A0A087Y8W9_POEFO Loading...

G protein-coupled receptor 161b

AlphaFold DB , UniProt , Accession A0A087Y8W9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 522 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
1M31.9Very low44.8Very low239 Ų239118.3 Ų118.3100%1.17770%0.697SS**  0110.10-80.9163.8154.600107.7A3M1-A3 PolarHBondContact O-N 3.45Å
2N37.6Very low44.8Very low163 Ų163119.2 Ų119.287%0.87270%0.697SS**  trans-84.2108.3-177.3-69.4-4.2000109.4
3A34.3Very low46.1Very low86 Ų86113.9 Ų113.971%0.71168%0.683SS**  trans-99.175.4167.100000109.1M1 R5M1-A3 PolarHBondContact O-N 3.45Å; A3-R5 PolarHBondContact O-N 2.74Å
4S38.4Very low47.8Very low99 Ų99113.9 Ų113.969%0.69268%0.678SS**  trans-65.683.3158.850.10000107.8N6S4-N6 VanDerWaalsContact C-N 3.32Å; S4-N6 PolarHBondContact O-N 3.45Å
5R48.4Very low49.9Very low178 Ų178110.1 Ų110.167%0.67267%0.671SS**  trans-65.195.9170.4-79.3-179.4169.1175.6-5.6107.3A3 C7A3-R5 PolarHBondContact O-N 2.74Å; R5-C7 PolarHBondContact O-N 3.4Å
6N46Very low51.8Low114 Ų114108.4 Ų108.461%0.6166%0.657SS**  trans-54.3115.5165.7-85.9-3.2000107.5S4 T8S4-N6 VanDerWaalsContact C-N 3.32Å; S4-N6 PolarHBondContact O-N 3.45Å; N6-T8 PolarHBondContact O-N 3.47Å
7C60.4Low53.3Low26 Ų26102.8 Ų102.818%0.17662%0.624CS.*  trans-73.673178.5-54.40000109.2R5 S9 C163R5-C7 PolarHBondContact O-N 3.4Å; C7-S9 PolarHBondContact O-N 2.61Å; C7-C163 HydrophobicContact CB-CB 3.73Å; C7-C163 WeakPolarHBondContact CB-SG 3.41Å; C7-C163 VanDerWaalsContact SG-CA 3.53Å; C7-C163 WeakPolarHBondContact SG-CB 3.4Å; C7-C163 CovalentContact SG-SG 2.04Å; C7-C163 PolarHBondContact SG-SG 2.92Å
8T49.7Very low55.1Low116 Ų116102 Ų10271%0.71262%0.619SS**  trans-6598.9175.248.80000109N6 V10N6-T8 PolarHBondContact O-N 3.47Å; T8-V10 PolarHBondContact O-N 3.31Å; T8-V10 VanDerWaalsContact O-N 3.12Å
9S48.7Very low56.8Low76 Ų76101.8 Ų101.853%0.53161%0.614SS.*  trans-57.6115167.3172.80000108.4C7 G11C7-S9 PolarHBondContact O-N 2.61Å; S9-G11 VanDerWaalsContact C-N 3.33Å; S9-G11 PolarHBondContact O-N 2.92Å
10V47.5Very low58.3Low138 Ų13897.6 Ų97.684%0.83659%0.587SS**  trans-75.393.8170.3177.90000107.1T8T8-V10 PolarHBondContact O-N 3.31Å; T8-V10 VanDerWaalsContact O-N 3.12Å
11G49.5Very low59.7Low66 Ų6694 Ų9468%0.6857%0.567SS**SBendtrans49.668.1157.900000117.5S9S9-G11 VanDerWaalsContact C-N 3.33Å; S9-G11 PolarHBondContact O-N 2.92Å
12N44.7Very low62.6Low129 Ų12986.4 Ų86.469%0.6953%0.534SS*.  trans-157.7107.8145.7-113.7-10.6000113.6
13G61.9Low65.1Low51 Ų5180 Ų8053%0.52650%0.502SS..  trans61.1107.4157.500000118.8G15 L16G13-G15 PolarHBondContact O-N 2.97Å; G13-G15 VanDerWaalsContact O-N 3.14Å; G13-L16 WeakPolarHBondContact O-CB 3.42Å; G13-L16 PolarHBondContact O-N 3.05Å
14D70Confident67.9Low114 Ų11476 Ų7661%0.6147%0.468SS*.Hα-helixtrans-56.6-29164.9-73.6-53.4000113L16 A17 V18 R81D14-L16 VanDerWaalsContact C-N 3.28Å; D14-L16 PolarHBondContact O-N 3.12Å; D14-A17 PolarHBondContact O-N 3.35Å; D14-V18 WeakPolarHBondContact O-CG2 3.34Å; D14-V18 PolarHBondContact O-N 3.41Å; D14-R81 IonicContact OD1-CZ 3.18Å; D14-R81 IonicContact OD1-NH1 3.73Å; D14-R81 IonicContact OD1-NH2 2.84Å; D14-R81 PolarHBondContact OD1-NH2 3.48Å
15G78.9Confident70.6Confident56 Ų5674.5 Ų74.558%0.57746%0.455SS*.Hα-helixtrans-59.8-32.9171.700000114.1G13 L19G13-G15 PolarHBondContact O-N 2.97Å; G13-G15 VanDerWaalsContact O-N 3.14Å; G15-L19 WeakPolarHBondContact O-CB 3.45Å; G15-L19 PolarHBondContact O-N 3.32Å
16L80.2Confident72.7Confident84 Ų8469.2 Ų69.244%0.4444%0.442SS..Hα-helixtrans-67.3-51174.6179.260.2000109.9G13 D14 V18 L19 E20G13-L16 WeakPolarHBondContact O-CB 3.42Å; G13-L16 PolarHBondContact O-N 3.05Å; D14-L16 VanDerWaalsContact C-N 3.28Å; D14-L16 PolarHBondContact O-N 3.12Å; L16-V18 VanDerWaalsContact C-N 3.3Å; L16-V18 PolarHBondContact O-N 3.27Å; L16-L19 CarbonylContact O-C 3.51Å; L16-L19 WeakPolarHBondContact O-CA 3.36Å; L16-L19 VanDerWaalsContact O-CB 3.32Å; L16-L19 WeakPolarHBondContact O-CB 3.41Å; L16-L19 PolarHBondContact O-N 2.9Å; L16-E20 WeakPolarHBondContact O-CG 3.46Å; L16-E20 PolarHBondContact O-N 3.24Å
17A78.2Confident75Confident12 Ų1264.7 Ų64.710%0.09942%0.418CS..Hα-helixtrans-64.2-31.2179.600000113.9D14 E20 S21 R81D14-A17 PolarHBondContact O-N 3.35Å; A17-E20 PolarHBondContact O-N 3.23Å; A17-S21 PolarHBondContact O-N 3.03Å; A17-S21 VanDerWaalsContact O-N 3.11Å; A17-S21 PolarHBondContact O-OG 3.27Å; A17-R81 VanDerWaalsContact CB-NH2 3.3Å
18V86.3Confident76.6Confident89 Ų8964.1 Ų64.154%0.53941%0.414SS..Hα-helixtrans-66.5-45.9170170.20000110.3D14 L16 E20 S21 V22D14-V18 WeakPolarHBondContact O-CG2 3.34Å; D14-V18 PolarHBondContact O-N 3.41Å; L16-V18 VanDerWaalsContact C-N 3.3Å; L16-V18 PolarHBondContact O-N 3.27Å; V18-E20 VanDerWaalsContact C-N 3.3Å; V18-E20 PolarHBondContact O-N 2.94Å; V18-S21 PolarHBondContact O-N 3.06Å; V18-V22 HydrophobicContact CG1-CG2 4.28Å; V18-V22 WeakPolarHBondContact O-CB 3.42Å; V18-V22 VanDerWaalsContact O-CG2 3.28Å; V18-V22 WeakPolarHBondContact O-CG2 3.38Å; V18-V22 PolarHBondContact O-N 3.48Å
19L87.5Confident78.8Confident98 Ų9863.4 Ų63.451%0.51341%0.405SS..Hα-helixtrans-58.4-41.5172.9-178.864.7000111.2G15 L16 S21 V22 S23G15-L19 WeakPolarHBondContact O-CB 3.45Å; G15-L19 PolarHBondContact O-N 3.32Å; L16-L19 CarbonylContact O-C 3.51Å; L16-L19 WeakPolarHBondContact O-CA 3.36Å; L16-L19 VanDerWaalsContact O-CB 3.32Å; L16-L19 WeakPolarHBondContact O-CB 3.41Å; L16-L19 PolarHBondContact O-N 2.9Å; L19-S21 PolarHBondContact O-N 3.28Å; L19-V22 PolarHBondContact O-N 3.22Å; L19-S23 VanDerWaalsContact O-CB 3.26Å; L19-S23 WeakPolarHBondContact O-CB 3.46Å; L19-S23 PolarHBondContact O-N 3.09Å; L19-S23 PolarHBondContact O-OG 3.42Å; L19-S23 VanDerWaalsContact O-OG 3.05Å
20E85.5Confident80.9Confident18 Ų1864.3 Ų64.38%0.08440%0.403CS..Hα-helixtrans-55.6-52.5175.6-60.8-172.6159.200111.9L16 A17 V18 S23 I24 R166 W300L16-E20 WeakPolarHBondContact O-CG 3.46Å; L16-E20 PolarHBondContact O-N 3.24Å; A17-E20 PolarHBondContact O-N 3.23Å; V18-E20 VanDerWaalsContact C-N 3.3Å; V18-E20 PolarHBondContact O-N 2.94Å; E20-S23 PolarHBondContact O-N 2.99Å; E20-I24 WeakPolarHBondContact O-CG1 3.45Å; E20-I24 PolarHBondContact O-N 3.16Å; E20-R166 IonicContact OE2-CZ 3.9Å; E20-R166 IonicContact OE2-NE 2.72Å; E20-R166 PolarHBondContact OE2-NE 3.36Å; E20-R166 IonicContact OE2-NH2 3.47Å; E20-R166 PolarHBondContact OE2-NH2 3.41Å; E20-W300 HydrophobicContact CB-CH2 4.29Å; E20-W300 HydrophobicContact CB-CZ2 3.71Å; E20-W300 HydrophobicContact CG-CH2 4.32Å; E20-W300 HydrophobicContact CG-CZ2 3.78Å
