolarHBondContact O-CA 3.42Å; K212-H215 PolarHBondContact O-N 3.24Å; L213-H215 PolarHBondContact O-N 3.12Å; H215-E217 PolarHBondContact O-N 2.93Å; H215-K222 VanDerWaalsContact C-CE 3.47Å; H215-K222 WeakPolarHBondContact O-CE 3.32Å; H215-K222 PolarHBondContact O-NZ 3.1Å; H215-L254 WeakPolarHBondContact NE2-CD1 3.3Å; H215-R258 PolarHBondContact CD2-NH2 3.2Å
216S95.3Very high96.3Very high11 Ų1144.4 Ų44.48%0.07721%0.213CC..  trans-42.8132.2-177-178.20000115.2E170 K212 L213 N218 K222E170-S216 WeakPolarHBondContact OE1-CB 3.34Å; E170-S216 PolarHBondContact OE1-OG 3.07Å; E170-S216 PolarHBondContact OE2-OG 3.18Å; K212-S216 PolarHBondContact O-N 2.92Å; L213-S216 VanDerWaalsContact O-CB 3.25Å; L213-S216 WeakPolarHBondContact O-CB 3.2Å; L213-S216 PolarHBondContact O-N 3.44Å; S216-N218 PolarHBondContact O-N 3.32Å; S216-N218 WeakPolarHBondContact OG-CB 3.25Å; S216-N218 PolarHBondContact OG-N 3.47Å; S216-K222 WeakPolarHBondContact O-CE 3.3Å; S216-K222 PolarHBondContact O-NZ 3.01Å
217E92.5Very high96.4Very high162 Ų16247.9 Ų47.976%0.75723%0.228SC*.SBendtrans-69.1-19.5172.1-64.9-53.9133.700112.4H215 Y219H215-E217 PolarHBondContact O-N 2.93Å; E217-Y219 PolarHBondContact O-N 2.88Å
218N93.4Very high96.4Very high50 Ų5047.2 Ų47.227%0.26723%0.225SC..  trans-71.2113172.7-173.7-35.2000110.1S216 V220 T221 K222S216-N218 PolarHBondContact O-N 3.32Å; S216-N218 WeakPolarHBondContact OG-CB 3.25Å; S216-N218 PolarHBondContact OG-N 3.47Å; N218-V220 VanDerWaalsContact C-N 3.29Å; N218-V220 PolarHBondContact O-N 3.37Å; N218-V220 PolarHBondContact OD1-N 2.95Å; N218-T221 PolarHBondContact O-N 3.47Å; N218-T221 PolarHBondContact OD1-N 2.87Å; N218-K222 VanDerWaalsContact O-CB 3.3Å; N218-K222 WeakPolarHBondContact O-CB 3.42Å; N218-K222 PolarHBondContact O-N 3.21Å
219Y93.1Very high96.5Very high80 Ų8043.2 Ų43.231%0.31420%0.201SC..Hα-helixtrans-54.9-43.3179.9165.7-109.6000112.8E217 R223 R263 N265 I266E217-Y219 PolarHBondContact O-N 2.88Å; Y219-R223 VanDerWaalsContact O-CB 3.28Å; Y219-R223 WeakPolarHBondContact O-CB 3.37Å; Y219-R223 PolarHBondContact O-N 2.93Å; Y219-R263 HydrophobicContact CE2-CB 4.32Å; Y219-R263 HydrophobicContact CE2-CG 4.43Å; Y219-N265 PolarHBondContact OH-ND2 3.12Å; Y219-I266 HydrophobicContact CD2-CD1 4.2Å; Y219-I266 HydrophobicContact CD2-CG1 4.27Å; Y219-I266 HydrophobicContact CE2-CD1 4.06Å; Y219-I266 HydrophobicContact CE2-CG1 4.02Å
220V94.8Very high96.5Very high47 Ų4741.5 Ų41.529%0.28519%0.193SC..Hα-helixtrans-70.1-47.4-176.1176.80000110F174 N218 K222 R223 Q224F174-V220 HydrophobicContact CE2-CB 4.26Å; F174-V220 HydrophobicContact CE2-CG1 4.11Å; F174-V220 HydrophobicContact CE2-CG2 3.97Å; N218-V220 VanDerWaalsContact C-N 3.29Å; N218-V220 PolarHBondContact O-N 3.37Å; N218-V220 PolarHBondContact OD1-N 2.95Å; V220-K222 PolarHBondContact O-N 3.28Å; V220-R223 PolarHBondContact O-N 2.97Å; V220-Q224 HydrophobicContact CG1-CG 4.1Å; V220-Q224 WeakPolarHBondContact O-CB 3.28Å; V220-Q224 WeakPolarHBondContact O-CG 3.41Å; V220-Q224 PolarHBondContact O-N 3.46Å
221T95.8Very high96.5Very high7 Ų744.6 Ų44.64%0.04321%0.207CC..Hα-helixtrans-60.3-47.6177.4-52.60000111.2V169 E170 L213 N218 R223 Q224 S225V169-T221 HydrophobicContact CB-CG2 4.37Å; V169-T221 HydrophobicContact CG2-CG2 4.03Å; V169-T221 PolarHBondContact O-OG1 2.81Å; E170-T221 HydrophobicContact CG-CG2 4.41Å; E170-T221 VanDerWaalsContact OE1-CG2 3.23Å; E170-T221 WeakPolarHBondContact OE1-CG2 3.4Å; L213-T221 HydrophobicContact CD2-CG2 4.26Å; N218-T221 PolarHBondContact O-N 3.47Å; N218-T221 PolarHBondContact OD1-N 2.87Å; T221-R223 PolarHBondContact O-N 3.2Å; T221-Q224 PolarHBondContact O-N 3.1Å; T221-S225 WeakPolarHBondContact O-CB 3.19Å; T221-S225 PolarHBondContact O-N 3.39Å; T221-S225 PolarHBondContact O-OG 2.96Å
222K96.7Very high96.6Very high7 Ų740.6 Ų40.63%0.0319%0.188CC..Hα-helixtrans-58.1-47.1176.2179.7175.3-86.6153.20112L214 H215 S216 N218 V220 L226 I266L214-K222 VanDerWaalsContact O-CE 3.28Å; L214-K222 WeakPolarHBondContact O-CE 3.43Å; H215-K222 VanDerWaalsContact C-CE 3.47Å; H215-K222 WeakPolarHBondContact O-CE 3.32Å; H215-K222 PolarHBondContact O-NZ 3.1Å; S216-K222 WeakPolarHBondContact O-CE 3.3Å; S216-K222 PolarHBondContact O-NZ 3.01Å; N218-K222 VanDerWaalsContact O-CB 3.3Å; N218-K222 WeakPolarHBondContact O-CB 3.42Å; N218-K222 PolarHBondContact O-N 3.21Å; V220-K222 PolarHBondContact O-N 3.28Å; K222-L226 WeakPolarHBondContact O-CB 3.4Å; K222-L226 PolarHBondContact O-N 3.43Å; K222-L226 VanDerWaalsContact O-N 3.1Å; K222-I266 HydrophobicContact CG-CD1 4.11Å
223R97.3Very high96.6Very high65 Ų6534.5 Ų34.525%0.24516%0.162CC..Hα-helixtrans-64.2-51.5179.7-174.9-177.6166.9-122.4-6.5111.9Y219 V220 T221 S225 L226 K227 I266 E269Y219-R223 VanDerWaalsContact O-CB 3.28Å; Y219-R223 WeakPolarHBondContact O-CB 3.37Å; Y219-R223 PolarHBondContact O-N 2.93Å; V220-R223 PolarHBondContact O-N 2.97Å; T221-R223 PolarHBondContact O-N 3.2Å; R223-S225 VanDerWaalsContact C-N 3.32Å; R223-S225 PolarHBondContact O-N 3.21Å; R223-L226 PolarHBondContact O-N 3.25Å; R223-K227 PolarHBondContact O-N 3.49Å; R223-I266 VanDerWaalsContact CA-CD1 3.47Å; R223-I266 HydrophobicContact CB-CD1 3.5Å; R223-I266 HydrophobicContact CG-CD1 4.06Å; R223-E269 HydrophobicContact CG-CG 4.18Å; R223-E269 IonicContact NE-OE1 3.07Å; R223-E269 IonicContact NH2-OE1 3.18Å; R223-E269 PolarHBondContact NH2-OE1 2.92Å
224Q97.8Very high96.6Very high53 Ų5338.8 Ų38.825%0.24818%0.184CC..Hα-helixtrans-67.5-35-175.8-66.8-63.3-20.100111.7F181 V220 T221 K227 L228F181-Q224 HydrophobicContact CD1-CB 4.04Å; F181-Q224 HydrophobicContact CD2-CB 4.43Å; F181-Q224 HydrophobicContact CE1-CB 3.54Å; F181-Q224 HydrophobicContact CE2-CB 3.96Å; F181-Q224 HydrophobicContact CG-CB 4.49Å; F181-Q224 HydrophobicContact CZ-CB 3.5Å; F181-Q224 WeakPolarHBondContact CZ-O 3.25Å; V220-Q224 HydrophobicContact CG1-CG 4.1Å; V220-Q224 WeakPolarHBondContact O-CB 3.28Å; V220-Q224 WeakPolarHBondContact O-CG 3.41Å; V220-Q224 PolarHBondContact O-N 3.46Å; T221-Q224 PolarHBondContact O-N 3.1Å; Q224-K227 PolarHBondContact O-N 3.32Å; Q224-L228 VanDerWaalsContact O-CB 3.29Å; Q224-L228 WeakPolarHBondContact O-CB 3.49Å; Q224-L228 PolarHBondContact O-N 2.98Å
225S98.3Very high96.6Very high0 Ų039.9 Ų39.90%019%0.191CC..Hα-helixtrans-65.3-40173.3-55.90000111.7Y210 L213 T221 R223 L228 L229Y210-S225 WeakPolarHBondContact CE1-O 3.36Å; Y210-S225 PolarHBondContact OH-O 3.3Å; L213-S225 WeakPolarHBondContact CB-OG 3.34Å; T221-S225 WeakPolarHBondContact O-CB 3.19Å; T221-S225 PolarHBondContact O-N 3.39Å; T221-S225 PolarHBondContact O-OG 2.96Å; R223-S225 VanDerWaalsContact C-N 3.32Å; R223-S225 PolarHBondContact O-N 3.21Å; S225-L228 PolarHBondContact O-N 2.98Å; S225-L229 WeakPolarHBondContact O-CB 3.41Å; S225-L229 PolarHBondContact O-N 3.14Å
226L98Very high96.7Very high3 Ų346 Ų462%0.01621%0.21CC..Hα-helixtrans-67.6-40.1177.1-165.659.7000112L214 K222 R223 L229 G230 M255 I266 E269 A270 V273L214-L226 HydrophobicContact CD2-CB 4.36Å; L214-L226 HydrophobicContact CD2-CD1 4.05Å; K222-L226 WeakPolarHBondContact O-CB 3.4Å; K222-L226 PolarHBondContact O-N 3.43Å; K222-L226 VanDerWaalsContact O-N 3.1Å; R223-L226 PolarHBondContact O-N 3.25Å; L226-L229 HydrophobicContact CD1-CD2 4.44Å; L226-L229 PolarHBondContact O-N 3.48Å; L226-G230 PolarHBondContact O-N 2.86Å; L226-G230 VanDerWaalsContact O-N 3.12Å; L226-M255 HydrophobicContact CD1-CE 3.87Å; L226-M255 HydrophobicContact CD1-SD 3.84Å; L226-I266 HydrophobicContact CD2-CG2 4.07Å; L226-I266 WeakPolarHBondContact CD2-O 3.25Å; L226-E269 HydrophobicContact CB-CB 4.03Å; L226-E269 HydrophobicContact CD2-CB 3.9Å; L226-E269 HydrophobicContact CG-CB 3.8Å; L226-A270 HydrophobicContact CD2-CB 3.86Å; L226-V273 HydrophobicContact CD1-CG2 4.25Å
227K98.2Very high96.8Very high74 Ų7448.4 Ų48.432%0.32222%0.22SC..Hα-helixtrans-60.9-50.4172.9-178.8171.4179.7170.50111.8R223 Q224 L229 G230 E231 E269R223-K227 PolarHBondContact O-N 3.49Å; Q224-K227 PolarHBondContact O-N 3.32Å; K227-L229 VanDerWaalsContact C-N 3.31Å; K227-L229 PolarHBondContact O-N 3.24Å; K227-G230 PolarHBondContact O-N 3.47Å; K227-G230 VanDerWaalsContact O-N 3.13Å; K227-E231 VanDerWaalsContact CE-OE1 3.31Å; K227-E231 WeakPolarHBondContact CE-OE1 3.33Å; K227-E231 PolarHBondContact O-N 3.24Å; K227-E269 HydrophobicContact CB-CG 4.14Å; K227-E269 WeakPolarHBondContact CB-OE2 3.49Å; K227-E269 WeakPolarHBondContact CG-OE2 3.32Å
228L98.6Very high97.1Very high1 Ų140.9 Ų40.91%0.00519%0.185CC..Hα-helixtrans-62-39.1179.1175.460.2000111.4F181 F184 K185 L188 T189 Y210 Q224 S225 G230 E231 L232F181-L228 HydrophobicContact CE1-CD2 4.32Å; F181-L228 HydrophobicContact CZ-CB 4.2Å; F181-L228 HydrophobicContact CZ-CD2 3.94Å; F184-L228 HydrophobicContact CD1-CD2 4.26Å; F184-L228 HydrophobicContact CE1-CD2 4.23Å; K185-L228 HydrophobicContact CB-CD1 4.48Å; K185-L228 HydrophobicContact CB-CD2 4.23Å; K185-L228 HydrophobicContact CD-CD1 4.35Å; K185-L228 HydrophobicContact CG-CD1 3.99Å; L188-L228 HydrophobicContact CD1-CD2 4.28Å; T189-L228 HydrophobicContact CG2-CD1 3.57Å; Y210-L228 HydrophobicContact CE2-CD2 4.41Å; Y210-L228 VanDerWaalsContact OH-CB 3.3Å; Y210-L228 WeakPolarHBondContact OH-CB 3.43Å; Y210-L228 WeakPolarHBondContact OH-CD2 3.34Å; Y210-L228 VanDerWaalsContact OH-CG 3.28Å; Y210-L228 WeakPolarHBondContact OH-CG 3.33Å; Q224-L228 VanDerWaalsContact O-CB 3.29Å; Q224-L228 WeakPolarHBondContact O-CB 3.49Å; Q224-L228 PolarHBondContact O-N 2.98Å; S225-L228 PolarHBondContact O-N 2.98Å; L228-G230 VanDerWaalsContact C-N 3.32Å; L228-G230 PolarHBondContact O-N 3.25Å; L228-E231 PolarHBondContact O-N 2.69Å; L228-L232 HydrophobicContact CD1-CD1 4.41Å; L228-L232 HydrophobicContact CD1-CG 4.12Å; L228-L232 HydrophobicContact CG-CD1 4.18Å; L228-L232 HydrophobicContact CG-CG 4.36Å; L228-L232 VanDerWaalsContact O-CG 3.29Å; L228-L232 WeakPolarHBondContact O-CG 3.48Å; L228-L232 PolarHBondContact O-N 3.43Å
229L98.6Very high97.3Very high0 Ų044.9 Ų44.90%020%0.2CC..Hα-helixtrans-57.9-45.5173.1179.264.9000111.6F207 Y210 L214 S225 L226 K227 L232 L233 Y245 M255 V273F207-L229 HydrophobicContact CE1-CD1 3.86Å; Y210-L229 HydrophobicContact CE1-CB 3.92Å; Y210-L229 HydrophobicContact CE1-CD1 4.4Å; Y210-L229 PolarHBondContact OH-N 3.46Å; L214-L229 HydrophobicContact CD1-CD2 3.88Å; L214-L229 HydrophobicContact CD2-CD2 4.3Å; S225-L229 WeakPolarHBondContact O-CB 3.41Å; S225-L229 PolarHBondContact O-N 3.14Å; L226-L229 HydrophobicContact CD1-CD2 4.44Å; L226-L229 PolarHBondContact O-N 3.48Å; K227-L229 VanDerWaalsContact C-N 3.31Å; K227-L229 PolarHBondContact O-N 3.24Å; L229-L232 PolarHBondContact O-N 2.89Å; L229-L233 HydrophobicContact CD1-CD1 3.82Å; L229-L233 HydrophobicContact CD1-CG 4.01Å; L229-L233 HydrophobicContact CG-CD1 3.82Å; L229-L233 HydrophobicContact CG-CG 4.35Å; L229-L233 WeakPolarHBondContact O-CB 3.39Å; L229-L233 VanDerWaalsContact O-CG 3.23Å; L229-L233 WeakPolarHBondContact O-CG 3.46Å; L229-L233 PolarHBondContact O-N 3.12Å; L229-Y245 HydrophobicContact CD1-CD2 4.49Å; L229-Y245 HydrophobicContact CD1-CE2 3.98Å; L229-Y245 HydrophobicContact CD2-CE1 4.35Å; L229-Y245 WeakPolarHBondContact CD2-OH 3.16Å; L229-M255 HydrophobicContact CD2-CE 4.42Å; L229-V273 HydrophobicContact CB-CG2 4.47Å; L229-V273 HydrophobicContact CD2-CG1 4.15Å; L229-V273 HydrophobicContact CD2-CG2 4.17Å; L229-V273 HydrophobicContact CG-CG1 4.49Å; L229-V273 HydrophobicContact CG-CG2 4.19Å