21S88.1Confident83.2Confident22 Ų2257.8 Ų57.815%0.15436%0.364CS..Hα-helixtrans-66.1-43.5-176.6-55.50000111.6A17 V18 L19 I24 V25 S78A17-S21 PolarHBondContact O-N 3.03Å; A17-S21 VanDerWaalsContact O-N 3.11Å; A17-S21 PolarHBondContact O-OG 3.27Å; V18-S21 PolarHBondContact O-N 3.06Å; L19-S21 PolarHBondContact O-N 3.28Å; S21-I24 PolarHBondContact O-N 3.48Å; S21-V25 WeakPolarHBondContact O-CB 3.42Å; S21-V25 VanDerWaalsContact O-CG2 3.28Å; S21-V25 WeakPolarHBondContact O-CG2 3.43Å; S21-V25 PolarHBondContact O-N 3.13Å; S21-S78 WeakPolarHBondContact CA-OG 3.41Å; S21-S78 PolarHBondContact OG-OG 3.06Å
22V92.2Very high85.3Confident80 Ų8056.2 Ų56.249%0.48534%0.342SS..Hα-helixtrans-64.9-41.5178171.30000111.3V18 L19 T26V18-V22 HydrophobicContact CG1-CG2 4.28Å; V18-V22 WeakPolarHBondContact O-CB 3.42Å; V18-V22 VanDerWaalsContact O-CG2 3.28Å; V18-V22 WeakPolarHBondContact O-CG2 3.38Å; V18-V22 PolarHBondContact O-N 3.48Å; L19-V22 PolarHBondContact O-N 3.22Å; V22-T26 WeakPolarHBondContact O-CB 3.34Å; V22-T26 PolarHBondContact O-N 3.41Å; V22-T26 PolarHBondContact O-OG1 3.47Å
23S91.6Very high87.7Confident28 Ų2855 Ų5520%0.19634%0.335CS..Hα-helixtrans-63.3-47.2177.2-71.80000111.9L19 E20 T26 I27 W300L19-S23 VanDerWaalsContact O-CB 3.26Å; L19-S23 WeakPolarHBondContact O-CB 3.46Å; L19-S23 PolarHBondContact O-N 3.09Å; L19-S23 PolarHBondContact O-OG 3.42Å; L19-S23 VanDerWaalsContact O-OG 3.05Å; E20-S23 PolarHBondContact O-N 2.99Å; S23-T26 PolarHBondContact O-N 3.4Å; S23-I27 WeakPolarHBondContact O-CD1 3.43Å; S23-I27 VanDerWaalsContact O-CG1 3.26Å; S23-I27 WeakPolarHBondContact O-CG1 3.39Å; S23-I27 PolarHBondContact O-N 3.27Å; S23-W300 WeakPolarHBondContact OG-CZ3 3.31Å
24I92.3Very high89.1Confident3 Ų353.4 Ų53.42%0.01532%0.318CS..Hα-helixtrans-64.6-42178.9-67.4168.3000111.3E20 S21 T26 I27 T28 V74 A75E20-I24 WeakPolarHBondContact O-CG1 3.45Å; E20-I24 PolarHBondContact O-N 3.16Å; S21-I24 PolarHBondContact O-N 3.48Å; I24-T26 VanDerWaalsContact C-N 3.34Å; I24-T26 PolarHBondContact O-N 3.3Å; I24-I27 PolarHBondContact O-N 3.44Å; I24-T28 WeakPolarHBondContact O-CB 3.4Å; I24-T28 PolarHBondContact O-N 3.49Å; I24-T28 PolarHBondContact O-OG1 3.47Å; I24-V74 HydrophobicContact CD1-CG1 4.47Å; I24-V74 HydrophobicContact CG2-CG1 4.17Å; I24-A75 HydrophobicContact CG2-CB 3.96Å
25V94.1Very high90.2Very high66 Ų6648 Ų4840%0.429%0.289SS..Hα-helixtrans-60-44.5173.7169.50000111S21 T28 L29 A75S21-V25 WeakPolarHBondContact O-CB 3.42Å; S21-V25 VanDerWaalsContact O-CG2 3.28Å; S21-V25 WeakPolarHBondContact O-CG2 3.43Å; S21-V25 PolarHBondContact O-N 3.13Å; V25-T28 WeakPolarHBondContact O-CB 3.31Å; V25-T28 PolarHBondContact O-N 3.05Å; V25-L29 HydrophobicContact CG1-CD1 4.11Å; V25-L29 WeakPolarHBondContact O-CG 3.39Å; V25-L29 PolarHBondContact O-N 3.07Å; V25-A75 HydrophobicContact CG2-CB 3.98Å
26T94.1Very high90.9Very high67 Ų6749.4 Ų49.441%0.41128%0.283SS..Hα-helixtrans-64.1-44.9179.1-56.30000111.8V22 S23 I24 T28 L29 L30V22-T26 WeakPolarHBondContact O-CB 3.34Å; V22-T26 PolarHBondContact O-N 3.41Å; V22-T26 PolarHBondContact O-OG1 3.47Å; S23-T26 PolarHBondContact O-N 3.4Å; I24-T26 VanDerWaalsContact C-N 3.34Å; I24-T26 PolarHBondContact O-N 3.3Å; T26-T28 VanDerWaalsContact C-N 3.32Å; T26-T28 PolarHBondContact O-N 3.28Å; T26-L29 PolarHBondContact O-N 3.41Å; T26-L30 HydrophobicContact CG2-CD1 3.98Å; T26-L30 HydrophobicContact CG2-CG 4.45Å; T26-L30 WeakPolarHBondContact O-CB 3.36Å; T26-L30 VanDerWaalsContact O-CG 3.32Å; T26-L30 WeakPolarHBondContact O-CG 3.5Å; T26-L30 PolarHBondContact O-N 3.49Å
27I93.9Very high91.4Very high19 Ų1948.5 Ų48.510%0.09728%0.279CS..Hα-helixtrans-59.2-44.2174.4-68.6162.5000110.5S23 I24 L30 A31 L71 F303 V307S23-I27 WeakPolarHBondContact O-CD1 3.43Å; S23-I27 VanDerWaalsContact O-CG1 3.26Å; S23-I27 WeakPolarHBondContact O-CG1 3.39Å; S23-I27 PolarHBondContact O-N 3.27Å; I24-I27 PolarHBondContact O-N 3.44Å; I27-L30 PolarHBondContact O-N 3.36Å; I27-A31 WeakPolarHBondContact O-CB 3.41Å; I27-A31 PolarHBondContact O-N 3.06Å; I27-L71 HydrophobicContact CG2-CD1 4.47Å; I27-F303 HydrophobicContact CG2-CB 4.08Å; I27-V307 HydrophobicContact CG2-CG2 4.06Å
28T94.4Very high91.9Very high15 Ų1548.1 Ų48.19%0.09228%0.275CS..Hα-helixtrans-59.3-49.2178.9-56.60000111.6I24 V25 T26 C32 L71 P72I24-T28 WeakPolarHBondContact O-CB 3.4Å; I24-T28 PolarHBondContact O-N 3.49Å; I24-T28 PolarHBondContact O-OG1 3.47Å; V25-T28 WeakPolarHBondContact O-CB 3.31Å; V25-T28 PolarHBondContact O-N 3.05Å; T26-T28 VanDerWaalsContact C-N 3.32Å; T26-T28 PolarHBondContact O-N 3.28Å; T28-C32 VanDerWaalsContact O-CB 3.23Å; T28-C32 WeakPolarHBondContact O-CB 3.49Å; T28-C32 PolarHBondContact O-N 3.02Å; T28-L71 HydrophobicContact CG2-CB 3.84Å; T28-L71 WeakPolarHBondContact OG1-CB 3.39Å; T28-P72 HydrophobicContact CG2-CG 4.1Å
29L94.9Very high92.2Very high101 Ų10144.8 Ų44.853%0.52926%0.255SS..Hα-helixtrans-64-45.9179.2-68.5173000111.9V25 T26 C32 L33V25-L29 HydrophobicContact CG1-CD1 4.11Å; V25-L29 WeakPolarHBondContact O-CG 3.39Å; V25-L29 PolarHBondContact O-N 3.07Å; T26-L29 PolarHBondContact O-N 3.41Å; L29-C32 PolarHBondContact O-N 3.46Å; L29-L33 WeakPolarHBondContact O-CB 3.45Å; L29-L33 VanDerWaalsContact O-CG 3.28Å; L29-L33 WeakPolarHBondContact O-CG 3.2Å; L29-L33 PolarHBondContact O-N 2.95Å
30L94.1Very high92.3Very high95 Ų9541.2 Ų41.250%0.49724%0.239SC..Hα-helixtrans-65.1-42.3178.8-70.3174.8000112.3T26 I27 G34 V307T26-L30 HydrophobicContact CG2-CD1 3.98Å; T26-L30 HydrophobicContact CG2-CG 4.45Å; T26-L30 WeakPolarHBondContact O-CB 3.36Å; T26-L30 VanDerWaalsContact O-CG 3.32Å; T26-L30 WeakPolarHBondContact O-CG 3.5Å; T26-L30 PolarHBondContact O-N 3.49Å; I27-L30 PolarHBondContact O-N 3.36Å; L30-G34 PolarHBondContact O-N 2.97Å; L30-V307 HydrophobicContact CB-CG1 4.02Å; L30-V307 HydrophobicContact CB-CG2 4.13Å
31A94.4Very high92.3Very high0 Ų040.3 Ų40.30%024%0.235CC..Hα-helixtrans-65-46.4176.900000111I27 N35 L71 A306 V307I27-A31 WeakPolarHBondContact O-CB 3.41Å; I27-A31 PolarHBondContact O-N 3.06Å; A31-N35 WeakPolarHBondContact O-CB 3.35Å; A31-N35 PolarHBondContact O-N 3.32Å; A31-N35 PolarHBondContact O-ND2 3.41Å; A31-L71 HydrophobicContact CB-CD1 4.3Å; A31-A306 HydrophobicContact CB-CB 3.97Å; A31-V307 HydrophobicContact CB-CG2 3.97Å
32C95Very high92.2Very high34 Ų3439.4 Ų39.423%0.2323%0.229CC..Hα-helixtrans-62.8-54179.2-1760000111.3T28 L29 L36 S67T28-C32 VanDerWaalsContact O-CB 3.23Å; T28-C32 WeakPolarHBondContact O-CB 3.49Å; T28-C32 PolarHBondContact O-N 3.02Å; L29-C32 PolarHBondContact O-N 3.46Å; C32-L36 WeakPolarHBondContact O-CB 3.34Å; C32-L36 PolarHBondContact O-N 3.46Å; C32-S67 VanDerWaalsContact CA-OG 3.32Å; C32-S67 WeakPolarHBondContact CA-OG 3.46Å
33L93.4Very high92Very high102 Ų10244.1 Ų44.153%0.53424%0.239SC..Hα-helixtrans-62.6-47.1-179.4-68.6170.4000111.8L29 L37L29-L33 WeakPolarHBondContact O-CB 3.45Å; L29-L33 VanDerWaalsContact O-CG 3.28Å; L29-L33 WeakPolarHBondContact O-CG 3.2Å; L29-L33 PolarHBondContact O-N 2.95Å; L33-L37 WeakPolarHBondContact O-CB 3.41Å; L33-L37 WeakPolarHBondContact O-CG 3.29Å; L33-L37 PolarHBondContact O-N 2.88Å
34G91.7Very high91.7Very high18 Ų1850.9 Ų50.919%0.18626%0.26CS..Hα-helixtrans-63.3-45.1-177.600000113.3L30 I38L30-G34 PolarHBondContact O-N 2.97Å; G34-I38 PolarHBondContact O-N 3.31Å
35N93.6Very high91.2Very high0 Ų054.7 Ų54.70%027%0.274CS..Hα-helixtrans-75-39.6178.7-70.5-74.5000111.9A31 L37 I38 V39 L64 A306 P310A31-N35 WeakPolarHBondContact O-CB 3.35Å; A31-N35 PolarHBondContact O-N 3.32Å; A31-N35 PolarHBondContact O-ND2 3.41Å; N35-L37 VanDerWaalsContact C-N 3.33Å; N35-L37 PolarHBondContact O-N 2.73Å; N35-I38 PolarHBondContact O-N 3.07Å; N35-V39 WeakPolarHBondContact O-CB 3.28Å; N35-V39 VanDerWaalsContact O-CG2 3.31Å; N35-V39 WeakPolarHBondContact O-CG2 3.42Å; N35-V39 PolarHBondContact O-N 3.23Å; N35-L64 HydrophobicContact CB-CB 3.99Å; N35-A306 PolarHBondContact ND2-O 3.3Å; N35-P310 HydrophobicContact CB-CG 4.42Å; N35-P310 WeakPolarHBondContact OD1-CG 3.18Å
36L92.9Very high90.5Very high86 Ų8655.9 Ų55.945%0.4528%0.284SS..Hα-helixtrans-58.4-44.8176.1178.462.6000111.6C32 I38 V39 A40 L64C32-L36 WeakPolarHBondContact O-CB 3.34Å; C32-L36 PolarHBondContact O-N 3.46Å; L36-I38 PolarHBondContact O-N 3.26Å; L36-V39 PolarHBondContact O-N 2.97Å; L36-A40 WeakPolarHBondContact O-CB 3.49Å; L36-A40 PolarHBondContact O-N 3.05Å; L36-L64 HydrophobicContact CB-CD1 3.93Å; L36-L64 HydrophobicContact CD1-CD2 4.24Å
37L90.7Very high89.7Confident65 Ų6558.9 Ų58.934%0.3429%0.288SS..Hα-helixtrans-59.8-45.3178.4-77.1170.3000111.8L33 N35 A40 T41 L324L33-L37 WeakPolarHBondContact O-CB 3.41Å; L33-L37 WeakPolarHBondContact O-CG 3.29Å; L33-L37 PolarHBondContact O-N 2.88Å; N35-L37 VanDerWaalsContact C-N 3.33Å; N35-L37 PolarHBondContact O-N 2.73Å; L37-A40 PolarHBondContact O-N 3.4Å; L37-T41 WeakPolarHBondContact O-CB 3.36Å; L37-T41 PolarHBondContact O-N 3.05Å; L37-T41 PolarHBondContact O-OG1 3.03Å; L37-L324 HydrophobicContact CB-CD1 3.74Å; L37-L324 HydrophobicContact CD1-CD1 4.32Å; L37-L324 HydrophobicContact CD2-CD1 4.36Å; L37-L324 HydrophobicContact CG-CD1 4.37Å
38I89.8Confident89Confident4 Ų458.4 Ų58.42%0.02129%0.286CS..Hα-helixtrans-69.9-44.6-179.9-65.5170000111.6G34 N35 L36 A40 T41 L42 T60 P310G34-I38 PolarHBondContact O-N 3.31Å; N35-I38 PolarHBondContact O-N 3.07Å; L36-I38 PolarHBondContact O-N 3.26Å; I38-A40 VanDerWaalsContact C-N 3.29Å; I38-A40 PolarHBondContact O-N 3.26Å; I38-T41 PolarHBondContact O-N 3.43Å; I38-L42 HydrophobicContact CG2-CD1 3.74Å; I38-L42 HydrophobicContact CG2-CG 4.18Å; I38-L42 WeakPolarHBondContact O-CB 3.39Å; I38-L42 WeakPolarHBondContact O-CG 3.44Å; I38-L42 PolarHBondContact O-N 2.9Å; I38-T60 HydrophobicContact CB-CG2 4.25Å; I38-T60 HydrophobicContact CD1-CG2 4.32Å; I38-T60 HydrophobicContact CG2-CG2 3.87Å; I38-P310 HydrophobicContact CD1-CB 3.56Å; I38-P310 HydrophobicContact CD1-CG 4.18Å
39V91.7Very high88.3Confident19 Ų1960.6 Ų60.612%0.11530%0.296CS..Hα-helixtrans-57.3-45.6175169.20000110N35 L36 L42 Y43 F57 L64N35-V39 WeakPolarHBondContact O-CB 3.28Å; N35-V39 VanDerWaalsContact O-CG2 3.31Å; N35-V39 WeakPolarHBondContact O-CG2 3.42Å; N35-V39 PolarHBondContact O-N 3.23Å; L36-V39 PolarHBondContact O-N 2.97Å; V39-L42 PolarHBondContact O-N 3.3Å; V39-Y43 WeakPolarHBondContact O-CB 3.49Å; V39-Y43 PolarHBondContact O-N 2.97Å; V39-F57 HydrophobicContact CB-CE2 4.48Å; V39-F57 HydrophobicContact CG1-CE2 3.9Å; V39-F57 HydrophobicContact CG1-CZ 4.36Å; V39-L64 HydrophobicContact CB-CD2 4.31Å; V39-L64 HydrophobicContact CG1-CD2 4.26Å; V39-L64 HydrophobicContact CG2-CD2 4.22Å
40A89.8Confident87.8Confident23 Ų2358.8 Ų58.819%0.1929%0.29CS..Hα-helixtrans-65.7-40.1177.600000113.3L36 L37 I38 R44 M327L36-A40 WeakPolarHBondContact O-CB 3.49Å; L36-A40 PolarHBondContact O-N 3.05Å; L37-A40 PolarHBondContact O-N 3.4Å; I38-A40 VanDerWaalsContact C-N 3.29Å; I38-A40 PolarHBondContact O-N 3.26Å; A40-R44 WeakPolarHBondContact O-CB 3.41Å; A40-R44 WeakPolarHBondContact O-CG 3.34Å; A40-R44 PolarHBondContact O-N 3.41Å; A40-M327 HydrophobicContact CB-CE 4.4Å
41T85.9Confident87.4Confident0 Ų055.9 Ų55.90%028%0.277CS..Hα-helixtrans-64.4-47.2175.4-60.90000111.4L37 I38 R45 L48 E323 M327L37-T41 WeakPolarHBondContact O-CB 3.36Å; L37-T41 PolarHBondContact O-N 3.05Å; L37-T41 PolarHBondContact O-OG1 3.03Å; I38-T41 PolarHBondContact O-N 3.43Å; T41-R45 WeakPolarHBondContact O-CB 3.45Å; T41-R45 PolarHBondContact O-N 2.88Å; T41-R45 VanDerWaalsContact O-N 3.07Å; T41-L48 HydrophobicContact CG2-CD1 4.18Å; T41-E323 HydrophobicContact CG2-CB 3.8Å; T41-M327 HydrophobicContact CG2-SD 4.18Å; T41-M327 PolarHBondContact OG1-SD 3.49Å
42L86.1Confident86.9Confident2 Ų256.5 Ų56.51%0.0128%0.281CS..Hα-helixtrans-66.8-37.2179.3-69.1176.3000112.1I38 V39 L48 L49 F57I38-L42 HydrophobicContact CG2-CD1 3.74Å; I38-L42 HydrophobicContact CG2-CG 4.18Å; I38-L42 WeakPolarHBondContact O-CB 3.39Å; I38-L42 WeakPolarHBondContact O-CG 3.44Å; I38-L42 PolarHBondContact O-N 2.9Å; V39-L42 PolarHBondContact O-N 3.3Å; L42-L48 HydrophobicContact CD2-CB 4.08Å; L42-L49 HydrophobicContact CB-CD2 4.09Å; L42-F57 HydrophobicContact CB-CD2 3.9Å; L42-F57 HydrophobicContact CD1-CB 4.01Å; L42-F57 HydrophobicContact CD1-CD2 4.11Å
43Y86.9Confident86.6Confident180 Ų18056 Ų5671%0.70628%0.276SS*.Hα-helixtrans-68.7-45176.4-174.1-98.6000112.5V39 R45V39-Y43 WeakPolarHBondContact O-CB 3.49Å; V39-Y43 PolarHBondContact O-N 2.97Å; Y43-R45 PolarHBondContact O-N 3Å
44R85.6Confident86.5Confident169 Ų16953.7 Ų53.764%0.63826%0.262SS*.Hα-helixtrans-74.1-21.6-179.8-73.2-168.8178.5112.7-2.3114.4A40 P46A40-R44 WeakPolarHBondContact O-CB 3.41Å; A40-R44 WeakPolarHBondContact O-CG 3.34Å; A40-R44 PolarHBondContact O-N 3.41Å; R44-P46 WeakPolarHBondContact O-CD 3.48Å
45R82.4Confident86.5Confident84 Ų8453.2 Ų53.232%0.31726%0.255SS..  trans-117.576-178.7-58.4-51.9-148.7-163.4-2.2110.3T41 Y43 Y47 L48 E323T41-R45 WeakPolarHBondContact O-CB 3.45Å; T41-R45 PolarHBondContact O-N 2.88Å; T41-R45 VanDerWaalsContact O-N 3.07Å; Y43-R45 PolarHBondContact O-N 3Å; R45-Y47 HydrophobicContact CB-CD1 4.26Å; R45-Y47 HydrophobicContact CB-CE1 3.77Å; R45-Y47 HydrophobicContact CG-CE1 4.13Å; R45-Y47 PolarHBondContact O-N 3.12Å; R45-L48 HydrophobicContact CB-CD1 3.66Å; R45-L48 HydrophobicContact CB-CG 3.85Å; R45-L48 HydrophobicContact CG-CD1 4.26Å; R45-L48 VanDerWaalsContact O-CB 3.3Å; R45-L48 WeakPolarHBondContact O-CB 3.44Å; R45-L48 PolarHBondContact O-N 3.16Å; R45-E323 IonicContact CZ-OE2 2.61Å; R45-E323 IonicContact NE-OE2 3.7Å; R45-E323 PolarHBondContact NE-OE2 3.45Å; R45-E323 IonicContact NH2-OE2 2.97Å