230G97.7Very high97.5Very high4 Ų444.9 Ų44.94%0.04121%0.209CC..Hα-helixtrans-58.4-46.7174.400000112.4L226 K227 L228 L232 L233 L234L226-G230 PolarHBondContact O-N 2.86Å; L226-G230 VanDerWaalsContact O-N 3.12Å; K227-G230 PolarHBondContact O-N 3.47Å; K227-G230 VanDerWaalsContact O-N 3.13Å; L228-G230 VanDerWaalsContact C-N 3.32Å; L228-G230 PolarHBondContact O-N 3.25Å; G230-L232 VanDerWaalsContact C-N 3.34Å; G230-L232 PolarHBondContact O-N 2.91Å; G230-L233 PolarHBondContact O-N 3.43Å; G230-L234 WeakPolarHBondContact O-CB 3.41Å; G230-L234 VanDerWaalsContact O-CG 3.28Å; G230-L234 WeakPolarHBondContact O-CG 3.25Å; G230-L234 PolarHBondContact O-N 2.93Å
231E97.8Very high97.6Very high67 Ų6742.9 Ų42.931%0.31320%0.197SC..Hα-helixtrans-59.2-43176-67.5174.9-161.800112.1K185 K227 L228 D235K185-E231 WeakPolarHBondContact CE-OE2 3.32Å; K185-E231 IonicContact NZ-OE1 3.99Å; K185-E231 PolarHBondContact NZ-OE1 2.91Å; K185-E231 IonicContact NZ-OE2 2.81Å; K185-E231 PolarHBondContact NZ-OE2 3.07Å; K227-E231 VanDerWaalsContact CE-OE1 3.31Å; K227-E231 WeakPolarHBondContact CE-OE1 3.33Å; K227-E231 PolarHBondContact O-N 3.24Å; L228-E231 PolarHBondContact O-N 2.69Å; E231-D235 PolarHBondContact O-N 3.44Å
232L98.3Very high97.7Very high6 Ų643.9 Ų43.93%0.03120%0.201CC..Hα-helixtrans-66.6-44.1179.6-71.2175000112.2L188 T189 L199 Y210 L228 L229 G230 D235 N238L188-L232 HydrophobicContact CB-CD2 4.34Å; L188-L232 WeakPolarHBondContact O-CD2 3.41Å; T189-L232 HydrophobicContact CG2-CD2 4.22Å; L199-L232 HydrophobicContact CD1-CD2 4.24Å; Y210-L232 HydrophobicContact CE2-CD1 4.42Å; L228-L232 HydrophobicContact CD1-CD1 4.41Å; L228-L232 HydrophobicContact CD1-CG 4.12Å; L228-L232 HydrophobicContact CG-CD1 4.18Å; L228-L232 HydrophobicContact CG-CG 4.36Å; L228-L232 VanDerWaalsContact O-CG 3.29Å; L228-L232 WeakPolarHBondContact O-CG 3.48Å; L228-L232 PolarHBondContact O-N 3.43Å; L229-L232 PolarHBondContact O-N 2.89Å; G230-L232 VanDerWaalsContact C-N 3.34Å; G230-L232 PolarHBondContact O-N 2.91Å; L232-D235 PolarHBondContact O-N 3.43Å; L232-N238 VanDerWaalsContact O-CB 3.24Å; L232-N238 WeakPolarHBondContact O-CB 3.36Å; L232-N238 PolarHBondContact O-ND2 2.83Å
233L97.6Very high97.7Very high2 Ų246.2 Ų46.21%0.0122%0.216CC..Hα-helixtrans-72.8-29.3-177.4-66.3174.7000112.6L229 G230 M242 Y245 V273L229-L233 HydrophobicContact CD1-CD1 3.82Å; L229-L233 HydrophobicContact CD1-CG 4.01Å; L229-L233 HydrophobicContact CG-CD1 3.82Å; L229-L233 HydrophobicContact CG-CG 4.35Å; L229-L233 WeakPolarHBondContact O-CB 3.39Å; L229-L233 VanDerWaalsContact O-CG 3.23Å; L229-L233 WeakPolarHBondContact O-CG 3.46Å; L229-L233 PolarHBondContact O-N 3.12Å; G230-L233 PolarHBondContact O-N 3.43Å; L233-M242 HydrophobicContact CB-CG 4.17Å; L233-M242 HydrophobicContact CD2-CB 4.17Å; L233-M242 HydrophobicContact CD2-CG 4.32Å; L233-M242 WeakPolarHBondContact O-CB 3.41Å; L233-M242 WeakPolarHBondContact O-CG 3.01Å; L233-Y245 HydrophobicContact CD1-CD1 3.73Å; L233-Y245 HydrophobicContact CD1-CE1 3.94Å; L233-Y245 HydrophobicContact CD1-CG 4.27Å; L233-Y245 HydrophobicContact CD2-CD1 4.04Å; L233-Y245 HydrophobicContact CD2-CD2 4.38Å; L233-Y245 HydrophobicContact CD2-CG 3.78Å; L233-V273 HydrophobicContact CD1-CG1 3.75Å
234L96.1Very high97.7Very high91 Ų9148.1 Ų48.148%0.47622%0.224SC..Hα-helixtrans-85.3-9.6178.3-68.8170.3000113.2G230 R236 V276G230-L234 WeakPolarHBondContact O-CB 3.41Å; G230-L234 VanDerWaalsContact O-CG 3.28Å; G230-L234 WeakPolarHBondContact O-CG 3.25Å; G230-L234 PolarHBondContact O-N 2.93Å; L234-R236 PolarHBondContact O-N 3.04Å; L234-V276 HydrophobicContact CD2-CG2 3.71Å; L234-V276 HydrophobicContact CG-CG2 4.24Å
235D97.5Very high97.8Very high27 Ų2746 Ų4614%0.14421%0.214CC..SBendtrans-72.2126.4176-162.3-56.6000110.8K192 E231 L232 H237 N238K192-D235 VanDerWaalsContact CD-OD2 3.26Å; K192-D235 WeakPolarHBondContact CD-OD2 3.28Å; K192-D235 WeakPolarHBondContact CE-OD2 3.42Å; K192-D235 IonicContact NZ-OD2 3.54Å; K192-D235 PolarHBondContact NZ-OD2 2.96Å; E231-D235 PolarHBondContact O-N 3.44Å; L232-D235 PolarHBondContact O-N 3.43Å; D235-H237 PolarHBondContact O-N 3.41Å; D235-H237 VanDerWaalsContact O-N 3.13Å; D235-H237 IonicContact OD1-CE1 3.88Å; D235-H237 IonicContact OD1-CG 3.55Å; D235-H237 PolarHBondContact OD1-N 3.43Å; D235-H237 IonicContact OD1-ND1 2.78Å; D235-H237 PolarHBondContact OD1-ND1 2.97Å; D235-N238 HydrophobicContact CB-CB 4.49Å; D235-N238 PolarHBondContact O-N 2.86Å
236R97Very high97.7Very high208 Ų20846.2 Ų46.279%0.78522%0.215SC*.G310 helixtrans-58.1-28.5-178.370.1-179-173.8-172.5-1.1114L234 N238L234-R236 PolarHBondContact O-N 3.04Å; R236-N238 PolarHBondContact O-N 3.26Å
237H98.3Very high97.6Very high63 Ų6347.7 Ų47.729%0.29223%0.226SC..G310 helixtrans-73.3-23.3179.5-54.486.1000111.4K192 A196 D235 F239K192-H237 HydrophobicContact CB-CB 4.42Å; A196-H237 HydrophobicContact CB-CB 3.96Å; A196-H237 VanDerWaalsContact CB-O 3.3Å; A196-H237 WeakPolarHBondContact CB-O 3.29Å; D235-H237 PolarHBondContact O-N 3.41Å; D235-H237 VanDerWaalsContact O-N 3.13Å; D235-H237 IonicContact OD1-CE1 3.88Å; D235-H237 IonicContact OD1-CG 3.55Å; D235-H237 PolarHBondContact OD1-N 3.43Å; D235-H237 IonicContact OD1-ND1 2.78Å; D235-H237 PolarHBondContact OD1-ND1 2.97Å; H237-F239 VanDerWaalsContact C-N 3.31Å; H237-F239 PolarHBondContact O-N 3.3Å
238N98.1Very high97.6Very high4 Ų447 Ų472%0.02122%0.223CC..G310 helixtrans-93.321.8-179.2-65.9-24.9000112.3A196 L232 D235 R236 T240 V241 M242A196-N238 WeakPolarHBondContact CA-OD1 3.29Å; A196-N238 WeakPolarHBondContact CB-OD1 3.45Å; L232-N238 VanDerWaalsContact O-CB 3.24Å; L232-N238 WeakPolarHBondContact O-CB 3.36Å; L232-N238 PolarHBondContact O-ND2 2.83Å; D235-N238 HydrophobicContact CB-CB 4.49Å; D235-N238 PolarHBondContact O-N 2.86Å; R236-N238 PolarHBondContact O-N 3.26Å; N238-T240 VanDerWaalsContact C-N 3.3Å; N238-T240 PolarHBondContact O-N 3.44Å; N238-V241 HydrophobicContact CB-CB 4.33Å; N238-V241 WeakPolarHBondContact O-CB 3.29Å; N238-V241 PolarHBondContact O-N 2.71Å; N238-V241 VanDerWaalsContact O-N 3.15Å; N238-M242 WeakPolarHBondContact O-CB 3.43Å; N238-M242 PolarHBondContact O-N 2.58Å
239F97.1Very high97.5Very high134 Ų13448.9 Ų48.959%0.58824%0.235SC*.Hα-helixtrans-55.4-42.1-175.4178.6-97.2000113H237 M242 T243H237-F239 VanDerWaalsContact C-N 3.31Å; H237-F239 PolarHBondContact O-N 3.3Å; F239-M242 HydrophobicContact CD2-CE 3.7Å; F239-M242 HydrophobicContact CE2-CE 3.81Å; F239-M242 PolarHBondContact O-N 3.33Å; F239-T243 WeakPolarHBondContact O-CB 3.47Å; F239-T243 PolarHBondContact O-N 3.14Å; F239-T243 PolarHBondContact O-OG1 3.36Å
240T97.4Very high97.4Very high80 Ų8054.3 Ų54.349%0.49126%0.26SS..Hα-helixtrans-63.3-49.3177.1-42.20000111.3E200 N238 M242 T243 Y244E200-T240 HydrophobicContact CG-CG2 4.41Å; E200-T240 WeakPolarHBondContact OE1-CB 3.42Å; E200-T240 PolarHBondContact OE1-OG1 2.97Å; N238-T240 VanDerWaalsContact C-N 3.3Å; N238-T240 PolarHBondContact O-N 3.44Å; T240-M242 VanDerWaalsContact C-N 3.34Å; T240-M242 PolarHBondContact O-N 3.35Å; T240-T243 PolarHBondContact O-N 3.01Å; T240-Y244 PolarHBondContact O-N 3.48Å
241V98.1Very high97.4Very high4 Ų454.8 Ų54.82%0.02426%0.262CS..Hα-helixtrans-58.9-46.5177.5175.30000110.5L199 E200 Y203 F207 N238 Y244 Y245L199-V241 HydrophobicContact CB-CG2 3.83Å; E200-V241 HydrophobicContact CB-CG2 4.42Å; E200-V241 HydrophobicContact CG-CG2 3.57Å; Y203-V241 HydrophobicContact CD2-CG1 3.96Å; Y203-V241 HydrophobicContact CE2-CG1 3.8Å; F207-V241 HydrophobicContact CE2-CG1 3.55Å; F207-V241 HydrophobicContact CZ-CG1 3.64Å; N238-V241 HydrophobicContact CB-CB 4.33Å; N238-V241 WeakPolarHBondContact O-CB 3.29Å; N238-V241 PolarHBondContact O-N 2.71Å; N238-V241 VanDerWaalsContact O-N 3.15Å; V241-Y244 PolarHBondContact O-N 2.84Å; V241-Y245 WeakPolarHBondContact O-CB 3.38Å; V241-Y245 PolarHBondContact O-N 2.77Å
242M97.8Very high97.3Very high29 Ų2951.6 Ų51.614%0.14325%0.248CC..Hα-helixtrans-59.6-50.9177.5179.9-150.56200111.1L233 N238 F239 T240 Y244 Y245 I246 V276L233-M242 HydrophobicContact CB-CG 4.17Å; L233-M242 HydrophobicContact CD2-CB 4.17Å; L233-M242 HydrophobicContact CD2-CG 4.32Å; L233-M242 WeakPolarHBondContact O-CB 3.41Å; L233-M242 WeakPolarHBondContact O-CG 3.01Å; N238-M242 WeakPolarHBondContact O-CB 3.43Å; N238-M242 PolarHBondContact O-N 2.58Å; F239-M242 HydrophobicContact CD2-CE 3.7Å; F239-M242 HydrophobicContact CE2-CE 3.81Å; F239-M242 PolarHBondContact O-N 3.33Å; T240-M242 VanDerWaalsContact C-N 3.34Å; T240-M242 PolarHBondContact O-N 3.35Å; M242-Y244 VanDerWaalsContact C-N 3.28Å; M242-Y244 PolarHBondContact O-N 3.28Å; M242-Y245 PolarHBondContact O-N 3.43Å; M242-Y245 VanDerWaalsContact O-N 3.14Å; M242-I246 HydrophobicContact CE-CD1 4.34Å; M242-I246 HydrophobicContact CG-CD1 4.45Å; M242-I246 WeakPolarHBondContact O-CG1 3.22Å; M242-I246 PolarHBondContact O-N 3.03Å; M242-V276 HydrophobicContact CG-CG1 3.77Å; M242-V276 HydrophobicContact SD-CG1 3.55Å; M242-V276 VanDerWaalsContact SD-CG1 3.55Å
243T97.2Very high97.3Very high56 Ų5655.6 Ų55.634%0.34426%0.264SS..Hα-helixtrans-58.8-42.1-179.1-59.50000111F239 T240 S247F239-T243 WeakPolarHBondContact O-CB 3.47Å; F239-T243 PolarHBondContact O-N 3.14Å; F239-T243 PolarHBondContact O-OG1 3.36Å; T240-T243 PolarHBondContact O-N 3.01Å; T243-S247 WeakPolarHBondContact O-CB 3.24Å; T243-S247 PolarHBondContact O-N 2.86Å
244Y97.4Very high97.2Very high105 Ų10556.1 Ų56.141%0.41227%0.267SS..Hα-helixtrans-67.7-43.4175.6-172.2-126000112Y203 T240 V241 M242 I246 S247 K248Y203-Y244 AromaticContact CD1-CD1 3.59Å; Y203-Y244 HydrophobicContact CD1-CD1 3.59Å; Y203-Y244 AromaticContact CD1-CE1 3.38Å; Y203-Y244 HydrophobicContact CD1-CE1 3.38Å; Y203-Y244 AromaticContact CD2-CD1 3.73Å; Y203-Y244 HydrophobicContact CD2-CD1 3.73Å; Y203-Y244 HydrophobicContact CD2-CE1 4.36Å; Y203-Y244 AromaticContact CE1-CD1 3.43Å; Y203-Y244 HydrophobicContact CE1-CD1 3.43Å; Y203-Y244 VanDerWaalsContact CE1-CD1 3.43Å; Y203-Y244 AromaticContact CE1-CE1 3.38Å; Y203-Y244 HydrophobicContact CE1-CE1 3.38Å; Y203-Y244 AromaticContact CE2-CD1 3.52Å; Y203-Y244 HydrophobicContact CE2-CD1 3.52Å; Y203-Y244 HydrophobicContact CE2-CE1 4.32Å; Y203-Y244 HydrophobicContact CE2-CG 4.42Å; Y203-Y244 AromaticContact CG-CD1 3.76Å; Y203-Y244 HydrophobicContact CG-CD1 3.76Å; Y203-Y244 AromaticContact CG-CE1 3.92Å; Y203-Y244 HydrophobicContact CG-CE1 3.92Å; Y203-Y244 AromaticContact CZ-CD1 3.37Å; Y203-Y244 AromaticContact CZ-CE1 3.86Å; T240-Y244 PolarHBondContact O-N 3.48Å; V241-Y244 PolarHBondContact O-N 2.84Å; M242-Y244 VanDerWaalsContact C-N 3.28Å; M242-Y244 PolarHBondContact O-N 3.28Å; Y244-I246 PolarHBondContact O-N 2.95Å; Y244-S247 WeakPolarHBondContact O-CB 3.38Å; Y244-S247 PolarHBondContact O-N 3.41Å; Y244-S247 PolarHBondContact O-OG 2.89Å; Y244-K248 VanDerWaalsContact CZ-CE 3.42Å; Y244-K248 PolarHBondContact OH-NZ 3.22Å
245Y97.9Very high97.3Very high9 Ų951.8 Ų51.84%0.03525%0.245CC..Hα-helixtrans-59.5-46.3178.8-170.5-83000112.7Y203 F207 L229 L233 V241 M242 S247 K248 T251 V273 F277Y203-Y245 WeakPolarHBondContact OH-CA 3.45Å; Y203-Y245 WeakPolarHBondContact OH-CB 3.34Å; Y203-Y245 VanDerWaalsContact OH-CD2 3.24Å; Y203-Y245 WeakPolarHBondContact OH-CD2 3.41Å; F207-Y245 AromaticContact CD1-CD2 3.76Å; F207-Y245 HydrophobicContact CD1-CD2 3.76Å; F207-Y245 AromaticContact CD1-CE2 3.72Å; F207-Y245 HydrophobicContact CD1-CE2 3.72Å; F207-Y245 AromaticContact CE1-CD2 3.73Å; F207-Y245 HydrophobicContact CE1-CD2 3.73Å; F207-Y245 AromaticContact CE1-CE2 3.91Å; F207-Y245 HydrophobicContact CE1-CE2 3.91Å; F207-Y245 HydrophobicContact CG-CD2 4.47Å; F207-Y245 HydrophobicContact CZ-CD2 4.45Å; L229-Y245 HydrophobicContact CD1-CD2 4.49Å; L229-Y245 HydrophobicContact CD1-CE2 3.98Å; L229-Y245 HydrophobicContact CD2-CE1 4.35Å; L229-Y245 WeakPolarHBondContact CD2-OH 3.16Å; L233-Y245 HydrophobicContact CD1-CD1 3.73Å; L233-Y245 HydrophobicContact CD1-CE1 3.94Å; L233-Y245 HydrophobicContact CD1-CG 4.27Å; L233-Y245 HydrophobicContact CD2-CD1 4.04Å; L233-Y245 HydrophobicContact CD2-CD2 4.38Å; L233-Y245 HydrophobicContact CD2-CG 3.78Å; V241-Y245 WeakPolarHBondContact O-CB 3.38Å; V241-Y245 PolarHBondContact O-N 2.77Å; M242-Y245 PolarHBondContact O-N 3.43Å; M242-Y245 VanDerWaalsContact O-N 3.14Å; Y245-S247 PolarHBondContact O-N 3.1Å; Y245-K248 PolarHBondContact O-N 3.42Å; Y245-T251 HydrophobicContact CD1-CG2 4.41Å; Y245-T251 HydrophobicContact CD2-CG2 4.46Å; Y245-T251 HydrophobicContact CE1-CG2 3.97Å; Y245-T251 HydrophobicContact CE2-CG2 4Å; Y245-T251 PolarHBondContact O-OG1 3.48Å; Y245-V273 HydrophobicContact CE1-CG1 4.44Å; Y245-F277 HydrophobicContact CD1-CE2 4.42Å; Y245-F277 HydrophobicContact CD1-CZ 4.07Å; Y245-F277 HydrophobicContact CE1-CE2 4.27Å; Y245-F277 HydrophobicContact CE1-CZ 4.03Å
246I97Very high97.2Very high3 Ų351.9 Ų51.92%0.01525%0.245CC..Hα-helixtrans-79.1-6-17771.7-172.1000114M242 Y244 V276 F277 N280M242-I246 HydrophobicContact CE-CD1 4.34Å; M242-I246 HydrophobicContact CG-CD1 4.45Å; M242-I246 WeakPolarHBondContact O-CG1 3.22Å; M242-I246 PolarHBondContact O-N 3.03Å; Y244-I246 PolarHBondContact O-N 2.95Å; I246-V276 HydrophobicContact CD1-CG1 4.17Å; I246-V276 HydrophobicContact CG2-CB 4.33Å; I246-V276 HydrophobicContact CG2-CG1 3.93Å; I246-F277 HydrophobicContact CB-CD1 3.79Å; I246-F277 HydrophobicContact CB-CD2 4.44Å; I246-F277 HydrophobicContact CB-CE1 3.84Å; I246-F277 HydrophobicContact CB-CE2 4.45Å; I246-F277 HydrophobicContact CB-CG 4.12Å; I246-F277 HydrophobicContact CB-CZ 4.16Å; I246-F277 HydrophobicContact CG2-CD1 4.25Å; I246-F277 HydrophobicContact CG2-CD2 4.01Å; I246-F277 HydrophobicContact CG2-CE1 4.2Å; I246-F277 HydrophobicContact CG2-CE2 3.91Å; I246-F277 HydrophobicContact CG2-CG 4.17Å; I246-F277 HydrophobicContact CG2-CZ 4.01Å; I246-F277 WeakPolarHBondContact O-CD1 3.45Å; I246-F277 WeakPolarHBondContact O-CE1 3.34Å; I246-N280 HydrophobicContact CD1-CB 3.76Å
247S96.9Very high97.2Very high35 Ų3546.7 Ų46.725%0.24523%0.233CC..Hα-helixtrans-79.5-19.8175.277.90000113.2T243 Y244 Y245 T284T243-S247 WeakPolarHBondContact O-CB 3.24Å; T243-S247 PolarHBondContact O-N 2.86Å; Y244-S247 WeakPolarHBondContact O-CB 3.38Å; Y244-S247 PolarHBondContact O-N 3.41Å; Y244-S247 PolarHBondContact O-OG 2.89Å; Y245-S247 PolarHBondContact O-N 3.1Å; S247-T284 PolarHBondContact O-OG1 3.16Å
248K96.9Very high97.1Very high60 Ų6045.5 Ų45.526%0.26123%0.226SC..  trans-85.6124.5-173.1-62.9-171-178-170.10111.5D204 Y244 Y245 E250 T251 L252D204-K248 IonicContact OD1-NZ 3.44Å; Y244-K248 VanDerWaalsContact CZ-CE 3.42Å; Y244-K248 PolarHBondContact OH-NZ 3.22Å; Y245-K248 PolarHBondContact O-N 3.42Å; K248-E250 VanDerWaalsContact C-N 3.32Å; K248-E250 PolarHBondContact O-N 3.07Å; K248-T251 HydrophobicContact CB-CG2 4.06Å; K248-T251 PolarHBondContact O-N 3.47Å; K248-T251 PolarHBondContact O-OG1 3.15Å; K248-L252 PolarHBondContact O-N 2.91Å
249P97.3Very high97Very high40 Ų4045.4 Ų45.426%0.2623%0.225SC..Hα-helixtrans-61.1-35.8179.4-30.339.6000114.8L252 K253 P286 I290P249-L252 PolarHBondContact O-N 3.14Å; P249-K253 WeakPolarHBondContact O-CG 3.29Å; P249-K253 PolarHBondContact O-N 3.09Å; P249-P286 HydrophobicContact CG-CB 3.53Å; P249-P286 HydrophobicContact CG-CG 4.46Å; P249-I290 HydrophobicContact CB-CD1 3.82Å
250E96.6Very high96.9Very high113 Ų11348 Ų4853%0.52823%0.231SC..Hα-helixtrans-68-36-177.9-59.9-48.4125.300112.2K248 L252 K253 L254K248-E250 VanDerWaalsContact C-N 3.32Å; K248-E250 PolarHBondContact O-N 3.07Å; E250-L252 PolarHBondContact O-N 2.85Å; E250-K253 PolarHBondContact O-N 3.22Å; E250-K253 IonicContact OE1-NZ 2.72Å; E250-K253 PolarHBondContact OE1-NZ 3.22Å; E250-K253 IonicContact OE2-NZ 3.76Å; E250-L254 WeakPolarHBondContact O-CB 3.25Å; E250-L254 PolarHBondContact O-N 3.48Å
251T96.2Very high96.8Very high15 Ų1544.8 Ų44.89%0.09221%0.211CC..Hα-helixtrans-66.2-39.7176.158.40000110.9Y245 K248 L254 M255 F277Y245-T251 HydrophobicContact CD1-CG2 4.41Å; Y245-T251 HydrophobicContact CD2-CG2 4.46Å; Y245-T251 HydrophobicContact CE1-CG2 3.97Å; Y245-T251 HydrophobicContact CE2-CG2 4Å; Y245-T251 PolarHBondContact O-OG1 3.48Å; K248-T251 HydrophobicContact CB-CG2 4.06Å; K248-T251 PolarHBondContact O-N 3.47Å; K248-T251 PolarHBondContact O-OG1 3.15Å; T251-L254 WeakPolarHBondContact O-CB 3.33Å; T251-L254 PolarHBondContact O-N 2.9Å; T251-M255 WeakPolarHBondContact O-CG 3.21Å; T251-M255 PolarHBondContact O-N 2.81Å; T251-F277 WeakPolarHBondContact OG1-CE1 3.43Å; T251-F277 VanDerWaalsContact OG1-CZ 3.31Å; T251-F277 WeakPolarHBondContact OG1-CZ 3.47Å
252L97.6Very high96.6Very high0 Ų054.3 Ų54.30%025%0.252CS..Hα-helixtrans-62-47.8172.917759.5000112K248 P249 E250 L254 M255 I256 F274 F277 I287 I290 L291K248-L252 PolarHBondContact O-N 2.91Å; P249-L252 PolarHBondContact O-N 3.14Å; E250-L252 PolarHBondContact O-N 2.85Å; L252-L254 VanDerWaalsContact C-N 3.28Å; L252-L254 PolarHBondContact O-N 3.36Å; L252-M255 PolarHBondContact O-N 2.85Å; L252-I256 HydrophobicContact CD1-CD1 3.9Å; L252-I256 HydrophobicContact CD1-CG1 4.1Å; L252-I256 HydrophobicContact CD2-CD1 4.48Å; L252-I256 HydrophobicContact CG-CD1 3.87Å; L252-I256 HydrophobicContact CG-CG1 4.45Å; L252-I256 WeakPolarHBondContact O-CG1 3.3Å; L252-I256 PolarHBondContact O-N 2.85Å; L252-F274 HydrophobicContact CD1-CD2 3.94Å; L252-F274 HydrophobicContact CD1-CE2 3.9Å; L252-F277 HydrophobicContact CB-CD1 3.82Å; L252-F277 HydrophobicContact CB-CE1 3.67Å; L252-F277 HydrophobicContact CB-CZ 4.36Å; L252-F277 HydrophobicContact CD1-CB 4.03Å; L252-F277 HydrophobicContact CD1-CD1 3.93Å; L252-F277 HydrophobicContact CD1-CD2 4.46Å; L252-F277 HydrophobicContact CD1-CE1 4.48Å; L252-F277 HydrophobicContact CD1-CG 3.9Å; L252-F277 HydrophobicContact CG-CD1 4.32Å; L252-I287 HydrophobicContact CB-CD1 3.81Å; L252-I287 HydrophobicContact CD2-CD1 3.8Å; L252-I287 HydrophobicContact CD2-CG2 4.12Å; L252-I287 HydrophobicContact CG-CD1 4.45Å; L252-I290 HydrophobicContact CD2-CB 3.92Å; L252-I290 HydrophobicContact CD2-CD1 4.36Å; L252-I290 HydrophobicContact CD2-CG2 3.63Å; L252-I290 HydrophobicContact CG-CG2 4.24Å; L252-L291 HydrophobicContact CD1-CD2 4.41Å; L252-L291 HydrophobicContact CD2-CD2 4.21Å; L252-L291 HydrophobicContact CD2-CG 4.23Å
253K96.9Very high96.5Very high89 Ų8957.3 Ų57.339%0.38726%0.262SS..Hα-helixtrans-59-42177.8-70.9172.5-170.5167.30111.3P249 E250 I256 N257 I290P249-K253 WeakPolarHBondContact O-CG 3.29Å; P249-K253 PolarHBondContact O-N 3.09Å; E250-K253 PolarHBondContact O-N 3.22Å; E250-K253 IonicContact OE1-NZ 2.72Å; E250-K253 PolarHBondContact OE1-NZ 3.22Å; E250-K253 IonicContact OE2-NZ 3.76Å; K253-I256 PolarHBondContact O-N 3.09Å; K253-N257 WeakPolarHBondContact O-CB 3.27Å; K253-N257 VanDerWaalsContact O-CG 3.28Å; K253-N257 PolarHBondContact O-N 3.04Å; K253-N257 PolarHBondContact O-ND2 2.97Å; K253-I290 HydrophobicContact CG-CD1 4.32Å
254L96.8Very high96.3Very high14 Ų1457.4 Ų57.47%0.07327%0.265CS..Hα-helixtrans-58.2-48.8175.1-179.862.6000110.9L214 H215 E250 T251 L252 I256 N257 R258L214-L254 HydrophobicContact CB-CD2 4.22Å; L214-L254 HydrophobicContact CD1-CD2 3.76Å; H215-L254 WeakPolarHBondContact NE2-CD1 3.3Å; E250-L254 WeakPolarHBondContact O-CB 3.25Å; E250-L254 PolarHBondContact O-N 3.48Å; T251-L254 WeakPolarHBondContact O-CB 3.33Å; T251-L254 PolarHBondContact O-N 2.9Å; L252-L254 VanDerWaalsContact C-N 3.28Å; L252-L254 PolarHBondContact O-N 3.36Å; L254-I256 PolarHBondContact O-N 3.31Å; L254-N257 PolarHBondContact O-N 3.37Å; L254-R258 HydrophobicContact CD1-CG 4.35Å; L254-R258 VanDerWaalsContact O-CG 3.26Å; L254-R258 WeakPolarHBondContact O-CG 3.15Å; L254-R258 PolarHBondContact O-N 3.37Å
255M97.7Very high96.2Very high0 Ų055 Ų550%026%0.259CS..Hα-helixtrans-63.2-41.7179-65.9-5610600112.6L214 L226 L229 T251 L252 N257 R258 L259 V273 F274 F277L214-M255 HydrophobicContact CD1-CE 4.33Å; L226-M255 HydrophobicContact CD1-CE 3.87Å; L226-M255 HydrophobicContact CD1-SD 3.84Å; L229-M255 HydrophobicContact CD2-CE 4.42Å; T251-M255 WeakPolarHBondContact O-CG 3.21Å; T251-M255 PolarHBondContact O-N 2.81Å; L252-M255 PolarHBondContact O-N 2.85Å; M255-N257 VanDerWaalsContact C-N 3.31Å; M255-N257 PolarHBondContact O-N 2.73Å; M255-R258 PolarHBondContact O-N 3.18Å; M255-R258 VanDerWaalsContact O-N 3.14Å; M255-L259 WeakPolarHBondContact O-CG 3.35Å; M255-L259 PolarHBondContact O-N 3.31Å; M255-V273 HydrophobicContact CG-CB 4.2Å; M255-V273 HydrophobicContact CG-CG1 3.72Å; M255-V273 HydrophobicContact SD-CB 3.51Å; M255-V273 VanDerWaalsContact SD-CB 3.51Å; M255-V273 HydrophobicContact SD-CG1 3.39Å; M255-V273 WeakPolarHBondContact SD-CG1 3.49Å; M255-V273 HydrophobicContact SD-CG2 4.18Å; M255-F274 HydrophobicContact CB-CB 4.35Å; M255-F277 HydrophobicContact CG-CE2 4.09Å
256I96Very high96.2Very high29 Ų2954.5 Ų54.515%0.14926%0.257CS..Hα-helixtrans-62-39.3175.4-68.4171.4000111.3L252 K253 L254 F274 I290L252-I256 HydrophobicContact CD1-CD1 3.9Å; L252-I256 HydrophobicContact CD1-CG1 4.1Å; L252-I256 HydrophobicContact CD2-CD1 4.48Å; L252-I256 HydrophobicContact CG-CD1 3.87Å; L252-I256 HydrophobicContact CG-CG1 4.45Å; L252-I256 WeakPolarHBondContact O-CG1 3.3Å; L252-I256 PolarHBondContact O-N 2.85Å; K253-I256 PolarHBondContact O-N 3.09Å; L254-I256 PolarHBondContact O-N 3.31Å; I256-F274 HydrophobicContact CD1-CE2 4.3Å; I256-F274 HydrophobicContact CG1-CD2 4.08Å; I256-F274 HydrophobicContact CG1-CE2 3.8Å; I256-I290 HydrophobicContact CD1-CG2 4.07Å