46P79.8Confident86.4Confident91 Ų9154.1 Ų54.159%0.59126%0.26SS*.G310 helixtrans-61.5-21.4-174.823.6-34.4000114.1R44 L48 L49R44-P46 WeakPolarHBondContact O-CD 3.48Å; P46-L48 PolarHBondContact O-N 3.21Å; P46-L49 HydrophobicContact CB-CD1 4.34Å; P46-L49 WeakPolarHBondContact O-CB 3.39Å; P46-L49 PolarHBondContact O-N 3.09Å
47Y77.2Confident86.3Confident130 Ų13052.5 Ų52.551%0.5125%0.249SC..G310 helixtrans-65-17.1171.569-99.4000113.6R45 E323R45-Y47 HydrophobicContact CB-CD1 4.26Å; R45-Y47 HydrophobicContact CB-CE1 3.77Å; R45-Y47 HydrophobicContact CG-CE1 4.13Å; R45-Y47 PolarHBondContact O-N 3.12Å; Y47-E323 PolarHBondContact OH-OE1 3.48Å; Y47-E323 VanDerWaalsContact OH-OE1 3.08Å; Y47-E323 PolarHBondContact OH-OE2 3.15Å
48L78.4Confident86.5Confident9 Ų949.5 Ų49.55%0.04723%0.234CC..G310 helixtrans-82.7-12171.1-59.9178.5000112.8T41 L42 R45 P46 T50 N53 T319 E323T41-L48 HydrophobicContact CG2-CD1 4.18Å; L42-L48 HydrophobicContact CD2-CB 4.08Å; R45-L48 HydrophobicContact CB-CD1 3.66Å; R45-L48 HydrophobicContact CB-CG 3.85Å; R45-L48 HydrophobicContact CG-CD1 4.26Å; R45-L48 VanDerWaalsContact O-CB 3.3Å; R45-L48 WeakPolarHBondContact O-CB 3.44Å; R45-L48 PolarHBondContact O-N 3.16Å; P46-L48 PolarHBondContact O-N 3.21Å; L48-T50 PolarHBondContact O-N 3.05Å; L48-N53 VanDerWaalsContact O-CB 3.23Å; L48-N53 WeakPolarHBondContact O-CB 3.46Å; L48-N53 PolarHBondContact O-ND2 3.46Å; L48-T319 HydrophobicContact CD2-CG2 3.81Å; L48-E323 HydrophobicContact CD1-CB 4.46Å; L48-E323 HydrophobicContact CD1-CG 4.12Å
49L80.6Confident86.7Confident60 Ų6049.3 Ų49.331%0.31423%0.233SC..  trans-79.252.3-178.8-63.9173.2000112.3L42 P46L42-L49 HydrophobicContact CB-CD2 4.09Å; P46-L49 HydrophobicContact CB-CD1 4.34Å; P46-L49 WeakPolarHBondContact O-CB 3.39Å; P46-L49 PolarHBondContact O-N 3.09Å
50T84.4Confident86.8Confident63 Ų6348.4 Ų48.439%0.38723%0.228SC..  trans-59.7157.8166.867.20000110.3L48 S52 N53 K54L48-T50 PolarHBondContact O-N 3.05Å; T50-S52 VanDerWaalsContact C-N 3.31Å; T50-S52 PolarHBondContact O-N 3.3Å; T50-N53 WeakPolarHBondContact O-CA 3.43Å; T50-N53 PolarHBondContact O-N 3.02Å; T50-N53 WeakPolarHBondContact OG1-CB 3.44Å; T50-N53 VanDerWaalsContact OG1-CG 3.26Å; T50-N53 PolarHBondContact OG1-N 3.37Å; T50-N53 PolarHBondContact OG1-ND2 3.31Å; T50-K54 PolarHBondContact O-N 2.85Å; T50-K54 VanDerWaalsContact O-N 3.08Å
51P84.6Confident87.1Confident35 Ų3550 Ų5023%0.22723%0.232CC..Hα-helixtrans-50.7-44.5-178.5-30.537000114.3N53 K54 I129P51-N53 PolarHBondContact O-N 3.46Å; P51-K54 WeakPolarHBondContact O-CB 3.43Å; P51-K54 PolarHBondContact O-N 3.25Å; P51-I129 HydrophobicContact CB-CG2 3.76Å
52S85.1Confident87.6Confident12 Ų1250 Ų508%0.08423%0.232CC..Hα-helixtrans-63-40.4174.9-47.40000113.1T50 K54 F55 V56 D114 R115 Y125T50-S52 VanDerWaalsContact C-N 3.31Å; T50-S52 PolarHBondContact O-N 3.3Å; S52-K54 PolarHBondContact O-N 3.48Å; S52-F55 PolarHBondContact O-N 3.38Å; S52-F55 VanDerWaalsContact O-N 3.15Å; S52-V56 PolarHBondContact O-N 3.04Å; S52-D114 WeakPolarHBondContact CA-OD1 3.23Å; S52-D114 VanDerWaalsContact CB-OD1 3.27Å; S52-D114 WeakPolarHBondContact CB-OD1 3.36Å; S52-D114 PolarHBondContact OG-OD1 3.04Å; S52-D114 PolarHBondContact OG-OD2 3.28Å; S52-R115 PolarHBondContact OG-NH2 2.98Å; S52-Y125 PolarHBondContact OG-OH 2.84Å
53N87.6Confident88Confident25 Ų2550 Ų5013%0.13423%0.232CC..Hα-helixtrans-71.9-16.5-178.4-70.5-3.6000112.2L48 T50 P51 V56 F57L48-N53 VanDerWaalsContact O-CB 3.23Å; L48-N53 WeakPolarHBondContact O-CB 3.46Å; L48-N53 PolarHBondContact O-ND2 3.46Å; T50-N53 WeakPolarHBondContact O-CA 3.43Å; T50-N53 PolarHBondContact O-N 3.02Å; T50-N53 WeakPolarHBondContact OG1-CB 3.44Å; T50-N53 VanDerWaalsContact OG1-CG 3.26Å; T50-N53 PolarHBondContact OG1-N 3.37Å; T50-N53 PolarHBondContact OG1-ND2 3.31Å; P51-N53 PolarHBondContact O-N 3.46Å; N53-V56 PolarHBondContact O-N 3.33Å; N53-F57 WeakPolarHBondContact O-CB 3.23Å; N53-F57 PolarHBondContact O-N 3.4Å
54K91Very high88.5Confident53 Ų5342.5 Ų42.523%0.2321%0.205CC..Hα-helixtrans-66.5-37.9168.1-63-168.9178.3-1670112.3T50 P51 S52 F57 S58 G131 A134 V135 I138T50-K54 PolarHBondContact O-N 2.85Å; T50-K54 VanDerWaalsContact O-N 3.08Å; P51-K54 WeakPolarHBondContact O-CB 3.43Å; P51-K54 PolarHBondContact O-N 3.25Å; S52-K54 PolarHBondContact O-N 3.48Å; K54-F57 WeakPolarHBondContact O-CB 3.45Å; K54-F57 PolarHBondContact O-N 3.11Å; K54-S58 PolarHBondContact O-N 3.28Å; K54-G131 PolarHBondContact NZ-O 3.43Å; K54-A134 HydrophobicContact CD-CB 4.32Å; K54-V135 HydrophobicContact CD-CG2 4.04Å; K54-I138 HydrophobicContact CB-CD1 3.99Å; K54-I138 WeakPolarHBondContact O-CD1 3.41Å
55F92.4Very high89Confident8 Ų837.2 Ų37.24%0.03519%0.188CC..Hα-helixtrans-67.7-41.9173.6-62-62000111.4S52 F57 S58 L59 T107 A110 I111 D114 A134 V137 I138S52-F55 PolarHBondContact O-N 3.38Å; S52-F55 VanDerWaalsContact O-N 3.15Å; F55-F57 VanDerWaalsContact C-N 3.3Å; F55-F57 PolarHBondContact O-N 3.12Å; F55-S58 PolarHBondContact O-N 3.46Å; F55-L59 WeakPolarHBondContact O-CB 3.36Å; F55-L59 PolarHBondContact O-N 3.4Å; F55-T107 HydrophobicContact CB-CG2 4.48Å; F55-T107 VanDerWaalsContact O-CG2 3.29Å; F55-T107 WeakPolarHBondContact O-CG2 3.41Å; F55-A110 HydrophobicContact CD1-CB 4.08Å; F55-A110 HydrophobicContact CE1-CB 4.09Å; F55-I111 HydrophobicContact CB-CD1 4.3Å; F55-I111 HydrophobicContact CB-CG1 3.6Å; F55-D114 HydrophobicContact CD2-CB 4.12Å; F55-D114 HydrophobicContact CE2-CB 4.1Å; F55-A134 HydrophobicContact CE1-CB 4.43Å; F55-A134 HydrophobicContact CE2-CB 4.15Å; F55-A134 HydrophobicContact CZ-CB 3.89Å; F55-V137 HydrophobicContact CE1-CB 3.95Å; F55-V137 HydrophobicContact CE1-CG1 3.71Å; F55-V137 HydrophobicContact CZ-CB 4.25Å; F55-V137 HydrophobicContact CZ-CG1 4.18Å; F55-I138 HydrophobicContact CD1-CD1 4.15Å; F55-I138 HydrophobicContact CD1-CG1 3.81Å; F55-I138 HydrophobicContact CE1-CD1 4.48Å; F55-I138 HydrophobicContact CE1-CG1 4.01Å
56V90.9Very high89.6Confident18 Ų1833.4 Ų33.411%0.10918%0.175CC..Hα-helixtrans-60.4-40.7172.91790000111.1S52 N53 L59 T60 Y313S52-V56 PolarHBondContact O-N 3.04Å; N53-V56 PolarHBondContact O-N 3.33Å; V56-L59 PolarHBondContact O-N 3.32Å; V56-T60 PolarHBondContact O-N 3.07Å; V56-T60 PolarHBondContact O-OG1 3.06Å; V56-T60 VanDerWaalsContact O-OG1 3.06Å; V56-Y313 HydrophobicContact CG1-CG 4.21Å; V56-Y313 HydrophobicContact CG2-CD1 3.98Å; V56-Y313 HydrophobicContact CG2-CE1 4.49Å; V56-Y313 HydrophobicContact CG2-CG 4.37Å