257N95.6Very high96.2Very high99 Ų9956.2 Ų56.253%0.52927%0.265SS..Hα-helixtrans-67.1-38.2174.8-71.8-25.3000111.7K253 L254 M255 R260K253-N257 WeakPolarHBondContact O-CB 3.27Å; K253-N257 VanDerWaalsContact O-CG 3.28Å; K253-N257 PolarHBondContact O-N 3.04Å; K253-N257 PolarHBondContact O-ND2 2.97Å; L254-N257 PolarHBondContact O-N 3.37Å; M255-N257 VanDerWaalsContact C-N 3.31Å; M255-N257 PolarHBondContact O-N 2.73Å; N257-R260 PolarHBondContact O-N 2.73Å; N257-R260 VanDerWaalsContact O-N 3.1Å
258R96.1Very high96.2Very high38 Ų3855.6 Ų55.614%0.14326%0.258CS..Hα-helixtrans-69.7-30.5178.1-67.5-72.5168.2-115-9.9113.1L214 H215 L254 M255 R260 D261 A270L214-R258 PolarHBondContact O-NE 3.17Å; L214-R258 PolarHBondContact O-NH2 2.84Å; H215-R258 PolarHBondContact CD2-NH2 3.2Å; L254-R258 HydrophobicContact CD1-CG 4.35Å; L254-R258 VanDerWaalsContact O-CG 3.26Å; L254-R258 WeakPolarHBondContact O-CG 3.15Å; L254-R258 PolarHBondContact O-N 3.37Å; M255-R258 PolarHBondContact O-N 3.18Å; M255-R258 VanDerWaalsContact O-N 3.14Å; R258-R260 PolarHBondContact O-N 3.06Å; R258-R260 VanDerWaalsContact O-N 3.15Å; R258-D261 IonicContact NH1-OD2 3.98Å; R258-D261 WeakPolarHBondContact O-CB 3.46Å; R258-D261 PolarHBondContact O-N 2.91Å; R258-A270 HydrophobicContact CB-CB 3.56Å
259L96.3Very high96.2Very high2 Ų253.5 Ų53.51%0.0125%0.249CC..Hα-helixtrans-57.6-24.5168.6-76.1173.7000112.9M255 Q267 A270 F271 F274 F301 F305M255-L259 WeakPolarHBondContact O-CG 3.35Å; M255-L259 PolarHBondContact O-N 3.31Å; L259-Q267 WeakPolarHBondContact O-CG 3.4Å; L259-A270 HydrophobicContact CD2-CB 4.27Å; L259-A270 HydrophobicContact CG-CB 4.36Å; L259-F271 HydrophobicContact CD2-CB 3.85Å; L259-F274 HydrophobicContact CD1-CB 4.14Å; L259-F274 HydrophobicContact CD1-CD1 3.92Å; L259-F274 HydrophobicContact CD1-CD2 4.03Å; L259-F274 HydrophobicContact CD1-CE1 4.34Å; L259-F274 HydrophobicContact CD1-CE2 4.43Å; L259-F274 HydrophobicContact CD1-CG 3.75Å; L259-F301 HydrophobicContact CB-CE1 4.04Å; L259-F301 HydrophobicContact CB-CZ 4.15Å; L259-F301 HydrophobicContact CD1-CE1 4.46Å; L259-F301 WeakPolarHBondContact O-CZ 3.49Å; L259-F305 HydrophobicContact CD2-CE1 4.42Å; L259-F305 HydrophobicContact CD2-CE2 4.3Å; L259-F305 HydrophobicContact CD2-CZ 3.95Å
260R95Very high96.2Very high187 Ų18751.6 Ų51.671%0.70624%0.236SC*.THydrogen-bonded Turntrans-101.311.7178.7-58.8179.566.1-163.90.1113.4N257 R258 F301N257-R260 PolarHBondContact O-N 2.73Å; N257-R260 VanDerWaalsContact O-N 3.1Å; R258-R260 PolarHBondContact O-N 3.06Å; R258-R260 VanDerWaalsContact O-N 3.15Å; R260-F301 HydrophobicContact CG-CE2 4.3Å
261D95.6Very high96.3Very high14 Ų1446.2 Ų46.28%0.07521%0.211CC..  trans-60152176.3-163.5-74.7000110.7R258 R263 I266 Q267R258-D261 IonicContact NH1-OD2 3.98Å; R258-D261 WeakPolarHBondContact O-CB 3.46Å; R258-D261 PolarHBondContact O-N 2.91Å; D261-R263 PolarHBondContact O-N 2.87Å; D261-R263 IonicContact OD1-CZ 2.81Å; D261-R263 PolarHBondContact OD1-N 2.93Å; D261-R263 IonicContact OD1-NE 2.9Å; D261-R263 PolarHBondContact OD1-NE 3.33Å; D261-R263 IonicContact OD1-NH2 3.99Å; D261-R263 PolarHBondContact OD1-NH2 3.25Å; D261-R263 IonicContact OD2-NH2 2.78Å; D261-I266 HydrophobicContact CB-CB 4.11Å; D261-I266 HydrophobicContact CB-CG2 3.78Å; D261-Q267 HydrophobicContact CB-CG 4.37Å; D261-Q267 WeakPolarHBondContact O-CG 3.14Å; D261-Q267 PolarHBondContact O-NE2 3.21Å
262K93.6Very high96.2Very high204 Ų20447.3 Ų47.389%0.88722%0.215SC*.SBendtrans-64.7-22.4178.3-62.3-178-178.6179.70112.9
263R95.4Very high96.2Very high92 Ų9247.3 Ų47.335%0.34722%0.215SC..SBendtrans-99.6116.1-172.3-68.9151.4-85.3-153.2-7.2110.7Y219 D261 N265 I266 Q267Y219-R263 HydrophobicContact CE2-CB 4.32Å; Y219-R263 HydrophobicContact CE2-CG 4.43Å; D261-R263 PolarHBondContact O-N 2.87Å; D261-R263 IonicContact OD1-CZ 2.81Å; D261-R263 PolarHBondContact OD1-N 2.93Å; D261-R263 IonicContact OD1-NE 2.9Å; D261-R263 PolarHBondContact OD1-NE 3.33Å; D261-R263 IonicContact OD1-NH2 3.99Å; D261-R263 PolarHBondContact OD1-NH2 3.25Å; D261-R263 IonicContact OD2-NH2 2.78Å; R263-N265 VanDerWaalsContact C-N 3.28Å; R263-N265 PolarHBondContact O-N 3.22Å; R263-I266 HydrophobicContact CB-CB 4.3Å; R263-I266 HydrophobicContact CB-CG1 3.9Å; R263-I266 WeakPolarHBondContact O-CB 3.48Å; R263-I266 PolarHBondContact O-N 3.38Å; R263-Q267 WeakPolarHBondContact O-CG 3.43Å; R263-Q267 PolarHBondContact O-N 3.35Å
264S94.8Very high96.3Very high58 Ų5843.1 Ų43.141%0.40620%0.197SC..Hα-helixtrans-53.9-40.6-176.856.90000113.6I266 Q267 F268 Q306S264-I266 VanDerWaalsContact C-N 3.35Å; S264-I266 PolarHBondContact O-N 3.41Å; S264-Q267 WeakPolarHBondContact O-CB 3.28Å; S264-Q267 PolarHBondContact O-N 3.32Å; S264-F268 WeakPolarHBondContact O-CB 3.47Å; S264-F268 PolarHBondContact O-N 3.24Å; S264-Q306 PolarHBondContact O-NE2 3.02Å
265N95.3Very high96.3Very high53 Ų5343.8 Ų43.828%0.28320%0.2SC..Hα-helixtrans-65.8-34.2178.2-67.9-34.5000113Y219 R263 F268 E269Y219-N265 PolarHBondContact OH-ND2 3.12Å; R263-N265 VanDerWaalsContact C-N 3.28Å; R263-N265 PolarHBondContact O-N 3.22Å; N265-F268 PolarHBondContact O-N 3.45Å; N265-E269 WeakPolarHBondContact O-CG 3.31Å; N265-E269 PolarHBondContact O-N 3.38Å
266I97Very high96.2Very high0 Ų044.3 Ų44.30%020%0.203CC..Hα-helixtrans-68.2-43.9174.7-62.2-60.5000110.2Y219 K222 R223 L226 D261 R263 S264 F268 E269 A270Y219-I266 HydrophobicContact CD2-CD1 4.2Å; Y219-I266 HydrophobicContact CD2-CG1 4.27Å; Y219-I266 HydrophobicContact CE2-CD1 4.06Å; Y219-I266 HydrophobicContact CE2-CG1 4.02Å; K222-I266 HydrophobicContact CG-CD1 4.11Å; R223-I266 VanDerWaalsContact CA-CD1 3.47Å; R223-I266 HydrophobicContact CB-CD1 3.5Å; R223-I266 HydrophobicContact CG-CD1 4.06Å; L226-I266 HydrophobicContact CD2-CG2 4.07Å; L226-I266 WeakPolarHBondContact CD2-O 3.25Å; D261-I266 HydrophobicContact CB-CB 4.11Å; D261-I266 HydrophobicContact CB-CG2 3.78Å; R263-I266 HydrophobicContact CB-CB 4.3Å; R263-I266 HydrophobicContact CB-CG1 3.9Å; R263-I266 WeakPolarHBondContact O-CB 3.48Å; R263-I266 PolarHBondContact O-N 3.38Å; S264-I266 VanDerWaalsContact C-N 3.35Å; S264-I266 PolarHBondContact O-N 3.41Å; I266-F268 PolarHBondContact O-N 3.38Å; I266-E269 PolarHBondContact O-N 3.37Å; I266-A270 WeakPolarHBondContact O-CB 3.27Å; I266-A270 PolarHBondContact O-N 2.98Å
267Q96.9Very high96.3Very high38 Ų3843 Ų4318%0.17820%0.196CC..Hα-helixtrans-59.3-40.2177-55170.9-17.800111.2L259 D261 R263 S264 A270 F271 F305 Q306L259-Q267 WeakPolarHBondContact O-CG 3.4Å; D261-Q267 HydrophobicContact CB-CG 4.37Å; D261-Q267 WeakPolarHBondContact O-CG 3.14Å; D261-Q267 PolarHBondContact O-NE2 3.21Å; R263-Q267 WeakPolarHBondContact O-CG 3.43Å; R263-Q267 PolarHBondContact O-N 3.35Å; S264-Q267 WeakPolarHBondContact O-CB 3.28Å; S264-Q267 PolarHBondContact O-N 3.32Å; Q267-A270 WeakPolarHBondContact O-CB 3.31Å; Q267-A270 PolarHBondContact O-N 3.17Å; Q267-F271 PolarHBondContact O-N 3.47Å; Q267-F305 HydrophobicContact CB-CE2 3.76Å; Q267-F305 HydrophobicContact CB-CZ 3.7Å; Q267-F305 HydrophobicContact CG-CE2 4.45Å; Q267-Q306 VanDerWaalsContact OE1-NE2 3.1Å
268F96.4Very high96.3Very high23 Ų2338.2 Ų38.210%0.10117%0.17CC..Hα-helixtrans-65.1-47.3-179.6-172.1-102.6000111.9S264 N265 I266 A270 F271 H272 F315S264-F268 WeakPolarHBondContact O-CB 3.47Å; S264-F268 PolarHBondContact O-N 3.24Å; N265-F268 PolarHBondContact O-N 3.45Å; I266-F268 PolarHBondContact O-N 3.38Å; F268-A270 VanDerWaalsContact C-N 3.29Å; F268-A270 PolarHBondContact O-N 3.27Å; F268-F271 WeakPolarHBondContact O-CB 3.45Å; F268-F271 PolarHBondContact O-N 2.95Å; F268-H272 AromaticContact CD1-NE2 3.86Å; F268-H272 AromaticContact CE1-CD2 3.96Å; F268-H272 AromaticContact CE1-NE2 3.19Å; F268-H272 WeakPolarHBondContact CE1-NE2 3.32Å; F268-H272 AromaticContact CZ-CE1 3.94Å; F268-H272 AromaticContact CZ-NE2 3.44Å; F268-H272 WeakPolarHBondContact CZ-NE2 3.41Å; F268-H272 PolarHBondContact O-N 3.38Å; F268-F315 HydrophobicContact CD2-CD2 4.37Å; F268-F315 HydrophobicContact CD2-CE2 4.23Å; F268-F315 HydrophobicContact CE2-CB 4.44Å; F268-F315 AromaticContact CE2-CD2 3.69Å; F268-F315 HydrophobicContact CE2-CD2 3.69Å; F268-F315 HydrophobicContact CE2-CE2 4.01Å; F268-F315 AromaticContact CE2-CG 3.96Å; F268-F315 HydrophobicContact CE2-CG 3.96Å
269E97.5Very high96.2Very high15 Ų1538.3 Ų38.37%0.0718%0.179CC..Hα-helixtrans-65.2-35.2174.8-54.7-60.3169.300111.3R223 L226 K227 N265 I266 F271 H272 V273R223-E269 HydrophobicContact CG-CG 4.18Å; R223-E269 IonicContact NE-OE1 3.07Å; R223-E269 IonicContact NH2-OE1 3.18Å; R223-E269 PolarHBondContact NH2-OE1 2.92Å; L226-E269 HydrophobicContact CB-CB 4.03Å; L226-E269 HydrophobicContact CD2-CB 3.9Å; L226-E269 HydrophobicContact CG-CB 3.8Å; K227-E269 HydrophobicContact CB-CG 4.14Å; K227-E269 WeakPolarHBondContact CB-OE2 3.49Å; K227-E269 WeakPolarHBondContact CG-OE2 3.32Å; N265-E269 WeakPolarHBondContact O-CG 3.31Å; N265-E269 PolarHBondContact O-N 3.38Å; I266-E269 PolarHBondContact O-N 3.37Å; E269-F271 VanDerWaalsContact C-N 3.28Å; E269-F271 PolarHBondContact O-N 3.28Å; E269-H272 PolarHBondContact O-N 3.05Å; E269-V273 PolarHBondContact O-N 2.95Å
270A97.6Very high96.1Very high0 Ų039.4 Ų39.40%019%0.185CC..Hα-helixtrans-61.9-36.8174.700000112.2L226 R258 L259 I266 Q267 F268 H272 V273 F274L226-A270 HydrophobicContact CD2-CB 3.86Å; R258-A270 HydrophobicContact CB-CB 3.56Å; L259-A270 HydrophobicContact CD2-CB 4.27Å; L259-A270 HydrophobicContact CG-CB 4.36Å; I266-A270 WeakPolarHBondContact O-CB 3.27Å; I266-A270 PolarHBondContact O-N 2.98Å; Q267-A270 WeakPolarHBondContact O-CB 3.31Å; Q267-A270 PolarHBondContact O-N 3.17Å; F268-A270 VanDerWaalsContact C-N 3.29Å; F268-A270 PolarHBondContact O-N 3.27Å; A270-H272 VanDerWaalsContact C-N 3.33Å; A270-H272 PolarHBondContact O-N 3.04Å; A270-V273 PolarHBondContact O-N 3.14Å; A270-F274 VanDerWaalsContact O-CB 3.3Å; A270-F274 WeakPolarHBondContact O-CB 3.33Å; A270-F274 PolarHBondContact O-N 3.01Å
271F97.5Very high95.9Very high0 Ų035.8 Ų35.80%019%0.186CC..Hα-helixtrans-60.5-42.6176.4172.8-88.8000111.7L259 Q267 F268 E269 V273 F274 K275 L302 F305 F315 E318 K319 L322L259-F271 HydrophobicContact CD2-CB 3.85Å; Q267-F271 PolarHBondContact O-N 3.47Å; F268-F271 WeakPolarHBondContact O-CB 3.45Å; F268-F271 PolarHBondContact O-N 2.95Å; E269-F271 VanDerWaalsContact C-N 3.28Å; E269-F271 PolarHBondContact O-N 3.28Å; F271-V273 VanDerWaalsContact C-N 3.25Å; F271-V273 PolarHBondContact O-N 3.29Å; F271-F274 PolarHBondContact O-N 2.9Å; F271-K275 WeakPolarHBondContact O-CB 3.44Å; F271-K275 PolarHBondContact O-N 3.34Å; F271-L302 HydrophobicContact CD2-CD2 4.25Å; F271-L302 HydrophobicContact CE2-CD2 4.1Å; F271-F305 HydrophobicContact CB-CE1 3.89Å; F271-F305 HydrophobicContact CB-CZ 4.35Å; F271-F305 HydrophobicContact CD2-CD1 4.12Å; F271-F305 AromaticContact CD2-CE1 3.91Å; F271-F305 HydrophobicContact CD2-CE1 3.91Å; F271-F305 HydrophobicContact CG-CE1 4.1Å; F271-F315 AromaticContact CD1-CD2 3.99Å; F271-F315 HydrophobicContact CD1-CD2 3.99Å; F271-F315 AromaticContact CD1-CE2 3.81Å; F271-F315 HydrophobicContact CD1-CE2 3.81Å; F271-F315 HydrophobicContact CD2-CE2 4.21Å; F271-F315 AromaticContact CE1-CD2 3.65Å; F271-F315 HydrophobicContact CE1-CD2 3.65Å; F271-F315 AromaticContact CE1-CE2 3.72Å; F271-F315 HydrophobicContact CE1-CE2 3.72Å; F271-F315 HydrophobicContact CE2-CE2 4.11Å; F271-F315 HydrophobicContact CG-CE2 4.06Å; F271-F315 HydrophobicContact CZ-CD2 4.07Å; F271-F315 AromaticContact CZ-CE2 3.87Å; F271-F315 HydrophobicContact CZ-CE2 3.87Å; F271-E318 HydrophobicContact CE1-CB 4.13Å; F271-E318 HydrophobicContact CZ-CB 4.12Å; F271-K319 HydrophobicContact CE2-CB 4.48Å; F271-K319 HydrophobicContact CZ-CB 4.29Å; F271-L322 HydrophobicContact CD2-CD1 4.3Å; F271-L322 HydrophobicContact CE1-CD1 4.47Å; F271-L322 HydrophobicContact CE2-CD1 3.48Å; F271-L322 VanDerWaalsContact CE2-CD1 3.48Å; F271-L322 HydrophobicContact CZ-CD1 3.57Å
272H95.8Very high95.8Very high39 Ų3941.4 Ų41.418%0.18122%0.216CC..Hα-helixtrans-66.7-24178.3-68.4-43000114.1F268 E269 A270 K275 E318F268-H272 AromaticContact CD1-NE2 3.86Å; F268-H272 AromaticContact CE1-CD2 3.96Å; F268-H272 AromaticContact CE1-NE2 3.19Å; F268-H272 WeakPolarHBondContact CE1-NE2 3.32Å; F268-H272 AromaticContact CZ-CE1 3.94Å; F268-H272 AromaticContact CZ-NE2 3.44Å; F268-H272 WeakPolarHBondContact CZ-NE2 3.41Å; F268-H272 PolarHBondContact O-N 3.38Å; E269-H272 PolarHBondContact O-N 3.05Å; A270-H272 VanDerWaalsContact C-N 3.33Å; A270-H272 PolarHBondContact O-N 3.04Å; H272-K275 WeakPolarHBondContact O-CG 3.4Å; H272-E318 IonicContact ND1-OE2 3.32Å
273V97.5Very high95.8Very high0 Ų033.7 Ų33.70%018%0.182CC..Hα-helixtrans-84.8-44.3171-177.80000110.5L226 L229 L233 Y245 M255 E269 A270 F271 K275 V276 F277L226-V273 HydrophobicContact CD1-CG2 4.25Å; L229-V273 HydrophobicContact CB-CG2 4.47Å; L229-V273 HydrophobicContact CD2-CG1 4.15Å; L229-V273 HydrophobicContact CD2-CG2 4.17Å; L229-V273 HydrophobicContact CG-CG1 4.49Å; L229-V273 HydrophobicContact CG-CG2 4.19Å; L233-V273 HydrophobicContact CD1-CG1 3.75Å; Y245-V273 HydrophobicContact CE1-CG1 4.44Å; M255-V273 HydrophobicContact CG-CB 4.2Å; M255-V273 HydrophobicContact CG-CG1 3.72Å; M255-V273 HydrophobicContact SD-CB 3.51Å; M255-V273 VanDerWaalsContact SD-CB 3.51Å; M255-V273 HydrophobicContact SD-CG1 3.39Å; M255-V273 WeakPolarHBondContact SD-CG1 3.49Å; M255-V273 HydrophobicContact SD-CG2 4.18Å; E269-V273 PolarHBondContact O-N 2.95Å; A270-V273 PolarHBondContact O-N 3.14Å; F271-V273 VanDerWaalsContact C-N 3.25Å; F271-V273 PolarHBondContact O-N 3.29Å; V273-K275 VanDerWaalsContact C-N 3.28Å; V273-K275 PolarHBondContact O-N 2.87Å; V273-V276 WeakPolarHBondContact O-CB 3.27Å; V273-V276 PolarHBondContact O-N 3.19Å; V273-V276 VanDerWaalsContact O-N 3.13Å; V273-F277 HydrophobicContact CG1-CE2 4.16Å; V273-F277 WeakPolarHBondContact O-CD2 3.24Å
274F98Very high95.8Very high0 Ų031.8 Ų31.80%018%0.181CC..Hα-helixtrans-57.2-38.7178.1174.8-102.3000112.6L252 M255 I256 L259 A270 F271 V276 F277 V278 L291 L298 L302 L322 I326L252-F274 HydrophobicContact CD1-CD2 3.94Å; L252-F274 HydrophobicContact CD1-CE2 3.9Å; M255-F274 HydrophobicContact CB-CB 4.35Å; I256-F274 HydrophobicContact CD1-CE2 4.3Å; I256-F274 HydrophobicContact CG1-CD2 4.08Å; I256-F274 HydrophobicContact CG1-CE2 3.8Å; L259-F274 HydrophobicContact CD1-CB 4.14Å; L259-F274 HydrophobicContact CD1-CD1 3.92Å; L259-F274 HydrophobicContact CD1-CD2 4.03Å; L259-F274 HydrophobicContact CD1-CE1 4.34Å; L259-F274 HydrophobicContact CD1-CE2 4.43Å; L259-F274 HydrophobicContact CD1-CG 3.75Å; A270-F274 VanDerWaalsContact O-CB 3.3Å; A270-F274 WeakPolarHBondContact O-CB 3.33Å; A270-F274 PolarHBondContact O-N 3.01Å; F271-F274 PolarHBondContact O-N 2.9Å; F274-V276 PolarHBondContact O-N 2.91Å; F274-V276 VanDerWaalsContact O-N 3.17Å; F274-F277 WeakPolarHBondContact O-CB 3.16Å; F274-F277 PolarHBondContact O-N 2.64Å; F274-F277 VanDerWaalsContact O-N 3.12Å; F274-V278 HydrophobicContact CD1-CG2 4.26Å; F274-V278 HydrophobicContact CE1-CG2 3.63Å; F274-V278 HydrophobicContact CE2-CG2 4.1Å; F274-V278 HydrophobicContact CZ-CG2 3.54Å; F274-V278 PolarHBondContact O-N 2.81Å; F274-L291 HydrophobicContact CE2-CD2 4.22Å; F274-L291 HydrophobicContact CZ-CD2 4.33Å; F274-L298 HydrophobicContact CZ-CD1 4.44Å; F274-L298 HydrophobicContact CZ-CD2 4.14Å; F274-L302 HydrophobicContact CE1-CD1 4.34Å; F274-L322 HydrophobicContact CD1-CD1 4.46Å; F274-I326 HydrophobicContact CE1-CD1 4.34Å; F274-I326 HydrophobicContact CZ-CD1 4.25Å
275K95.9Very high95.8Very high29 Ų2933.5 Ų33.513%0.12618%0.183CC..Hα-helixtrans-57.2-33.3179.478.8-179.2175.4179.20112.5F271 H272 V273 F277 V278 A279 E318 L322F271-K275 WeakPolarHBondContact O-CB 3.44Å; F271-K275 PolarHBondContact O-N 3.34Å; H272-K275 WeakPolarHBondContact O-CG 3.4Å; V273-K275 VanDerWaalsContact C-N 3.28Å; V273-K275 PolarHBondContact O-N 2.87Å; K275-F277 PolarHBondContact O-N 3.41Å; K275-V278 PolarHBondContact O-N 3.15Å; K275-A279 WeakPolarHBondContact O-CB 3.43Å; K275-A279 PolarHBondContact O-N 3.48Å; K275-E318 VanDerWaalsContact CD-OE2 3.32Å; K275-E318 WeakPolarHBondContact CD-OE2 3.48Å; K275-E318 IonicContact NZ-OE1 3.92Å; K275-E318 PolarHBondContact NZ-OE1 2.91Å; K275-E318 IonicContact NZ-OE2 2.7Å; K275-E318 PolarHBondContact NZ-OE2 3.33Å; K275-L322 HydrophobicContact CB-CD1 3.68Å; K275-L322 HydrophobicContact CB-CD2 3.95Å; K275-L322 HydrophobicContact CB-CG 4.29Å
276V96.4Very high95.8Very high11 Ų1134 Ų347%0.06719%0.189CC..Hα-helixtrans-65.5-39.6-179.3-169.80000111.2L234 M242 I246 V273 F274 V278 N280L234-V276 HydrophobicContact CD2-CG2 3.71Å; L234-V276 HydrophobicContact CG-CG2 4.24Å; M242-V276 HydrophobicContact CG-CG1 3.77Å; M242-V276 HydrophobicContact SD-CG1 3.55Å; M242-V276 VanDerWaalsContact SD-CG1 3.55Å; I246-V276 HydrophobicContact CD1-CG1 4.17Å; I246-V276 HydrophobicContact CG2-CB 4.33Å; I246-V276 HydrophobicContact CG2-CG1 3.93Å; V273-V276 WeakPolarHBondContact O-CB 3.27Å; V273-V276 PolarHBondContact O-N 3.19Å; V273-V276 VanDerWaalsContact O-N 3.13Å; F274-V276 PolarHBondContact O-N 2.91Å; F274-V276 VanDerWaalsContact O-N 3.17Å; V276-V278 PolarHBondContact O-N 3.33Å; V276-N280 PolarHBondContact O-N 2.92Å; V276-N280 VanDerWaalsContact O-N 3.12Å
277F97.4Very high95.8Very high0 Ų034 Ų340%019%0.189CC..Hα-helixtrans-62.7-43.6176.3-72.3-99.7000112.1Y245 I246 T251 L252 M255 V273 F274 K275 K283 I287Y245-F277 HydrophobicContact CD1-CE2 4.42Å; Y245-F277 HydrophobicContact CD1-CZ 4.07Å; Y245-F277 HydrophobicContact CE1-CE2 4.27Å; Y245-F277 HydrophobicContact CE1-CZ 4.03Å; I246-F277 HydrophobicContact CB-CD1 3.79Å; I246-F277 HydrophobicContact CB-CD2 4.44Å; I246-F277 HydrophobicContact CB-CE1 3.84Å; I246-F277 HydrophobicContact CB-CE2 4.45Å; I246-F277 HydrophobicContact CB-CG 4.12Å; I246-F277 HydrophobicContact CB-CZ 4.16Å; I246-F277 HydrophobicContact CG2-CD1 4.25Å; I246-F277 HydrophobicContact CG2-CD2 4.01Å; I246-F277 HydrophobicContact CG2-CE1 4.2Å; I246-F277 HydrophobicContact CG2-CE2 3.91Å; I246-F277 HydrophobicContact CG2-CG 4.17Å; I246-F277 HydrophobicContact CG2-CZ 4.01Å; I246-F277 WeakPolarHBondContact O-CD1 3.45Å; I246-F277 WeakPolarHBondContact O-CE1 3.34Å; T251-F277 WeakPolarHBondContact OG1-CE1 3.43Å; T251-F277 VanDerWaalsContact OG1-CZ 3.31Å; T251-F277 WeakPolarHBondContact OG1-CZ 3.47Å; L252-F277 HydrophobicContact CB-CD1 3.82Å; L252-F277 HydrophobicContact CB-CE1 3.67Å; L252-F277 HydrophobicContact CB-CZ 4.36Å; L252-F277 HydrophobicContact CD1-CB 4.03Å; L252-F277 HydrophobicContact CD1-CD1 3.93Å; L252-F277 HydrophobicContact CD1-CD2 4.46Å; L252-F277 HydrophobicContact CD1-CE1 4.48Å; L252-F277 HydrophobicContact CD1-CG 3.9Å; L252-F277 HydrophobicContact CG-CD1 4.32Å; M255-F277 HydrophobicContact CG-CE2 4.09Å; V273-F277 HydrophobicContact CG1-CE2 4.16Å; V273-F277 WeakPolarHBondContact O-CD2 3.24Å; F274-F277 WeakPolarHBondContact O-CB 3.16Å; F274-F277 PolarHBondContact O-N 2.64Å; F274-F277 VanDerWaalsContact O-N 3.12Å; K275-F277 PolarHBondContact O-N 3.41Å; F277-K283 WeakPolarHBondContact O-CE 3.39Å; F277-I287 HydrophobicContact CD1-CD1 4.14Å; F277-I287 HydrophobicContact CE1-CD1 4.24Å
278V96.1Very high95.8Very high0 Ų032.8 Ų32.80%019%0.185CC..Hα-helixtrans-75.4-38.2-177.31760000111.2F274 K275 V276 N280 K283 L291 L322 Q325 I326F274-V278 HydrophobicContact CD1-CG2 4.26Å; F274-V278 HydrophobicContact CE1-CG2 3.63Å; F274-V278 HydrophobicContact CE2-CG2 4.1Å; F274-V278 HydrophobicContact CZ-CG2 3.54Å; F274-V278 PolarHBondContact O-N 2.81Å; K275-V278 PolarHBondContact O-N 3.15Å; V276-V278 PolarHBondContact O-N 3.33Å; V278-N280 VanDerWaalsContact C-N 3.28Å; V278-N280 PolarHBondContact O-N 3.49Å; V278-K283 WeakPolarHBondContact O-CE 3.41Å; V278-K283 PolarHBondContact O-NZ 3.37Å; V278-L291 HydrophobicContact CG2-CD1 4.44Å; V278-L291 HydrophobicContact CG2-CD2 4.26Å; V278-L322 HydrophobicContact CB-CD2 3.63Å; V278-L322 HydrophobicContact CG1-CD2 3.57Å; V278-L322 HydrophobicContact CG2-CD2 4.42Å; V278-Q325 HydrophobicContact CG1-CB 3.7Å; V278-I326 HydrophobicContact CG1-CD1 4.28Å; V278-I326 HydrophobicContact CG1-CG1 3.72Å; V278-I326 HydrophobicContact CG2-CD1 4.17Å; V278-I326 HydrophobicContact CG2-CG1 4.22Å
279A94.4Very high95.7Very high39 Ų3935.4 Ų35.432%0.32220%0.2SC..Hα-helixtrans-72.2-18.617900000113.5K275 P281 Y321K275-A279 WeakPolarHBondContact O-CB 3.43Å; K275-A279 PolarHBondContact O-N 3.48Å; A279-P281 WeakPolarHBondContact O-CD 3.45Å; A279-Y321 HydrophobicContact CB-CE1 4.17Å
280N94.1Very high95.7Very high26 Ų2636 Ų3614%0.13920%0.203CC..  trans-60.2118.5177.417815.4000111.2I246 V276 V278 N282 K283I246-N280 HydrophobicContact CD1-CB 3.76Å; V276-N280 PolarHBondContact O-N 2.92Å; V276-N280 VanDerWaalsContact O-N 3.12Å; V278-N280 VanDerWaalsContact C-N 3.28Å; V278-N280 PolarHBondContact O-N 3.49Å; N280-N282 VanDerWaalsContact C-N 3.3Å; N280-N282 PolarHBondContact ND2-O 3.02Å; N280-N282 PolarHBondContact O-N 3.33Å; N280-N282 PolarHBondContact OD1-N 3.12Å; N280-K283 HydrophobicContact CB-CG 4.44Å; N280-K283 WeakPolarHBondContact O-CE 3.11Å; N280-K283 WeakPolarHBondContact O-CG 3.33Å; N280-K283 PolarHBondContact O-NZ 2.99Å
281P91.4Very high95.6Very high111 Ų11136 Ų3672%0.72120%0.203SC*.SBendtrans-68.5-30.7176.927.3-34000112.4A279 K283A279-P281 WeakPolarHBondContact O-CD 3.45Å; P281-K283 PolarHBondContact O-N 3.39Å
282N92.4Very high95.5Very high132 Ų13237.6 Ų37.671%0.70621%0.212SC*.SBendtrans-104.563.6-174.7-61.5-38.3000110.7N280N280-N282 VanDerWaalsContact C-N 3.3Å; N280-N282 PolarHBondContact ND2-O 3.02Å; N280-N282 PolarHBondContact O-N 3.33Å; N280-N282 PolarHBondContact OD1-N 3.12Å