57F92.4Very high90.4Very high52 Ų5229.2 Ų29.223%0.22815%0.147CC..Hα-helixtrans-60.9-48.4174.2-179.5-96000111.9V39 L42 N53 K54 F55 L59 T60 L61V39-F57 HydrophobicContact CB-CE2 4.48Å; V39-F57 HydrophobicContact CG1-CE2 3.9Å; V39-F57 HydrophobicContact CG1-CZ 4.36Å; L42-F57 HydrophobicContact CB-CD2 3.9Å; L42-F57 HydrophobicContact CD1-CB 4.01Å; L42-F57 HydrophobicContact CD1-CD2 4.11Å; N53-F57 WeakPolarHBondContact O-CB 3.23Å; N53-F57 PolarHBondContact O-N 3.4Å; K54-F57 WeakPolarHBondContact O-CB 3.45Å; K54-F57 PolarHBondContact O-N 3.11Å; F55-F57 VanDerWaalsContact C-N 3.3Å; F55-F57 PolarHBondContact O-N 3.12Å; F57-L59 VanDerWaalsContact C-N 3.3Å; F57-L59 PolarHBondContact O-N 3.26Å; F57-T60 PolarHBondContact O-N 2.91Å; F57-T60 PolarHBondContact O-OG1 2.82Å; F57-L61 HydrophobicContact CE1-CD2 4.01Å; F57-L61 WeakPolarHBondContact O-CB 3.41Å; F57-L61 PolarHBondContact O-N 3.39Å
58S94.8Very high91.3Very high3 Ų326.4 Ų26.42%0.02114%0.143CC..Hα-helixtrans-57.6-42.9175.8-1720000111.8K54 F55 L61 S62 W142K54-S58 PolarHBondContact O-N 3.28Å; F55-S58 PolarHBondContact O-N 3.46Å; S58-L61 PolarHBondContact O-N 2.99Å; S58-S62 PolarHBondContact O-N 3.46Å; S58-S62 PolarHBondContact O-OG 2.82Å; S58-W142 PolarHBondContact OG-NE1 2.88Å
59L93.8Very high92.1Very high0 Ų029.1 Ų29.10%016%0.158CC..Hα-helixtrans-63.7-48.5176.9-178.167.1000111.7F55 V56 F57 L61 S62 N63 S104 T107 L108 I111 H309 Y313F55-L59 WeakPolarHBondContact O-CB 3.36Å; F55-L59 PolarHBondContact O-N 3.4Å; V56-L59 PolarHBondContact O-N 3.32Å; F57-L59 VanDerWaalsContact C-N 3.3Å; F57-L59 PolarHBondContact O-N 3.26Å; L59-L61 VanDerWaalsContact C-N 3.29Å; L59-L61 PolarHBondContact O-N 3.17Å; L59-S62 PolarHBondContact O-N 3.32Å; L59-S62 PolarHBondContact O-OG 3.22Å; L59-N63 PolarHBondContact O-N 2.98Å; L59-N63 VanDerWaalsContact O-N 3.11Å; L59-N63 PolarHBondContact O-ND2 3.49Å; L59-S104 WeakPolarHBondContact CD1-OG 3.24Å; L59-T107 HydrophobicContact CB-CG2 3.86Å; L59-L108 HydrophobicContact CD1-CD2 4.1Å; L59-L108 HydrophobicContact CD1-CG 4.04Å; L59-L108 HydrophobicContact CD2-CD2 3.75Å; L59-I111 HydrophobicContact CB-CD1 4.33Å; L59-I111 HydrophobicContact CD2-CD1 3.8Å; L59-H309 HydrophobicContact CD2-CB 4.19Å; L59-H309 HydrophobicContact CG-CB 4.41Å; L59-Y313 HydrophobicContact CD2-CD2 3.86Å; L59-Y313 HydrophobicContact CD2-CE2 3.49Å; L59-Y313 VanDerWaalsContact CD2-CE2 3.49Å
60T93.9Very high92.8Very high0 Ų026.2 Ų26.20%014%0.143CC..Hα-helixtrans-70.1-28.4178.752.20000112.4I38 V56 F57 L64I38-T60 HydrophobicContact CB-CG2 4.25Å; I38-T60 HydrophobicContact CD1-CG2 4.32Å; I38-T60 HydrophobicContact CG2-CG2 3.87Å; V56-T60 PolarHBondContact O-N 3.07Å; V56-T60 PolarHBondContact O-OG1 3.06Å; V56-T60 VanDerWaalsContact O-OG1 3.06Å; F57-T60 PolarHBondContact O-N 2.91Å; F57-T60 PolarHBondContact O-OG1 2.82Å; T60-L64 VanDerWaalsContact O-CB 3.3Å; T60-L64 WeakPolarHBondContact O-CB 3.25Å; T60-L64 PolarHBondContact O-N 3.36Å
61L95.3Very high93.3Very high55 Ų5523.3 Ų23.329%0.28812%0.124SC..Hα-helixtrans-69.7-44174.2-179.362.3000111.7F57 S58 L59 N63 L64 L65F57-L61 HydrophobicContact CE1-CD2 4.01Å; F57-L61 WeakPolarHBondContact O-CB 3.41Å; F57-L61 PolarHBondContact O-N 3.39Å; S58-L61 PolarHBondContact O-N 2.99Å; L59-L61 VanDerWaalsContact C-N 3.29Å; L59-L61 PolarHBondContact O-N 3.17Å; L61-N63 VanDerWaalsContact C-N 3.34Å; L61-N63 PolarHBondContact O-N 2.89Å; L61-L64 PolarHBondContact O-N 3.15Å; L61-L65 HydrophobicContact CG-CD1 4.4Å; L61-L65 WeakPolarHBondContact O-CG 3.44Å; L61-L65 PolarHBondContact O-N 3.22Å
62S96.3Very high93.7Very high0 Ų023.8 Ų23.80%013%0.128CC..Hα-helixtrans-61.9-43.6174.862.90000110.9S58 L59 L64 L65 L66 I100S58-S62 PolarHBondContact O-N 3.46Å; S58-S62 PolarHBondContact O-OG 2.82Å; L59-S62 PolarHBondContact O-N 3.32Å; L59-S62 PolarHBondContact O-OG 3.22Å; S62-L64 PolarHBondContact O-N 3.21Å; S62-L65 PolarHBondContact O-N 3.37Å; S62-L66 PolarHBondContact O-N 2.9Å; S62-I100 WeakPolarHBondContact O-CG2 3.31Å
63N95.3Very high94.2Very high2 Ų225.5 Ų25.51%0.01113%0.134CC..Hα-helixtrans-69.1-31.4177.3-70.9-74.7000113.3L59 L61 L66 S67 S104 A306 H309L59-N63 PolarHBondContact O-N 2.98Å; L59-N63 VanDerWaalsContact O-N 3.11Å; L59-N63 PolarHBondContact O-ND2 3.49Å; L61-N63 VanDerWaalsContact C-N 3.34Å; L61-N63 PolarHBondContact O-N 2.89Å; N63-L66 PolarHBondContact O-N 2.88Å; N63-S67 WeakPolarHBondContact O-CB 3.48Å; N63-S67 PolarHBondContact O-N 3.24Å; N63-S67 PolarHBondContact O-OG 2.84Å; N63-S104 PolarHBondContact ND2-OG 3.06Å; N63-S104 VanDerWaalsContact ND2-OG 3.09Å; N63-A306 HydrophobicContact CB-CB 4.09Å; N63-A306 WeakPolarHBondContact OD1-CA 3.49Å; N63-A306 WeakPolarHBondContact OD1-CB 3.35Å; N63-H309 PolarHBondContact ND2-CD2 3.06Å
64L96Very high94.4Very high24 Ų2424.3 Ų24.313%0.12613%0.127CC..Hα-helixtrans-62.6-48169-178.659.8000111N35 L36 V39 T60 L61 S62 L66 S67 V68N35-L64 HydrophobicContact CB-CB 3.99Å; L36-L64 HydrophobicContact CB-CD1 3.93Å; L36-L64 HydrophobicContact CD1-CD2 4.24Å; V39-L64 HydrophobicContact CB-CD2 4.31Å; V39-L64 HydrophobicContact CG1-CD2 4.26Å; V39-L64 HydrophobicContact CG2-CD2 4.22Å; T60-L64 VanDerWaalsContact O-CB 3.3Å; T60-L64 WeakPolarHBondContact O-CB 3.25Å; T60-L64 PolarHBondContact O-N 3.36Å; L61-L64 PolarHBondContact O-N 3.15Å; S62-L64 PolarHBondContact O-N 3.21Å; L64-L66 VanDerWaalsContact C-N 3.32Å; L64-L66 PolarHBondContact O-N 3.01Å; L64-S67 WeakPolarHBondContact CA-OG 3.41Å; L64-S67 PolarHBondContact O-N 3.48Å; L64-S67 VanDerWaalsContact O-N 3.12Å; L64-S67 PolarHBondContact O-OG 2.96Å; L64-V68 HydrophobicContact CD1-CG2 3.96Å; L64-V68 HydrophobicContact CG-CG2 4.47Å; L64-V68 WeakPolarHBondContact O-CG2 3.47Å; L64-V68 PolarHBondContact O-N 2.91Å
65L96.4Very high94.5Very high57 Ų5722.3 Ų22.330%0.29812%0.121SC..Hα-helixtrans-59-41.5176.6-69.2167.6000111.8L61 S62 V68 L69 I100 W142L61-L65 HydrophobicContact CG-CD1 4.4Å; L61-L65 WeakPolarHBondContact O-CG 3.44Å; L61-L65 PolarHBondContact O-N 3.22Å; S62-L65 PolarHBondContact O-N 3.37Å; L65-V68 PolarHBondContact O-N 3.22Å; L65-L69 HydrophobicContact CB-CD1 4.42Å; L65-L69 HydrophobicContact CD2-CD1 3.88Å; L65-L69 VanDerWaalsContact O-CB 3.27Å; L65-L69 WeakPolarHBondContact O-CB 3.48Å; L65-L69 WeakPolarHBondContact O-CG 3.36Å; L65-L69 PolarHBondContact O-N 3.2Å; L65-I100 HydrophobicContact CB-CD1 3.93Å; L65-I100 HydrophobicContact CB-CG1 4.47Å; L65-W142 HydrophobicContact CD1-CH2 3.91Å