283K94.3Very high95.6Very high42 Ų4244.5 Ų44.518%0.18324%0.241CC..  trans-69.5135.4179.3-56.7-177.9177.665.90110.1F277 V278 N280 P281 I287 L291 L329F277-K283 WeakPolarHBondContact O-CE 3.39Å; V278-K283 WeakPolarHBondContact O-CE 3.41Å; V278-K283 PolarHBondContact O-NZ 3.37Å; N280-K283 HydrophobicContact CB-CG 4.44Å; N280-K283 WeakPolarHBondContact O-CE 3.11Å; N280-K283 WeakPolarHBondContact O-CG 3.33Å; N280-K283 PolarHBondContact O-NZ 2.99Å; P281-K283 PolarHBondContact O-N 3.39Å; K283-I287 HydrophobicContact CB-CG2 4.26Å; K283-L291 HydrophobicContact CD-CD1 3.94Å; K283-L329 HydrophobicContact CD-CD2 4.02Å
284T94.9Very high95.5Very high52 Ų5247 Ų4732%0.31926%0.255SS..  trans-68.1153.2170.561.50000110.3S247 I287 A288S247-T284 PolarHBondContact O-OG1 3.16Å; T284-I287 WeakPolarHBondContact O-CB 3.37Å; T284-I287 PolarHBondContact O-N 3.08Å; T284-I287 WeakPolarHBondContact OG1-CG1 3.18Å; T284-A288 PolarHBondContact O-N 3.01Å
285Q94.3Very high95.3Very high94 Ų9449.3 Ų49.344%0.43927%0.265SS..Hα-helixtrans-52.5-47.2-178.7-172.264.738.400112.9I287 A288 D289Q285-I287 VanDerWaalsContact C-N 3.27Å; Q285-I287 PolarHBondContact O-N 3.06Å; Q285-A288 PolarHBondContact O-N 3.48Å; Q285-D289 PolarHBondContact NE2-OD1 2.71Å; Q285-D289 WeakPolarHBondContact O-CB 3.33Å; Q285-D289 PolarHBondContact O-N 3.23Å
286P96.2Very high95.3Very high63 Ų6353.3 Ų53.341%0.40929%0.292SS..Hα-helixtrans-61.1-33.3178.6-27.539.5000114.1P249 I290P249-P286 HydrophobicContact CG-CB 3.53Å; P249-P286 HydrophobicContact CG-CG 4.46Å; P286-I290 VanDerWaalsContact O-CG1 3.32Å; P286-I290 WeakPolarHBondContact O-CG1 3.44Å; P286-I290 PolarHBondContact O-N 2.62Å
287I97.2Very high95.3Very high1 Ų160.3 Ų60.31%0.00532%0.322CS..Hα-helixtrans-71.4-46.7177.2-66.8-66.2000110.3L252 F277 K283 T284 Q285 D289 I290 L291L252-I287 HydrophobicContact CB-CD1 3.81Å; L252-I287 HydrophobicContact CD2-CD1 3.8Å; L252-I287 HydrophobicContact CD2-CG2 4.12Å; L252-I287 HydrophobicContact CG-CD1 4.45Å; F277-I287 HydrophobicContact CD1-CD1 4.14Å; F277-I287 HydrophobicContact CE1-CD1 4.24Å; K283-I287 HydrophobicContact CB-CG2 4.26Å; T284-I287 WeakPolarHBondContact O-CB 3.37Å; T284-I287 PolarHBondContact O-N 3.08Å; T284-I287 WeakPolarHBondContact OG1-CG1 3.18Å; Q285-I287 VanDerWaalsContact C-N 3.27Å; Q285-I287 PolarHBondContact O-N 3.06Å; I287-D289 VanDerWaalsContact C-N 3.3Å; I287-D289 PolarHBondContact O-N 3.18Å; I287-I290 PolarHBondContact O-N 2.99Å; I287-L291 HydrophobicContact CG2-CD1 4.25Å; I287-L291 WeakPolarHBondContact O-CG 3.39Å; I287-L291 PolarHBondContact O-N 3.4Å; I287-L291 VanDerWaalsContact O-N 3.09Å
288A95.8Very high95.3Very high11 Ų1160.8 Ų60.89%0.09133%0.325CS..Hα-helixtrans-58.9-43.1176.100000111.4T284 Q285 I290 L291 L292T284-A288 PolarHBondContact O-N 3.01Å; Q285-A288 PolarHBondContact O-N 3.48Å; A288-I290 PolarHBondContact O-N 3Å; A288-L291 PolarHBondContact O-N 3.32Å; A288-L292 WeakPolarHBondContact O-CB 3.43Å; A288-L292 WeakPolarHBondContact O-CG 3.27Å; A288-L292 PolarHBondContact O-N 3.27Å
289D95.6Very high95.3Very high78 Ų7862.2 Ų62.242%0.41733%0.332SS..Hα-helixtrans-61.8-42.4178.5-68.8-23.4000112.3Q285 I287 K293Q285-D289 PolarHBondContact NE2-OD1 2.71Å; Q285-D289 WeakPolarHBondContact O-CB 3.33Å; Q285-D289 PolarHBondContact O-N 3.23Å; I287-D289 VanDerWaalsContact C-N 3.3Å; I287-D289 PolarHBondContact O-N 3.18Å; D289-K293 WeakPolarHBondContact O-CB 3.45Å; D289-K293 PolarHBondContact O-N 3.22Å
290I96.6Very high95.4Very high27 Ų2765.3 Ų65.314%0.13834%0.343CS..Hα-helixtrans-63.1-45.4176.4-70.9168.4000110.8P249 L252 K253 I256 P286 I287 A288 N294P249-I290 HydrophobicContact CB-CD1 3.82Å; L252-I290 HydrophobicContact CD2-CB 3.92Å; L252-I290 HydrophobicContact CD2-CD1 4.36Å; L252-I290 HydrophobicContact CD2-CG2 3.63Å; L252-I290 HydrophobicContact CG-CG2 4.24Å; K253-I290 HydrophobicContact CG-CD1 4.32Å; I256-I290 HydrophobicContact CD1-CG2 4.07Å; P286-I290 VanDerWaalsContact O-CG1 3.32Å; P286-I290 WeakPolarHBondContact O-CG1 3.44Å; P286-I290 PolarHBondContact O-N 2.62Å; I287-I290 PolarHBondContact O-N 2.99Å; A288-I290 PolarHBondContact O-N 3Å; I290-N294 PolarHBondContact O-N 3.1Å; I290-N294 PolarHBondContact O-ND2 3.38Å
291L96.2Very high95.5Very high0 Ų067 Ų670%035%0.349CS..Hα-helixtrans-66.4-43.9-179.9-66.2175.4000111.5L252 F274 V278 K283 I287 A288 N294 Q295 L298 L329L252-L291 HydrophobicContact CD1-CD2 4.41Å; L252-L291 HydrophobicContact CD2-CD2 4.21Å; L252-L291 HydrophobicContact CD2-CG 4.23Å; F274-L291 HydrophobicContact CE2-CD2 4.22Å; F274-L291 HydrophobicContact CZ-CD2 4.33Å; V278-L291 HydrophobicContact CG2-CD1 4.44Å; V278-L291 HydrophobicContact CG2-CD2 4.26Å; K283-L291 HydrophobicContact CD-CD1 3.94Å; I287-L291 HydrophobicContact CG2-CD1 4.25Å; I287-L291 WeakPolarHBondContact O-CG 3.39Å; I287-L291 PolarHBondContact O-N 3.4Å; I287-L291 VanDerWaalsContact O-N 3.09Å; A288-L291 PolarHBondContact O-N 3.32Å; L291-N294 CarbonylContact O-C 3.44Å; L291-N294 PolarHBondContact O-N 3.28Å; L291-Q295 VanDerWaalsContact O-CA 3.28Å; L291-Q295 WeakPolarHBondContact O-CA 3.38Å; L291-Q295 PolarHBondContact O-N 2.88Å; L291-L298 HydrophobicContact CD2-CD1 3.96Å; L291-L329 HydrophobicContact CB-CD1 3.55Å; L291-L329 HydrophobicContact CD1-CD1 4.03Å; L291-L329 HydrophobicContact CG-CD1 4.42Å
292L95.9Very high95.7Very high35 Ų3561.8 Ų61.818%0.18332%0.315CS..Hα-helixtrans-63.9-44.4177.1-75.8171.1000111.9A288 N294 Q295 L329 K331A288-L292 WeakPolarHBondContact O-CB 3.43Å; A288-L292 WeakPolarHBondContact O-CG 3.27Å; A288-L292 PolarHBondContact O-N 3.27Å; L292-N294 PolarHBondContact O-N 3.4Å; L292-Q295 VanDerWaalsContact O-CB 3.31Å; L292-Q295 WeakPolarHBondContact O-CB 3.38Å; L292-Q295 PolarHBondContact O-N 3.47Å; L292-L329 HydrophobicContact CD2-CB 3.78Å; L292-L329 HydrophobicContact CG-CB 4.47Å; L292-K331 HydrophobicContact CD1-CG 3.84Å
293K96.1Very high95.8Very high183 Ų18357.8 Ų57.880%0.79630%0.297SS*.Hα-helixtrans-60.1-30.4177.6-177.3175.6-179.8177.50112.6D289D289-K293 WeakPolarHBondContact O-CB 3.45Å; D289-K293 PolarHBondContact O-N 3.22Å
294N95.4Very high95.8Very high54 Ų5459.9 Ų59.929%0.28931%0.311SS..THydrogen-bonded Turntrans-107.310.1-178.8-63.7-79.5000113.3I290 L291 L292 T296 K297 L298I290-N294 PolarHBondContact O-N 3.1Å; I290-N294 PolarHBondContact O-ND2 3.38Å; L291-N294 CarbonylContact O-C 3.44Å; L291-N294 PolarHBondContact O-N 3.28Å; L292-N294 PolarHBondContact O-N 3.4Å; N294-T296 PolarHBondContact O-N 2.96Å; N294-K297 PolarHBondContact O-N 2.94Å; N294-K297 VanDerWaalsContact O-N 3.15Å; N294-L298 HydrophobicContact CB-CD1 3.94Å; N294-L298 HydrophobicContact CB-CG 4.05Å; N294-L298 WeakPolarHBondContact O-CB 3.44Å; N294-L298 WeakPolarHBondContact O-CG 3.3Å; N294-L298 PolarHBondContact O-N 3.28Å
295Q95.4Very high95.8Very high47 Ų4757.7 Ų57.722%0.2230%0.297CS..Hα-helixtrans-53.4-56.8-166.7-172.9-176.546.200112.9L291 L292 K297 L298 I299 I326 R327 L329L291-Q295 VanDerWaalsContact O-CA 3.28Å; L291-Q295 WeakPolarHBondContact O-CA 3.38Å; L291-Q295 PolarHBondContact O-N 2.88Å; L292-Q295 VanDerWaalsContact O-CB 3.31Å; L292-Q295 WeakPolarHBondContact O-CB 3.38Å; L292-Q295 PolarHBondContact O-N 3.47Å; Q295-K297 VanDerWaalsContact C-N 3.32Å; Q295-K297 PolarHBondContact O-N 2.99Å; Q295-L298 PolarHBondContact O-N 2.89Å; Q295-I299 HydrophobicContact CG-CD1 4.05Å; Q295-I299 WeakPolarHBondContact O-CG1 3.39Å; Q295-I299 PolarHBondContact O-N 3.5Å; Q295-I326 HydrophobicContact CB-CG2 4.48Å; Q295-I326 HydrophobicContact CG-CG2 3.81Å; Q295-I326 PolarHBondContact NE2-O 3.2Å; Q295-R327 PolarHBondContact NE2-O 2.97Å; Q295-L329 PolarHBondContact NE2-O 3.47Å
296T95.6Very high95.7Very high113 Ų11354 Ų5469%0.69328%0.279SS*.Hα-helixtrans-59.8-42.7-178.9-46.70000112N294 I299 D300N294-T296 PolarHBondContact O-N 2.96Å; T296-I299 PolarHBondContact O-N 3.07Å; T296-D300 PolarHBondContact O-N 3.39Å; T296-D300 VanDerWaalsContact O-N 3.09Å
297K96.3Very high95.4Very high158 Ų15856.6 Ų56.669%0.68728%0.284SS*.Hα-helixtrans-67.8-39.2-180-66.3-178179.8178.30111.9N294 Q295 F301N294-K297 PolarHBondContact O-N 2.94Å; N294-K297 VanDerWaalsContact O-N 3.15Å; Q295-K297 VanDerWaalsContact C-N 3.32Å; Q295-K297 PolarHBondContact O-N 2.99Å; K297-F301 WeakPolarHBondContact O-CB 3.35Å; K297-F301 PolarHBondContact O-N 3.3Å
298L96.3Very high95.1Very high11 Ų1162.6 Ų62.66%0.05832%0.317CS..Hα-helixtrans-67-42.2177.5-75.1170.5000111.4F274 L291 N294 Q295 F301 L302 I326F274-L298 HydrophobicContact CZ-CD1 4.44Å; F274-L298 HydrophobicContact CZ-CD2 4.14Å; L291-L298 HydrophobicContact CD2-CD1 3.96Å; N294-L298 HydrophobicContact CB-CD1 3.94Å; N294-L298 HydrophobicContact CB-CG 4.05Å; N294-L298 WeakPolarHBondContact O-CB 3.44Å; N294-L298 WeakPolarHBondContact O-CG 3.3Å; N294-L298 PolarHBondContact O-N 3.28Å; Q295-L298 PolarHBondContact O-N 2.89Å; L298-F301 PolarHBondContact O-N 3.43Å; L298-L302 WeakPolarHBondContact O-CB 3.44Å; L298-L302 VanDerWaalsContact O-CG 3.26Å; L298-L302 WeakPolarHBondContact O-CG 3.27Å; L298-L302 PolarHBondContact O-N 2.72Å; L298-I326 HydrophobicContact CB-CD1 4.22Å; L298-I326 HydrophobicContact CB-CG2 4.41Å
299I96Very high94.8Very high29 Ų2965 Ų6515%0.14932%0.323CS..Hα-helixtrans-61.3-48.4176.8-70.2167.6000110.7Q295 T296 S303 I323 I326 R327Q295-I299 HydrophobicContact CG-CD1 4.05Å; Q295-I299 WeakPolarHBondContact O-CG1 3.39Å; Q295-I299 PolarHBondContact O-N 3.5Å; T296-I299 PolarHBondContact O-N 3.07Å; I299-S303 WeakPolarHBondContact O-CB 3.04Å; I299-S303 PolarHBondContact O-N 3.47Å; I299-S303 PolarHBondContact O-OG 3.43Å; I299-I323 HydrophobicContact CG2-CG2 4.08Å; I299-I326 HydrophobicContact CD1-CG2 4.21Å; I299-I326 HydrophobicContact CG1-CB 4.36Å; I299-I326 HydrophobicContact CG1-CG2 3.85Å; I299-R327 HydrophobicContact CD1-CB 3.95Å; I299-R327 HydrophobicContact CD1-CG 4.46Å
300D96.7Very high94.4Very high105 Ų10566.7 Ų66.756%0.56134%0.336SS*.Hα-helixtrans-63.6-44178.4-178.757.1000111.8T296 S303 N304T296-D300 PolarHBondContact O-N 3.39Å; T296-D300 VanDerWaalsContact O-N 3.09Å; D300-S303 PolarHBondContact O-N 3.5Å; D300-N304 PolarHBondContact O-N 3.43Å; D300-N304 PolarHBondContact O-ND2 2.92Å
301F96.6Very high94.2Very high62 Ų6272 Ų7227%0.27237%0.365SS..Hα-helixtrans-59.1-53.5176.2177.2-93.1000111.8L259 R260 K297 L298 S303 N304 F305L259-F301 HydrophobicContact CB-CE1 4.04Å; L259-F301 HydrophobicContact CB-CZ 4.15Å; L259-F301 HydrophobicContact CD1-CE1 4.46Å; L259-F301 WeakPolarHBondContact O-CZ 3.49Å; R260-F301 HydrophobicContact CG-CE2 4.3Å; K297-F301 WeakPolarHBondContact O-CB 3.35Å; K297-F301 PolarHBondContact O-N 3.3Å; L298-F301 PolarHBondContact O-N 3.43Å; F301-S303 VanDerWaalsContact C-N 3.27Å; F301-S303 PolarHBondContact O-N 2.89Å; F301-N304 CarbonylContact O-C 3.48Å; F301-N304 PolarHBondContact O-N 3.34Å; F301-F305 HydrophobicContact CD1-CD2 4.43Å; F301-F305 HydrophobicContact CE1-CB 4.27Å; F301-F305 AromaticContact CE1-CD2 3.42Å; F301-F305 HydrophobicContact CE1-CD2 3.42Å; F301-F305 VanDerWaalsContact CE1-CD2 3.42Å; F301-F305 AromaticContact CE1-CE2 3.95Å; F301-F305 HydrophobicContact CE1-CE2 3.95Å; F301-F305 AromaticContact CE1-CG 3.99Å; F301-F305 HydrophobicContact CE1-CG 3.99Å; F301-F305 HydrophobicContact CE2-CD2 4.39Å; F301-F305 AromaticContact CZ-CD2 3.4Å; F301-F305 HydrophobicContact CZ-CD2 3.4Å; F301-F305 VanDerWaalsContact CZ-CD2 3.4Å; F301-F305 AromaticContact CZ-CE2 3.78Å; F301-F305 HydrophobicContact CZ-CE2 3.78Å; F301-F305 HydrophobicContact CZ-CG 4.37Å; F301-F305 WeakPolarHBondContact O-CB 3.49Å; F301-F305 PolarHBondContact O-N 3.05Å
302L96Very high94Very high0 Ų074.2 Ų74.20%038%0.377CS..Hα-helixtrans-63.5-34.6-179.2-71.1172.9000111.8F271 F274 L298 N304 F305 K319 L322 I323 I326F271-L302 HydrophobicContact CD2-CD2 4.25Å; F271-L302 HydrophobicContact CE2-CD2 4.1Å; F274-L302 HydrophobicContact CE1-CD1 4.34Å; L298-L302 WeakPolarHBondContact O-CB 3.44Å; L298-L302 VanDerWaalsContact O-CG 3.26Å; L298-L302 WeakPolarHBondContact O-CG 3.27Å; L298-L302 PolarHBondContact O-N 2.72Å; L302-N304 PolarHBondContact O-N 3.3Å; L302-F305 PolarHBondContact O-N 3.38Å; L302-K319 VanDerWaalsContact O-CD 3.26Å; L302-K319 WeakPolarHBondContact O-CD 3.34Å; L302-L322 HydrophobicContact CD1-CB 4.27Å; L302-I323 HydrophobicContact CB-CD1 4.02Å; L302-I323 HydrophobicContact CB-CG1 3.69Å; L302-I323 HydrophobicContact CD1-CG1 4.23Å; L302-I326 HydrophobicContact CD1-CD1 3.58Å
303S94.4Very high93.9Very high48 Ų4880 Ų8034%0.33640%0.403SS..Hα-helixtrans-61.6-26.3176.2-60.90000112.4I299 D300 F301 K307I299-S303 WeakPolarHBondContact O-CB 3.04Å; I299-S303 PolarHBondContact O-N 3.47Å; I299-S303 PolarHBondContact O-OG 3.43Å; D300-S303 PolarHBondContact O-N 3.5Å; F301-S303 VanDerWaalsContact C-N 3.27Å; F301-S303 PolarHBondContact O-N 2.89Å; S303-K307 WeakPolarHBondContact O-CE 3.35Å; S303-K307 PolarHBondContact O-NZ 2.88Å
304N94.1Very high93.8Very high86 Ų8677.3 Ų77.346%0.4639%0.393SS..Hα-helixtrans-107.70.5-180-65.2-58000113.9D300 F301 L302 Q306 K307D300-N304 PolarHBondContact O-N 3.43Å; D300-N304 PolarHBondContact O-ND2 2.92Å; F301-N304 CarbonylContact O-C 3.48Å; F301-N304 PolarHBondContact O-N 3.34Å; L302-N304 PolarHBondContact O-N 3.3Å; N304-Q306 PolarHBondContact O-N 3.19Å; N304-K307 PolarHBondContact OD1-NZ 2.8Å
305F95.1Very high93.7Very high7 Ų774.9 Ų74.93%0.03138%0.38CS..THydrogen-bonded Turntrans-75.9121.7-173.6-173.4-111.7000111.9L259 Q267 F271 F301 L302 K307 F315 K319L259-F305 HydrophobicContact CD2-CE1 4.42Å; L259-F305 HydrophobicContact CD2-CE2 4.3Å; L259-F305 HydrophobicContact CD2-CZ 3.95Å; Q267-F305 HydrophobicContact CB-CE2 3.76Å; Q267-F305 HydrophobicContact CB-CZ 3.7Å; Q267-F305 HydrophobicContact CG-CE2 4.45Å; F271-F305 HydrophobicContact CB-CE1 3.89Å; F271-F305 HydrophobicContact CB-CZ 4.35Å; F271-F305 HydrophobicContact CD2-CD1 4.12Å; F271-F305 AromaticContact CD2-CE1 3.91Å; F271-F305 HydrophobicContact CD2-CE1 3.91Å; F271-F305 HydrophobicContact CG-CE1 4.1Å; F301-F305 HydrophobicContact CD1-CD2 4.43Å; F301-F305 HydrophobicContact CE1-CB 4.27Å; F301-F305 AromaticContact CE1-CD2 3.42Å; F301-F305 HydrophobicContact CE1-CD2 3.42Å; F301-F305 VanDerWaalsContact CE1-CD2 3.42Å; F301-F305 AromaticContact CE1-CE2 3.95Å; F301-F305 HydrophobicContact CE1-CE2 3.95Å; F301-F305 AromaticContact CE1-CG 3.99Å; F301-F305 HydrophobicContact CE1-CG 3.99Å; F301-F305 HydrophobicContact CE2-CD2 4.39Å; F301-F305 AromaticContact CZ-CD2 3.4Å; F301-F305 HydrophobicContact CZ-CD2 3.4Å; F301-F305 VanDerWaalsContact CZ-CD2 3.4Å; F301-F305 AromaticContact CZ-CE2 3.78Å; F301-F305 HydrophobicContact CZ-CE2 3.78Å; F301-F305 HydrophobicContact CZ-CG 4.37Å; F301-F305 WeakPolarHBondContact O-CB 3.49Å; F301-F305 PolarHBondContact O-N 3.05Å; L302-F305 PolarHBondContact O-N 3.38Å; F305-K307 VanDerWaalsContact C-N 3.33Å; F305-K307 PolarHBondContact O-N 3.06Å; F305-F315 HydrophobicContact CD1-CE2 4.16Å; F305-F315 AromaticContact CD1-CZ 3.75Å; F305-F315 HydrophobicContact CD1-CZ 3.75Å; F305-F315 HydrophobicContact CE1-CE2 4.11Å; F305-F315 AromaticContact CE1-CZ 3.98Å; F305-F315 HydrophobicContact CE1-CZ 3.98Å; F305-K319 PolarHBondContact O-NZ 3.36Å
306Q92.4Very high93.7Very high15 Ų1574.4 Ų74.47%0.0738%0.379CS..THydrogen-bonded Turntrans41.852.4175.9-58-166.711.200114.1S264 Q267 N304 D308 R309 F315S264-Q306 PolarHBondContact O-NE2 3.02Å; Q267-Q306 VanDerWaalsContact OE1-NE2 3.1Å; N304-Q306 PolarHBondContact O-N 3.19Å; Q306-D308 VanDerWaalsContact CA-OD1 3.28Å; Q306-D308 WeakPolarHBondContact CA-OD1 3.48Å; Q306-D308 PolarHBondContact O-N 2.99Å; Q306-R309 HydrophobicContact CB-CG 4.5Å; Q306-R309 PolarHBondContact O-N 3.07Å; Q306-F315 HydrophobicContact CB-CE1 4.15Å; Q306-F315 HydrophobicContact CB-CZ 4.09Å
307K89.6Confident93.7Very high119 Ų11974.5 Ų74.552%0.51738%0.375SS..THydrogen-bonded Turntrans-62.2-19.9179.3-77.9-179.7163.7166.30114S303 N304 F305 R309 T310S303-K307 WeakPolarHBondContact O-CE 3.35Å; S303-K307 PolarHBondContact O-NZ 2.88Å; N304-K307 PolarHBondContact OD1-NZ 2.8Å; F305-K307 VanDerWaalsContact C-N 3.33Å; F305-K307 PolarHBondContact O-N 3.06Å; K307-R309 PolarHBondContact O-N 3.31Å; K307-T310 WeakPolarHBondContact O-CG2 3.49Å
308D90.4Very high93.6Very high127 Ų12768.7 Ų68.768%0.67935%0.351SS*.THydrogen-bonded Turntrans-66.2-20.6177.353.7-53.6000113.3Q306 T310Q306-D308 VanDerWaalsContact CA-OD1 3.28Å; Q306-D308 WeakPolarHBondContact CA-OD1 3.48Å; Q306-D308 PolarHBondContact O-N 2.99Å; D308-T310 VanDerWaalsContact C-N 3.28Å; D308-T310 PolarHBondContact O-N 2.69Å; D308-T310 VanDerWaalsContact O-N 3.08Å
309R90.8Very high93.6Very high62 Ų6269 Ų6923%0.23435%0.352CS..  trans-84.561.2176-63.6-177.4175.3-84.1-3.3112.4Q306 K307 D311 F315 N316Q306-R309 HydrophobicContact CB-CG 4.5Å; Q306-R309 PolarHBondContact O-N 3.07Å; K307-R309 PolarHBondContact O-N 3.31Å; R309-D311 VanDerWaalsContact C-N 3.32Å; R309-F315 HydrophobicContact CB-CD1 4.08Å; R309-F315 HydrophobicContact CB-CE1 4.22Å; R309-N316 PolarHBondContact O-ND2 2.66Å
310T86.4Confident93.6Very high113 Ų11372 Ų7269%0.69337%0.371SS*.  trans-75.6-21.3-178.9540000113.7K307 D308K307-T310 WeakPolarHBondContact O-CG2 3.49Å; D308-T310 VanDerWaalsContact C-N 3.28Å; D308-T310 PolarHBondContact O-N 2.69Å; D308-T310 VanDerWaalsContact O-N 3.08Å
311D91.5Very high93.6Very high138 Ų13872.2 Ų72.274%0.73837%0.365SS*.SBendtrans-81-16.4-179.958.4-36.4000113.7R309 E313R309-D311 VanDerWaalsContact C-N 3.32Å; D311-E313 PolarHBondContact O-N 3.13Å
312D92.6Very high93.6Very high47 Ų4769.4 Ų69.425%0.25135%0.353SS..  trans-92.783.6177.1-167.3-23.5000110.5Q314 F315 N316D312-Q314 VanDerWaalsContact C-N 3.31Å; D312-Q314 PolarHBondContact O-N 2.91Å; D312-F315 HydrophobicContact CB-CB 3.9Å; D312-F315 PolarHBondContact O-N 3.21Å; D312-F315 WeakPolarHBondContact OD1-CB 3.01Å; D312-F315 PolarHBondContact OD1-N 2.97Å; D312-N316 PolarHBondContact O-N 3.17Å; D312-N316 VanDerWaalsContact O-N 3.16Å; D312-N316 PolarHBondContact O-ND2 3.07Å
313E93.9Very high93.6Very high155 Ų15570.3 Ų70.372%0.72436%0.357SS*.Hα-helixtrans-57.6-43.3179.5-69.8-175.2171.700111.8D311 F315 N316 D317D311-E313 PolarHBondContact O-N 3.13Å; E313-F315 PolarHBondContact O-N 3.47Å; E313-N316 PolarHBondContact O-N 3.48Å; E313-N316 VanDerWaalsContact O-N 3.14Å; E313-D317 PolarHBondContact O-N 3.37Å
314Q94Very high93.7Very high128 Ų12873.9 Ų73.960%0.59837%0.367SS*.Hα-helixtrans-59.1-46.4179.5-178.3-179.4-8.700111.3D312 N316 D317 E318D312-Q314 VanDerWaalsContact C-N 3.31Å; D312-Q314 PolarHBondContact O-N 2.91Å; Q314-N316 VanDerWaalsContact C-N 3.32Å; Q314-N316 PolarHBondContact O-N 2.94Å; Q314-D317 PolarHBondContact O-N 2.99Å; Q314-E318 HydrophobicContact CG-CG 4.46Å; Q314-E318 PolarHBondContact NE2-OE1 2.86Å; Q314-E318 VanDerWaalsContact NE2-OE1 3.15Å; Q314-E318 WeakPolarHBondContact O-CB 3.29Å; Q314-E318 VanDerWaalsContact O-CG 3.31Å; Q314-E318 WeakPolarHBondContact O-CG 3.44Å; Q314-E318 PolarHBondContact O-N 2.99Å
315F94.4Very high93.8Very high2 Ų272.4 Ų72.41%0.00936%0.357CS..Hα-helixtrans-60.9-41.6176.9169.1-113.9000112.3F268 F271 F305 Q306 R309 D312 E313 E318 K319F268-F315 HydrophobicContact CD2-CD2 4.37Å; F268-F315 HydrophobicContact CD2-CE2 4.23Å; F268-F315 HydrophobicContact CE2-CB 4.44Å; F268-F315 AromaticContact CE2-CD2 3.69Å; F268-F315 HydrophobicContact CE2-CD2 3.69Å; F268-F315 HydrophobicContact CE2-CE2 4.01Å; F268-F315 AromaticContact CE2-CG 3.96Å; F268-F315 HydrophobicContact CE2-CG 3.96Å; F271-F315 AromaticContact CD1-CD2 3.99Å; F271-F315 HydrophobicContact CD1-CD2 3.99Å; F271-F315 AromaticContact CD1-CE2 3.81Å; F271-F315 HydrophobicContact CD1-CE2 3.81Å; F271-F315 HydrophobicContact CD2-CE2 4.21Å; F271-F315 AromaticContact CE1-CD2 3.65Å; F271-F315 HydrophobicContact CE1-CD2 3.65Å; F271-F315 AromaticContact CE1-CE2 3.72Å; F271-F315 HydrophobicContact CE1-CE2 3.72Å; F271-F315 HydrophobicContact CE2-CE2 4.11Å; F271-F315 HydrophobicContact CG-CE2 4.06Å; F271-F315 HydrophobicContact CZ-CD2 4.07Å; F271-F315 AromaticContact CZ-CE2 3.87Å; F271-F315 HydrophobicContact CZ-CE2 3.87Å; F305-F315 HydrophobicContact CD1-CE2 4.16Å; F305-F315 AromaticContact CD1-CZ 3.75Å; F305-F315 HydrophobicContact CD1-CZ 3.75Å; F305-F315 HydrophobicContact CE1-CE2 4.11Å; F305-F315 AromaticContact CE1-CZ 3.98Å; F305-F315 HydrophobicContact CE1-CZ 3.98Å; Q306-F315 HydrophobicContact CB-CE1 4.15Å; Q306-F315 HydrophobicContact CB-CZ 4.09Å; R309-F315 HydrophobicContact CB-CD1 4.08Å; R309-F315 HydrophobicContact CB-CE1 4.22Å; D312-F315 HydrophobicContact CB-CB 3.9Å; D312-F315 PolarHBondContact O-N 3.21Å; D312-F315 WeakPolarHBondContact OD1-CB 3.01Å; D312-F315 PolarHBondContact OD1-N 2.97Å; E313-F315 PolarHBondContact O-N 3.47Å; F315-E318 PolarHBondContact O-N 3.43Å; F315-K319 HydrophobicContact CE1-CD 4.44Å; F315-K319 HydrophobicContact CZ-CD 4.23Å; F315-K319 VanDerWaalsContact O-CB 3.31Å; F315-K319 WeakPolarHBondContact O-CB 3.07Å; F315-K319 PolarHBondContact O-N 3.36Å
316N94.1Very high93.8Very high38 Ų3872.1 Ų72.120%0.20336%0.356CS..Hα-helixtrans-68.6-37-179.8-72.5-56000112.6R309 D312 E313 Q314 K319 T320R309-N316 PolarHBondContact O-ND2 2.66Å; D312-N316 PolarHBondContact O-N 3.17Å; D312-N316 VanDerWaalsContact O-N 3.16Å; D312-N316 PolarHBondContact O-ND2 3.07Å; E313-N316 PolarHBondContact O-N 3.48Å; E313-N316 VanDerWaalsContact O-N 3.14Å; Q314-N316 VanDerWaalsContact C-N 3.32Å; Q314-N316 PolarHBondContact O-N 2.94Å; N316-K319 PolarHBondContact O-N 3.13Å; N316-K319 PolarHBondContact OD1-NZ 3.31Å; N316-T320 WeakPolarHBondContact O-CB 3.3Å; N316-T320 PolarHBondContact O-N 3.3Å; N316-T320 PolarHBondContact O-OG1 3.38Å