66L96Very high94.6Very high5 Ų524.8 Ų24.83%0.02614%0.137CC..Hα-helixtrans-58.4-48.7173-17668.2000111.4S62 N63 L64 V68 V70 L71 Y97 I100 A306S62-L66 PolarHBondContact O-N 2.9Å; N63-L66 PolarHBondContact O-N 2.88Å; L64-L66 VanDerWaalsContact C-N 3.32Å; L64-L66 PolarHBondContact O-N 3.01Å; L66-V68 VanDerWaalsContact C-N 3.29Å; L66-V68 PolarHBondContact O-N 2.89Å; L66-V70 HydrophobicContact CD1-CB 3.9Å; L66-V70 HydrophobicContact CD1-CG1 4.09Å; L66-V70 HydrophobicContact CD1-CG2 4.11Å; L66-V70 WeakPolarHBondContact O-CB 3.44Å; L66-V70 PolarHBondContact O-N 3.46Å; L66-V70 VanDerWaalsContact O-N 3.08Å; L66-L71 HydrophobicContact CG-CG 4.3Å; L66-L71 PolarHBondContact O-N 3.41Å; L66-Y97 HydrophobicContact CD1-CD2 3.86Å; L66-Y97 HydrophobicContact CD1-CE2 4.47Å; L66-I100 HydrophobicContact CB-CG2 3.83Å; L66-A306 HydrophobicContact CD2-CB 4.16Å
67S95.8Very high94.6Very high2 Ų224 Ų241%0.01413%0.131CC..Hα-helixtrans-70.9-18.6-176.5670000115.3C32 N63 L64 P72C32-S67 VanDerWaalsContact CA-OG 3.32Å; C32-S67 WeakPolarHBondContact CA-OG 3.46Å; N63-S67 WeakPolarHBondContact O-CB 3.48Å; N63-S67 PolarHBondContact O-N 3.24Å; N63-S67 PolarHBondContact O-OG 2.84Å; L64-S67 WeakPolarHBondContact CA-OG 3.41Å; L64-S67 PolarHBondContact O-N 3.48Å; L64-S67 VanDerWaalsContact O-N 3.12Å; L64-S67 PolarHBondContact O-OG 2.96Å; S67-P72 VanDerWaalsContact O-CD 3.31Å; S67-P72 WeakPolarHBondContact O-CD 3.27Å; S67-P72 WeakPolarHBondContact O-CG 3.42Å
68V96Very high94.5Very high71 Ų7121.5 Ų21.543%0.4312%0.121SC..Hα-helixtrans-101.9-38.1179.2175.30000112.1L64 L65 L66L64-V68 HydrophobicContact CD1-CG2 3.96Å; L64-V68 HydrophobicContact CG-CG2 4.47Å; L64-V68 WeakPolarHBondContact O-CG2 3.47Å; L64-V68 PolarHBondContact O-N 2.91Å; L65-V68 PolarHBondContact O-N 3.22Å; L66-V68 VanDerWaalsContact C-N 3.29Å; L66-V68 PolarHBondContact O-N 2.89Å
69L95.3Very high94.2Very high66 Ų6624.6 Ų24.635%0.34615%0.146SC..Hα-helixtrans-101.5-16.7-171.3-55.7177.5000114.5L65 F73 L96L65-L69 HydrophobicContact CB-CD1 4.42Å; L65-L69 HydrophobicContact CD2-CD1 3.88Å; L65-L69 VanDerWaalsContact O-CB 3.27Å; L65-L69 WeakPolarHBondContact O-CB 3.48Å; L65-L69 WeakPolarHBondContact O-CG 3.36Å; L65-L69 PolarHBondContact O-N 3.2Å; L69-F73 VanDerWaalsContact O-CD2 3.28Å; L69-F73 WeakPolarHBondContact O-CD2 3.4Å; L69-F73 WeakPolarHBondContact O-CE2 3.24Å; L69-L96 HydrophobicContact CB-CD1 3.93Å; L69-L96 HydrophobicContact CD1-CD1 4.34Å
70V95.4Very high93.9Very high0 Ų031 Ų310%017%0.174CC..THydrogen-bonded Turntrans-120-60.9-177.5176.40000110.8L66 P72 F73 V74 T93 L96 Y97L66-V70 HydrophobicContact CD1-CB 3.9Å; L66-V70 HydrophobicContact CD1-CG1 4.09Å; L66-V70 HydrophobicContact CD1-CG2 4.11Å; L66-V70 WeakPolarHBondContact O-CB 3.44Å; L66-V70 PolarHBondContact O-N 3.46Å; L66-V70 VanDerWaalsContact O-N 3.08Å; V70-P72 VanDerWaalsContact C-CD 3.41Å; V70-F73 PolarHBondContact O-N 3.47Å; V70-V74 HydrophobicContact CG1-CG2 4.06Å; V70-V74 PolarHBondContact O-N 3.39Å; V70-T93 HydrophobicContact CB-CG2 4.38Å; V70-T93 HydrophobicContact CG1-CG2 3.87Å; V70-T93 HydrophobicContact CG2-CG2 4.35Å; V70-L96 HydrophobicContact CG2-CB 3.95Å; V70-Y97 HydrophobicContact CG1-CD2 4.42Å
71L94.3Very high93.4Very high1 Ų135 Ų351%0.00519%0.189CC..Hα-helixtrans-56.6-35.2-170.9-62.3-173.2000115.5I27 T28 A31 L66 F73 V74 A75 F303I27-L71 HydrophobicContact CG2-CD1 4.47Å; T28-L71 HydrophobicContact CG2-CB 3.84Å; T28-L71 WeakPolarHBondContact OG1-CB 3.39Å; A31-L71 HydrophobicContact CB-CD1 4.3Å; L66-L71 HydrophobicContact CG-CG 4.3Å; L66-L71 PolarHBondContact O-N 3.41Å; L71-F73 VanDerWaalsContact C-N 3.31Å; L71-F73 PolarHBondContact O-N 2.93Å; L71-V74 PolarHBondContact O-N 3.36Å; L71-A75 WeakPolarHBondContact O-CB 3.32Å; L71-A75 PolarHBondContact O-N 3.43Å; L71-F303 HydrophobicContact CD2-CB 4.24Å; L71-F303 HydrophobicContact CD2-CD1 3.62Å; L71-F303 HydrophobicContact CD2-CD2 4.41Å; L71-F303 HydrophobicContact CD2-CE1 4.03Å; L71-F303 HydrophobicContact CD2-CG 3.84Å
72P94.3Very high93Very high46 Ų4636.4 Ų36.430%0.29919%0.194SC..Hα-helixtrans-64.6-34.1177.3-23.736.6000113T28 S67 V70 A75 V76T28-P72 HydrophobicContact CG2-CG 4.1Å; S67-P72 VanDerWaalsContact O-CD 3.31Å; S67-P72 WeakPolarHBondContact O-CD 3.27Å; S67-P72 WeakPolarHBondContact O-CG 3.42Å; V70-P72 VanDerWaalsContact C-CD 3.41Å; P72-A75 PolarHBondContact O-N 2.92Å; P72-V76 WeakPolarHBondContact O-CG2 3.36Å; P72-V76 PolarHBondContact O-N 3.03Å; P72-V76 VanDerWaalsContact O-N 3.09Å
73F94.2Very high92.7Very high47 Ų4738 Ų3821%0.20620%0.2CC..Hα-helixtrans-73.3-37.3176.2-57.8-79.8000111.3L69 V70 L71 A75 V76 S77 W83 F85 W89L69-F73 VanDerWaalsContact O-CD2 3.28Å; L69-F73 WeakPolarHBondContact O-CD2 3.4Å; L69-F73 WeakPolarHBondContact O-CE2 3.24Å; V70-F73 PolarHBondContact O-N 3.47Å; L71-F73 VanDerWaalsContact C-N 3.31Å; L71-F73 PolarHBondContact O-N 2.93Å; F73-A75 VanDerWaalsContact C-N 3.34Å; F73-V76 PolarHBondContact O-N 3.42Å; F73-S77 VanDerWaalsContact O-CB 3.27Å; F73-S77 WeakPolarHBondContact O-CB 3.48Å; F73-S77 PolarHBondContact O-N 3.1Å; F73-W83 HydrophobicContact CB-CH2 3.88Å; F73-W83 HydrophobicContact CB-CZ3 4.25Å; F73-F85 HydrophobicContact CB-CD2 4.34Å; F73-F85 HydrophobicContact CB-CE2 4Å; F73-F85 HydrophobicContact CD1-CD1 4.06Å; F73-F85 HydrophobicContact CD1-CD2 4.04Å; F73-F85 AromaticContact CD1-CE1 3.82Å; F73-F85 HydrophobicContact CD1-CE1 3.82Å; F73-F85 AromaticContact CD1-CE2 3.8Å; F73-F85 HydrophobicContact CD1-CE2 3.8Å; F73-F85 HydrophobicContact CD1-CG 4.17Å; F73-F85 AromaticContact CD1-CZ 3.67Å; F73-F85 HydrophobicContact CD1-CZ 3.67Å; F73-F85 HydrophobicContact CE1-CD1 4.4Å; F73-F85 HydrophobicContact CE1-CE1 4.2Å; F73-F85 HydrophobicContact CE1-CZ 4.44Å; F73-F85 HydrophobicContact CG-CE2 4.41Å; F73-W89 AromaticContact CD1-CD1 3.86Å; F73-W89 AromaticContact CD1-NE1 3.2Å; F73-W89 AromaticContact CD2-NE1 3.75Å; F73-W89 AromaticContact CE1-CE2 3.81Å; F73-W89 HydrophobicContact CE1-CZ2 4.02Å; F73-W89 AromaticContact CE1-NE1 3.2Å; F73-W89 AromaticContact CE2-CZ2 3.8Å; F73-W89 HydrophobicContact CE2-CZ2 3.8Å; F73-W89 AromaticContact CE2-NE1 3.75Å; F73-W89 AromaticContact CG-NE1 3.49Å; F73-W89 AromaticContact CZ-CE2 3.75Å; F73-W89 AromaticContact CZ-CZ2 3.49Å; F73-W89 HydrophobicContact CZ-CZ2 3.49Å; F73-W89 VanDerWaalsContact CZ-CZ2 3.49Å; F73-W89 AromaticContact CZ-NE1 3.49Å
74V93.4Very high92.5Very high0 Ų041.2 Ų41.20%022%0.22CC..Hα-helixtrans-62.4-40.5170.9-176.90000111I24 V70 L71 S77 S78 T167 F303I24-V74 HydrophobicContact CD1-CG1 4.47Å; I24-V74 HydrophobicContact CG2-CG1 4.17Å; V70-V74 HydrophobicContact CG1-CG2 4.06Å; V70-V74 PolarHBondContact O-N 3.39Å; L71-V74 PolarHBondContact O-N 3.36Å; V74-S77 PolarHBondContact O-N 3.42Å; V74-S78 WeakPolarHBondContact O-CB 3.39Å; V74-S78 PolarHBondContact O-N 3.48Å; V74-T167 WeakPolarHBondContact CG2-OG1 3.37Å; V74-F303 HydrophobicContact CG1-CE2 3.99Å; V74-F303 HydrophobicContact CG1-CZ 4.12Å
75A93.3Very high92.3Very high11 Ų1143.4 Ų43.49%0.09123%0.228CC..Hα-helixtrans-63-45.1176.700000112.4I24 V25 L71 P72 F73 A79I24-A75 HydrophobicContact CG2-CB 3.96Å; V25-A75 HydrophobicContact CG2-CB 3.98Å; L71-A75 WeakPolarHBondContact O-CB 3.32Å; L71-A75 PolarHBondContact O-N 3.43Å; P72-A75 PolarHBondContact O-N 2.92Å; F73-A75 VanDerWaalsContact C-N 3.34Å; A75-A79 WeakPolarHBondContact O-CB 3.38Å; A75-A79 PolarHBondContact O-N 3Å
76V92.7Very high92.1Very high61 Ų6142.4 Ų42.437%0.3723%0.232SC..Hα-helixtrans-66.4-40.5174.9175.30000111.2P72 F73 A79 K80 V84 F85P72-V76 WeakPolarHBondContact O-CG2 3.36Å; P72-V76 PolarHBondContact O-N 3.03Å; P72-V76 VanDerWaalsContact O-N 3.09Å; F73-V76 PolarHBondContact O-N 3.42Å; V76-A79 PolarHBondContact O-N 2.86Å; V76-K80 HydrophobicContact CG1-CG 4.32Å; V76-K80 WeakPolarHBondContact O-CB 3.31Å; V76-K80 WeakPolarHBondContact O-CG 3.48Å; V76-K80 PolarHBondContact O-N 2.99Å; V76-V84 HydrophobicContact CG1-CG2 4.35Å; V76-F85 HydrophobicContact CB-CE2 4.03Å; V76-F85 HydrophobicContact CB-CZ 3.73Å; V76-F85 HydrophobicContact CG1-CE2 4.01Å; V76-F85 HydrophobicContact CG1-CZ 3.59Å; V76-F85 HydrophobicContact CG2-CZ 4.25Å
77S91.6Very high91.9Very high0 Ų047 Ų470%026%0.26CS..Hα-helixtrans-64.9-39.1178-171.80000112.7F73 V74 R81 E82 F161 R166F73-S77 VanDerWaalsContact O-CB 3.27Å; F73-S77 WeakPolarHBondContact O-CB 3.48Å; F73-S77 PolarHBondContact O-N 3.1Å; V74-S77 PolarHBondContact O-N 3.42Å; S77-R81 VanDerWaalsContact O-CA 3.31Å; S77-R81 WeakPolarHBondContact O-CA 3.4Å; S77-R81 PolarHBondContact O-N 3.24Å; S77-E82 WeakPolarHBondContact CA-O 3.14Å; S77-E82 PolarHBondContact O-N 2.94Å; S77-E82 PolarHBondContact OG-O 2.97Å; S77-F161 VanDerWaalsContact OG-CE2 3.24Å; S77-F161 WeakPolarHBondContact OG-CE2 3.43Å; S77-F161 WeakPolarHBondContact OG-CZ 3.33Å; S77-R166 PolarHBondContact OG-O 3.03Å
78S89.9Confident91.7Very high1 Ų153 Ų531%0.00730%0.296CS..Hα-helixtrans-61.2-49.5170.5179.80000111.6S21 V74 K80 R81S21-S78 WeakPolarHBondContact CA-OG 3.41Å; S21-S78 PolarHBondContact OG-OG 3.06Å; V74-S78 WeakPolarHBondContact O-CB 3.39Å; V74-S78 PolarHBondContact O-N 3.48Å; S78-K80 VanDerWaalsContact C-N 3.3Å; S78-K80 PolarHBondContact O-N 3.23Å; S78-R81 PolarHBondContact O-N 3.38Å; S78-R81 VanDerWaalsContact O-N 3.14Å
79A88.4Confident91.6Very high67 Ų6754 Ų5455%0.55429%0.292SS*.Hα-helixtrans-64.3-31.6-179.700000113.7A75 V76A75-A79 WeakPolarHBondContact O-CB 3.38Å; A75-A79 PolarHBondContact O-N 3Å; V76-A79 PolarHBondContact O-N 2.86Å
80K87.1Confident91.5Very high134 Ų13451.2 Ų51.258%0.58328%0.279SS*.Hα-helixtrans-88.3-15.7175.6-68-66-174.6176.80113.8V76 S78 E82 V84V76-K80 HydrophobicContact CG1-CG 4.32Å; V76-K80 WeakPolarHBondContact O-CB 3.31Å; V76-K80 WeakPolarHBondContact O-CG 3.48Å; V76-K80 PolarHBondContact O-N 2.99Å; S78-K80 VanDerWaalsContact C-N 3.3Å; S78-K80 PolarHBondContact O-N 3.23Å; K80-E82 HydrophobicContact CB-CG 3.92Å; K80-E82 PolarHBondContact O-N 3.17Å; K80-V84 HydrophobicContact CB-CG1 4.36Å; K80-V84 HydrophobicContact CG-CG1 4.31Å
81R84.3Confident91.4Very high85 Ų8554 Ų5432%0.32129%0.293SS..THydrogen-bonded Turntrans58.417.6-169.5-51.5-174.8-172.3174.37.6114.4D14 A17 S77 S78D14-R81 IonicContact OD1-CZ 3.18Å; D14-R81 IonicContact OD1-NH1 3.73Å; D14-R81 IonicContact OD1-NH2 2.84Å; D14-R81 PolarHBondContact OD1-NH2 3.48Å; A17-R81 VanDerWaalsContact CB-NH2 3.3Å; S77-R81 VanDerWaalsContact O-CA 3.31Å; S77-R81 WeakPolarHBondContact O-CA 3.4Å; S77-R81 PolarHBondContact O-N 3.24Å; S78-R81 PolarHBondContact O-N 3.38Å; S78-R81 VanDerWaalsContact O-N 3.14Å
82E86.3Confident91.4Very high84 Ų8458.5 Ų58.539%0.39331%0.313SS..SBendtrans-150167-178.563.7173.1177.200111.4S77 K80 V84S77-E82 WeakPolarHBondContact CA-O 3.14Å; S77-E82 PolarHBondContact O-N 2.94Å; S77-E82 PolarHBondContact OG-O 2.97Å; K80-E82 HydrophobicContact CB-CG 3.92Å; K80-E82 PolarHBondContact O-N 3.17Å; E82-V84 HydrophobicContact CG-CG1 3.8Å; E82-V84 WeakPolarHBondContact OE1-CG1 3.36Å
83W91.1Very high91.4Very high33 Ų3356.3 Ų56.313%0.12530%0.299CS..  trans-10092.3176.6-173.4-92.4000112.1F73 F85 G86 W89 C90 T93 F161F73-W83 HydrophobicContact CB-CH2 3.88Å; F73-W83 HydrophobicContact CB-CZ3 4.25Å; W83-F85 HydrophobicContact CD2-CD2 4.22Å; W83-F85 AromaticContact CE2-CD2 3.99Å; W83-F85 HydrophobicContact CE3-CD2 4.35Å; W83-F85 HydrophobicContact CH2-CD2 4.12Å; W83-F85 HydrophobicContact CZ2-CB 4.06Å; W83-F85 AromaticContact CZ2-CD2 3.98Å; W83-F85 HydrophobicContact CZ2-CD2 3.98Å; W83-F85 HydrophobicContact CZ2-CG 4.45Å; W83-F85 HydrophobicContact CZ3-CD2 4.3Å; W83-F85 PolarHBondContact O-N 3.13Å; W83-G86 PolarHBondContact NE1-O 2.86Å; W83-W89 HydrophobicContact CZ2-CB 4.42Å; W83-W89 AromaticContact CZ2-CD1 3.68Å; W83-W89 HydrophobicContact CZ2-CG 4.41Å; W83-C90 HydrophobicContact CZ2-CB 4.27Å; W83-T93 HydrophobicContact CH2-CG2 3.94Å; W83-F161 HydrophobicContact CB-CB 4.4Å; W83-F161 HydrophobicContact CB-CD1 4.24Å; W83-F161 HydrophobicContact CB-CD2 3.73Å; W83-F161 HydrophobicContact CB-CE1 4.46Å; W83-F161 HydrophobicContact CB-CE2 3.99Å; W83-F161 HydrophobicContact CB-CG 3.85Å; W83-F161 HydrophobicContact CB-CZ 4.35Å; W83-F161 HydrophobicContact CD2-CD2 4.5Å; W83-F161 HydrophobicContact CE3-CD2 4.23Å; W83-F161 HydrophobicContact CE3-CE2 4.26Å; W83-F161 HydrophobicContact CG-CD2 4.34Å
84V91.8Very high91.4Very high70 Ų7054 Ų5442%0.42429%0.289SS..THydrogen-bonded Turntrans-76.9-14.2-176.1-59.40000115V76 K80 E82 G86V76-V84 HydrophobicContact CG1-CG2 4.35Å; K80-V84 HydrophobicContact CB-CG1 4.36Å; K80-V84 HydrophobicContact CG-CG1 4.31Å; E82-V84 HydrophobicContact CG-CG1 3.8Å; E82-V84 WeakPolarHBondContact OE1-CG1 3.36Å; V84-G86 VanDerWaalsContact C-N 3.27Å; V84-G86 PolarHBondContact O-N 3.07Å