317D95.4Very high93.9Very high115 Ų11578.5 Ų78.562%0.61538%0.38SS*.Hα-helixtrans-66.2-46.4172.5-76.7-12.1000111.6E313 Q314 K319 T320 Y321E313-D317 PolarHBondContact O-N 3.37Å; Q314-D317 PolarHBondContact O-N 2.99Å; D317-K319 VanDerWaalsContact C-N 3.3Å; D317-K319 PolarHBondContact O-N 3.13Å; D317-T320 PolarHBondContact O-N 2.52Å; D317-Y321 WeakPolarHBondContact O-CB 3.42Å; D317-Y321 PolarHBondContact O-N 3.31Å
318E95.6Very high94.1Very high35 Ų3577 Ų7716%0.16438%0.377CS..Hα-helixtrans-58-44.1175.3-75.5-177.2176.400110.8F271 H272 K275 Q314 F315 T320 Y321 L322F271-E318 HydrophobicContact CE1-CB 4.13Å; F271-E318 HydrophobicContact CZ-CB 4.12Å; H272-E318 IonicContact ND1-OE2 3.32Å; K275-E318 VanDerWaalsContact CD-OE2 3.32Å; K275-E318 WeakPolarHBondContact CD-OE2 3.48Å; K275-E318 IonicContact NZ-OE1 3.92Å; K275-E318 PolarHBondContact NZ-OE1 2.91Å; K275-E318 IonicContact NZ-OE2 2.7Å; K275-E318 PolarHBondContact NZ-OE2 3.33Å; Q314-E318 HydrophobicContact CG-CG 4.46Å; Q314-E318 PolarHBondContact NE2-OE1 2.86Å; Q314-E318 VanDerWaalsContact NE2-OE1 3.15Å; Q314-E318 WeakPolarHBondContact O-CB 3.29Å; Q314-E318 VanDerWaalsContact O-CG 3.31Å; Q314-E318 WeakPolarHBondContact O-CG 3.44Å; Q314-E318 PolarHBondContact O-N 2.99Å; F315-E318 PolarHBondContact O-N 3.43Å; E318-T320 PolarHBondContact O-N 3.13Å; E318-Y321 WeakPolarHBondContact O-CB 3.37Å; E318-Y321 PolarHBondContact O-N 3.37Å; E318-L322 WeakPolarHBondContact O-CB 3.19Å; E318-L322 VanDerWaalsContact O-CG 3.22Å; E318-L322 WeakPolarHBondContact O-CG 3.28Å; E318-L322 PolarHBondContact O-N 3Å
319K96Very high94.1Very high18 Ų1872.3 Ų72.38%0.07835%0.352CS..Hα-helixtrans-61.9-45.4177.5-171.2173.475.6-1610111.9F271 L302 F305 F315 N316 D317 L322 I323F271-K319 HydrophobicContact CE2-CB 4.48Å; F271-K319 HydrophobicContact CZ-CB 4.29Å; L302-K319 VanDerWaalsContact O-CD 3.26Å; L302-K319 WeakPolarHBondContact O-CD 3.34Å; F305-K319 PolarHBondContact O-NZ 3.36Å; F315-K319 HydrophobicContact CE1-CD 4.44Å; F315-K319 HydrophobicContact CZ-CD 4.23Å; F315-K319 VanDerWaalsContact O-CB 3.31Å; F315-K319 WeakPolarHBondContact O-CB 3.07Å; F315-K319 PolarHBondContact O-N 3.36Å; N316-K319 PolarHBondContact O-N 3.13Å; N316-K319 PolarHBondContact OD1-NZ 3.31Å; D317-K319 VanDerWaalsContact C-N 3.3Å; D317-K319 PolarHBondContact O-N 3.13Å; K319-L322 PolarHBondContact O-N 3.43Å; K319-I323 HydrophobicContact CG-CD1 4.3Å; K319-I323 WeakPolarHBondContact O-CG1 3.34Å; K319-I323 PolarHBondContact O-N 3.06Å
320T95.6Very high93.7Very high92 Ų9277.9 Ų77.956%0.56438%0.378SS*.Hα-helixtrans-63.1-43.6177.3-58.60000111.2N316 D317 E318 I323 K324N316-T320 WeakPolarHBondContact O-CB 3.3Å; N316-T320 PolarHBondContact O-N 3.3Å; N316-T320 PolarHBondContact O-OG1 3.38Å; D317-T320 PolarHBondContact O-N 2.52Å; E318-T320 PolarHBondContact O-N 3.13Å; T320-I323 PolarHBondContact O-N 3.02Å; T320-K324 PolarHBondContact O-N 3.48Å; T320-K324 VanDerWaalsContact O-N 3.08Å
321Y96.4Very high93Very high110 Ų11080.9 Ų80.943%0.43138%0.381SS..Hα-helixtrans-59.1-47.3174.6172.1-99.6000111.9A279 D317 E318 I323 K324 Q325A279-Y321 HydrophobicContact CB-CE1 4.17Å; D317-Y321 WeakPolarHBondContact O-CB 3.42Å; D317-Y321 PolarHBondContact O-N 3.31Å; E318-Y321 WeakPolarHBondContact O-CB 3.37Å; E318-Y321 PolarHBondContact O-N 3.37Å; Y321-I323 PolarHBondContact O-N 3.11Å; Y321-K324 WeakPolarHBondContact O-CB 3.45Å; Y321-K324 PolarHBondContact O-N 3.33Å; Y321-Q325 HydrophobicContact CD1-CG 4.16Å; Y321-Q325 HydrophobicContact CD2-CG 4.33Å; Y321-Q325 HydrophobicContact CE1-CG 3.69Å; Y321-Q325 HydrophobicContact CE2-CG 3.88Å; Y321-Q325 HydrophobicContact CG-CG 4.46Å; Y321-Q325 WeakPolarHBondContact O-CG 3.45Å; Y321-Q325 PolarHBondContact O-N 2.95Å; Y321-Q325 PolarHBondContact OH-NE2 3.13Å
322L96.6Very high91.5Very high2 Ų277.6 Ų77.61%0.0137%0.368CS..Hα-helixtrans-63.7-41.4179.2-69.4-178.4000112.7F271 F274 K275 V278 L302 E318 K319 K324 Q325 I326F271-L322 HydrophobicContact CD2-CD1 4.3Å; F271-L322 HydrophobicContact CE1-CD1 4.47Å; F271-L322 HydrophobicContact CE2-CD1 3.48Å; F271-L322 VanDerWaalsContact CE2-CD1 3.48Å; F271-L322 HydrophobicContact CZ-CD1 3.57Å; F274-L322 HydrophobicContact CD1-CD1 4.46Å; K275-L322 HydrophobicContact CB-CD1 3.68Å; K275-L322 HydrophobicContact CB-CD2 3.95Å; K275-L322 HydrophobicContact CB-CG 4.29Å; V278-L322 HydrophobicContact CB-CD2 3.63Å; V278-L322 HydrophobicContact CG1-CD2 3.57Å; V278-L322 HydrophobicContact CG2-CD2 4.42Å; L302-L322 HydrophobicContact CD1-CB 4.27Å; E318-L322 WeakPolarHBondContact O-CB 3.19Å; E318-L322 VanDerWaalsContact O-CG 3.22Å; E318-L322 WeakPolarHBondContact O-CG 3.28Å; E318-L322 PolarHBondContact O-N 3Å; K319-L322 PolarHBondContact O-N 3.43Å; L322-K324 VanDerWaalsContact C-N 3.3Å; L322-K324 PolarHBondContact O-N 3.49Å; L322-Q325 PolarHBondContact O-N 2.69Å; L322-I326 WeakPolarHBondContact O-CB 3.37Å; L322-I326 VanDerWaalsContact O-CG1 3.3Å; L322-I326 WeakPolarHBondContact O-CG1 3.45Å; L322-I326 PolarHBondContact O-N 3.37Å
323I96.3Very high89.8Confident19 Ų1980.3 Ų80.310%0.09740%0.397CS..Hα-helixtrans-59.3-44.7175.5-71.3164.3000110.4I299 L302 K319 T320 Y321 I326 R327I299-I323 HydrophobicContact CG2-CG2 4.08Å; L302-I323 HydrophobicContact CB-CD1 4.02Å; L302-I323 HydrophobicContact CB-CG1 3.69Å; L302-I323 HydrophobicContact CD1-CG1 4.23Å; K319-I323 HydrophobicContact CG-CD1 4.3Å; K319-I323 WeakPolarHBondContact O-CG1 3.34Å; K319-I323 PolarHBondContact O-N 3.06Å; T320-I323 PolarHBondContact O-N 3.02Å; Y321-I323 PolarHBondContact O-N 3.11Å; I323-I326 PolarHBondContact O-N 3.19Å; I323-R327 WeakPolarHBondContact O-CB 3.45Å; I323-R327 PolarHBondContact O-N 3.33Å
324K96.1Very high87.5Confident124 Ų12481.9 Ų81.954%0.53943%0.425SS..Hα-helixtrans-61.4-49.9176-176.7-180177.8-177.40111.3T320 Y321 L322 I326 R327 D328T320-K324 PolarHBondContact O-N 3.48Å; T320-K324 VanDerWaalsContact O-N 3.08Å; Y321-K324 WeakPolarHBondContact O-CB 3.45Å; Y321-K324 PolarHBondContact O-N 3.33Å; L322-K324 VanDerWaalsContact C-N 3.3Å; L322-K324 PolarHBondContact O-N 3.49Å; K324-I326 VanDerWaalsContact C-N 3.33Å; K324-I326 PolarHBondContact O-N 2.82Å; K324-R327 PolarHBondContact O-N 3.35Å; K324-D328 WeakPolarHBondContact CG-OD2 3.08Å; K324-D328 WeakPolarHBondContact O-CB 3.43Å; K324-D328 VanDerWaalsContact O-CG 3.29Å; K324-D328 PolarHBondContact O-N 3.16Å
325Q95.8Very high87.2Confident55 Ų5579.6 Ų79.626%0.25742%0.416SS..Hα-helixtrans-57.1-45.1178.5-73.9-64-39.900112.2V278 Y321 L322 D328 L329V278-Q325 HydrophobicContact CG1-CB 3.7Å; Y321-Q325 HydrophobicContact CD1-CG 4.16Å; Y321-Q325 HydrophobicContact CD2-CG 4.33Å; Y321-Q325 HydrophobicContact CE1-CG 3.69Å; Y321-Q325 HydrophobicContact CE2-CG 3.88Å; Y321-Q325 HydrophobicContact CG-CG 4.46Å; Y321-Q325 WeakPolarHBondContact O-CG 3.45Å; Y321-Q325 PolarHBondContact O-N 2.95Å; Y321-Q325 PolarHBondContact OH-NE2 3.13Å; L322-Q325 PolarHBondContact O-N 2.69Å; Q325-D328 PolarHBondContact O-N 3.37Å; Q325-L329 WeakPolarHBondContact O-CG 3.14Å; Q325-L329 PolarHBondContact O-N 2.79Å
326I95Very high86.8Confident0 Ų083.7 Ų83.70%044%0.437CS..Hα-helixtrans-66.8-39.8179-67.5167.5000111.1F274 V278 Q295 L298 I299 L302 L322 I323 K324 D328 L329F274-I326 HydrophobicContact CE1-CD1 4.34Å; F274-I326 HydrophobicContact CZ-CD1 4.25Å; V278-I326 HydrophobicContact CG1-CD1 4.28Å; V278-I326 HydrophobicContact CG1-CG1 3.72Å; V278-I326 HydrophobicContact CG2-CD1 4.17Å; V278-I326 HydrophobicContact CG2-CG1 4.22Å; Q295-I326 HydrophobicContact CB-CG2 4.48Å; Q295-I326 HydrophobicContact CG-CG2 3.81Å; Q295-I326 PolarHBondContact NE2-O 3.2Å; L298-I326 HydrophobicContact CB-CD1 4.22Å; L298-I326 HydrophobicContact CB-CG2 4.41Å; I299-I326 HydrophobicContact CD1-CG2 4.21Å; I299-I326 HydrophobicContact CG1-CB 4.36Å; I299-I326 HydrophobicContact CG1-CG2 3.85Å; L302-I326 HydrophobicContact CD1-CD1 3.58Å; L322-I326 WeakPolarHBondContact O-CB 3.37Å; L322-I326 VanDerWaalsContact O-CG1 3.3Å; L322-I326 WeakPolarHBondContact O-CG1 3.45Å; L322-I326 PolarHBondContact O-N 3.37Å; I323-I326 PolarHBondContact O-N 3.19Å; K324-I326 VanDerWaalsContact C-N 3.33Å; K324-I326 PolarHBondContact O-N 2.82Å; I326-D328 VanDerWaalsContact C-N 3.33Å; I326-L329 HydrophobicContact CG2-CD1 4.47Å; I326-L329 WeakPolarHBondContact O-CB 3.36Å; I326-L329 PolarHBondContact O-N 3.24Å
327R94.9Very high86.4Confident150 Ų15086.2 Ų86.257%0.56645%0.45SS*.Hα-helixtrans-63.5-39.8176.4-174.8-177.9-63.8149.91.6112.1Q295 I299 I323 K324 L329Q295-R327 PolarHBondContact NE2-O 2.97Å; I299-R327 HydrophobicContact CD1-CB 3.95Å; I299-R327 HydrophobicContact CD1-CG 4.46Å; I323-R327 WeakPolarHBondContact O-CB 3.45Å; I323-R327 PolarHBondContact O-N 3.33Å; K324-R327 PolarHBondContact O-N 3.35Å; R327-L329 VanDerWaalsContact C-N 3.26Å; R327-L329 PolarHBondContact O-N 3.14Å
328D93.4Very high85.9Confident88 Ų8884.5 Ų84.547%0.47144%0.441SS..THydrogen-bonded Turntrans-81.4-3.9-177.7-64.3-16.8000112.8K324 Q325 I326 K330K324-D328 WeakPolarHBondContact CG-OD2 3.08Å; K324-D328 WeakPolarHBondContact O-CB 3.43Å; K324-D328 VanDerWaalsContact O-CG 3.29Å; K324-D328 PolarHBondContact O-N 3.16Å; Q325-D328 PolarHBondContact O-N 3.37Å; I326-D328 VanDerWaalsContact C-N 3.33Å; D328-K330 PolarHBondContact O-N 3.43Å
329L90.6Very high85.3Confident27 Ų2787.6 Ų87.614%0.14146%0.458CS..  trans-59122171.8-74.1172000110.1K283 L291 L292 Q295 Q325 I326 R327K283-L329 HydrophobicContact CD-CD2 4.02Å; L291-L329 HydrophobicContact CB-CD1 3.55Å; L291-L329 HydrophobicContact CD1-CD1 4.03Å; L291-L329 HydrophobicContact CG-CD1 4.42Å; L292-L329 HydrophobicContact CD2-CB 3.78Å; L292-L329 HydrophobicContact CG-CB 4.47Å; Q295-L329 PolarHBondContact NE2-O 3.47Å; Q325-L329 WeakPolarHBondContact O-CG 3.14Å; Q325-L329 PolarHBondContact O-N 2.79Å; I326-L329 HydrophobicContact CG2-CD1 4.47Å; I326-L329 WeakPolarHBondContact O-CB 3.36Å; I326-L329 PolarHBondContact O-N 3.24Å; R327-L329 VanDerWaalsContact C-N 3.26Å; R327-L329 PolarHBondContact O-N 3.14Å
330K82.6Confident84.5Confident179 Ų17992.3 Ų92.378%0.77848%0.483SS*.  trans-113.9153172.8-65.4177.8-175.4178.50109D328D328-K330 PolarHBondContact O-N 3.43Å
331K71.8Confident83.7Confident176 Ų17692.3 Ų92.377%0.76548%0.478SS*.PPolyproline II helixtrans-59.3129.5166.1-74.7-177.3178-178.10107.7L292 A333L292-K331 HydrophobicContact CD1-CG 3.84Å; K331-A333 PolarHBondContact O-N 3.06Å
332P61.4Low82.8Confident70 Ų7090.9 Ų90.946%0.45548%0.481SS..PPolyproline II helixtrans-56.1140170.520-26000108.5S334P332-S334 PolarHBondContact O-N 3.33Å; P332-S334 VanDerWaalsContact O-N 3.16Å
333A56.6Low81.6Confident104 Ų10498.3 Ų98.386%0.8652%0.52SS*.PPolyproline II helixtrans-58.1122.417700000108K331K331-A333 PolarHBondContact O-N 3.06Å
334S44.9Very low80.3Confident188 Ų188105.5 Ų105.5100%1.31556%0.559SS**  trans-61.20-178.451.80000112.9P332P332-S334 PolarHBondContact O-N 3.33Å; P332-S334 VanDerWaalsContact O-N 3.16Å

Retrieved 334 of 334 residues in 237.2 ms (Link to these results)

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