85F91.1Very high91.4Very high70 Ų7055.2 Ų55.231%0.30730%0.295SS..THydrogen-bonded Turntrans-83.52.7-171.4-54.2-74.5000114.6F73 V76 W83 W89F73-F85 HydrophobicContact CB-CD2 4.34Å; F73-F85 HydrophobicContact CB-CE2 4Å; F73-F85 HydrophobicContact CD1-CD1 4.06Å; F73-F85 HydrophobicContact CD1-CD2 4.04Å; F73-F85 AromaticContact CD1-CE1 3.82Å; F73-F85 HydrophobicContact CD1-CE1 3.82Å; F73-F85 AromaticContact CD1-CE2 3.8Å; F73-F85 HydrophobicContact CD1-CE2 3.8Å; F73-F85 HydrophobicContact CD1-CG 4.17Å; F73-F85 AromaticContact CD1-CZ 3.67Å; F73-F85 HydrophobicContact CD1-CZ 3.67Å; F73-F85 HydrophobicContact CE1-CD1 4.4Å; F73-F85 HydrophobicContact CE1-CE1 4.2Å; F73-F85 HydrophobicContact CE1-CZ 4.44Å; F73-F85 HydrophobicContact CG-CE2 4.41Å; V76-F85 HydrophobicContact CB-CE2 4.03Å; V76-F85 HydrophobicContact CB-CZ 3.73Å; V76-F85 HydrophobicContact CG1-CE2 4.01Å; V76-F85 HydrophobicContact CG1-CZ 3.59Å; V76-F85 HydrophobicContact CG2-CZ 4.25Å; W83-F85 HydrophobicContact CD2-CD2 4.22Å; W83-F85 AromaticContact CE2-CD2 3.99Å; W83-F85 HydrophobicContact CE3-CD2 4.35Å; W83-F85 HydrophobicContact CH2-CD2 4.12Å; W83-F85 HydrophobicContact CZ2-CB 4.06Å; W83-F85 AromaticContact CZ2-CD2 3.98Å; W83-F85 HydrophobicContact CZ2-CD2 3.98Å; W83-F85 HydrophobicContact CZ2-CG 4.45Å; W83-F85 HydrophobicContact CZ3-CD2 4.3Å; W83-F85 PolarHBondContact O-N 3.13Å; F85-W89 HydrophobicContact CB-CB 3.87Å; F85-W89 HydrophobicContact CB-CG 3.99Å; F85-W89 AromaticContact CG-CD1 3.99Å; F85-W89 WeakPolarHBondContact O-CB 3.18Å
86G91.8Very high91.5Very high36 Ų3655.6 Ų55.637%0.37130%0.295SS..Hα-helixtrans75.5167.2-178.800000114.5W83 V84 V88 W89 C90W83-G86 PolarHBondContact NE1-O 2.86Å; V84-G86 VanDerWaalsContact C-N 3.27Å; V84-G86 PolarHBondContact O-N 3.07Å; G86-V88 PolarHBondContact O-N 3.15Å; G86-W89 PolarHBondContact O-N 3.36Å; G86-C90 PolarHBondContact O-N 2.76Å
87V91.1Very high91.6Very high103 Ų10352.9 Ų52.962%0.62428%0.279SS*.Hα-helixtrans-66.9-37.7-169.6-175.50000112.6W89 C90 N91V87-W89 VanDerWaalsContact C-N 3.35Å; V87-W89 PolarHBondContact O-N 3.28Å; V87-C90 VanDerWaalsContact O-CB 3.29Å; V87-C90 WeakPolarHBondContact O-CB 3.33Å; V87-C90 PolarHBondContact O-N 3.36Å; V87-N91 VanDerWaalsContact O-CG 3.31Å; V87-N91 PolarHBondContact O-N 3.08Å; V87-N91 PolarHBondContact O-OD1 3.47Å
88V92.6Very high91.7Very high126 Ų12653 Ų5376%0.76428%0.279SS*.Hα-helixtrans-61.8-44.2179.4-178.10000111G86 F92G86-V88 PolarHBondContact O-N 3.15Å; V88-F92 PolarHBondContact O-N 2.96Å; V88-F92 VanDerWaalsContact O-N 3.12Å
89W93.3Very high92Very high93 Ų9354.3 Ų54.335%0.35229%0.286SS..Hα-helixtrans-70.1-34.2176.5-158.2-109.1000112F73 W83 F85 G86 V87 F92 T93F73-W89 AromaticContact CD1-CD1 3.86Å; F73-W89 AromaticContact CD1-NE1 3.2Å; F73-W89 AromaticContact CD2-NE1 3.75Å; F73-W89 AromaticContact CE1-CE2 3.81Å; F73-W89 HydrophobicContact CE1-CZ2 4.02Å; F73-W89 AromaticContact CE1-NE1 3.2Å; F73-W89 AromaticContact CE2-CZ2 3.8Å; F73-W89 HydrophobicContact CE2-CZ2 3.8Å; F73-W89 AromaticContact CE2-NE1 3.75Å; F73-W89 AromaticContact CG-NE1 3.49Å; F73-W89 AromaticContact CZ-CE2 3.75Å; F73-W89 AromaticContact CZ-CZ2 3.49Å; F73-W89 HydrophobicContact CZ-CZ2 3.49Å; F73-W89 VanDerWaalsContact CZ-CZ2 3.49Å; F73-W89 AromaticContact CZ-NE1 3.49Å; W83-W89 HydrophobicContact CZ2-CB 4.42Å; W83-W89 AromaticContact CZ2-CD1 3.68Å; W83-W89 HydrophobicContact CZ2-CG 4.41Å; F85-W89 HydrophobicContact CB-CB 3.87Å; F85-W89 HydrophobicContact CB-CG 3.99Å; F85-W89 AromaticContact CG-CD1 3.99Å; F85-W89 WeakPolarHBondContact O-CB 3.18Å; G86-W89 PolarHBondContact O-N 3.36Å; V87-W89 VanDerWaalsContact C-N 3.35Å; V87-W89 PolarHBondContact O-N 3.28Å; W89-F92 HydrophobicContact CD2-CD1 4.36Å; W89-F92 AromaticContact CE3-CD1 3.96Å; W89-F92 HydrophobicContact CE3-CD1 3.96Å; W89-F92 AromaticContact CH2-CD1 3.82Å; W89-F92 HydrophobicContact CH2-CD1 3.82Å; W89-F92 AromaticContact CH2-CE1 3.79Å; W89-F92 HydrophobicContact CH2-CE1 3.79Å; W89-F92 HydrophobicContact CZ2-CD1 4.21Å; W89-F92 HydrophobicContact CZ2-CE1 4.39Å; W89-F92 AromaticContact CZ3-CD1 3.68Å; W89-F92 HydrophobicContact CZ3-CD1 3.68Å; W89-F92 AromaticContact CZ3-CE1 3.95Å; W89-F92 HydrophobicContact CZ3-CE1 3.95Å; W89-F92 PolarHBondContact O-N 2.92Å; W89-T93 WeakPolarHBondContact O-CB 3.48Å; W89-T93 PolarHBondContact O-N 3.38Å; W89-T93 PolarHBondContact O-OG1 3.34Å; W89-T93 VanDerWaalsContact O-OG1 3.04Å
90C93.6Very high92.4Very high8 Ų851.4 Ų51.45%0.05426%0.261CS..Hα-helixtrans-56.6-51.8173.8-172.20000111.5W83 G86 V87 F92 T93 A94 C168W83-C90 HydrophobicContact CZ2-CB 4.27Å; G86-C90 PolarHBondContact O-N 2.76Å; V87-C90 VanDerWaalsContact O-CB 3.29Å; V87-C90 WeakPolarHBondContact O-CB 3.33Å; V87-C90 PolarHBondContact O-N 3.36Å; C90-F92 VanDerWaalsContact C-N 3.33Å; C90-F92 PolarHBondContact O-N 3.49Å; C90-T93 PolarHBondContact O-N 3Å; C90-A94 WeakPolarHBondContact O-CB 3.39Å; C90-A94 PolarHBondContact O-N 3.02Å; C90-C168 WeakPolarHBondContact CA-SG 3.4Å; C90-C168 HydrophobicContact CB-CB 4.04Å; C90-C168 WeakPolarHBondContact CB-SG 3.37Å; C90-C168 WeakPolarHBondContact O-CB 3.3Å; C90-C168 WeakPolarHBondContact SG-CB 3.33Å; C90-C168 CovalentContact SG-SG 2.03Å; C90-C168 PolarHBondContact SG-SG 2.86Å
91N93.3Very high92.7Very high57 Ų5745.1 Ų45.131%0.30523%0.234SC..Hα-helixtrans-61.3-42178.5-64.44.6000111.4V87 A94 L95 F159V87-N91 VanDerWaalsContact O-CG 3.31Å; V87-N91 PolarHBondContact O-N 3.08Å; V87-N91 PolarHBondContact O-OD1 3.47Å; N91-A94 PolarHBondContact O-N 2.82Å; N91-L95 WeakPolarHBondContact O-CB 3.34Å; N91-L95 PolarHBondContact O-N 3.32Å; N91-F159 HydrophobicContact CB-CB 4.4Å; N91-F159 HydrophobicContact CB-CD2 3.84Å
92F93.6Very high93.2Very high96 Ų9641 Ų4142%0.42122%0.218SC..Hα-helixtrans-65.8-44.2177.9-175.1-114.3000112.4V88 W89 C90 L95 L96V88-F92 PolarHBondContact O-N 2.96Å; V88-F92 VanDerWaalsContact O-N 3.12Å; W89-F92 HydrophobicContact CD2-CD1 4.36Å; W89-F92 AromaticContact CE3-CD1 3.96Å; W89-F92 HydrophobicContact CE3-CD1 3.96Å; W89-F92 AromaticContact CH2-CD1 3.82Å; W89-F92 HydrophobicContact CH2-CD1 3.82Å; W89-F92 AromaticContact CH2-CE1 3.79Å; W89-F92 HydrophobicContact CH2-CE1 3.79Å; W89-F92 HydrophobicContact CZ2-CD1 4.21Å; W89-F92 HydrophobicContact CZ2-CE1 4.39Å; W89-F92 AromaticContact CZ3-CD1 3.68Å; W89-F92 HydrophobicContact CZ3-CD1 3.68Å; W89-F92 AromaticContact CZ3-CE1 3.95Å; W89-F92 HydrophobicContact CZ3-CE1 3.95Å; W89-F92 PolarHBondContact O-N 2.92Å; C90-F92 VanDerWaalsContact C-N 3.33Å; C90-F92 PolarHBondContact O-N 3.49Å; F92-L95 PolarHBondContact O-N 3.2Å; F92-L96 HydrophobicContact CD1-CD1 3.92Å; F92-L96 HydrophobicContact CD1-CG 4.44Å; F92-L96 HydrophobicContact CE1-CD1 3.43Å; F92-L96 VanDerWaalsContact CE1-CD1 3.43Å; F92-L96 HydrophobicContact CE1-CG 4.14Å; F92-L96 HydrophobicContact CE2-CD1 4.37Å; F92-L96 HydrophobicContact CE2-CD2 4.42Å; F92-L96 HydrophobicContact CE2-CG 4.23Å; F92-L96 HydrophobicContact CZ-CD1 3.69Å; F92-L96 HydrophobicContact CZ-CD2 4.23Å; F92-L96 HydrophobicContact CZ-CG 4.02Å; F92-L96 WeakPolarHBondContact O-CB 3.42Å; F92-L96 WeakPolarHBondContact O-CG 3.28Å; F92-L96 PolarHBondContact O-N 3.2Å
93T94.4Very high93.7Very high0 Ų037 Ų370%020%0.2CC..Hα-helixtrans-63.8-41.9175.9-60.30000111.7V70 W83 W89 C90 L96 Y97V70-T93 HydrophobicContact CB-CG2 4.38Å; V70-T93 HydrophobicContact CG1-CG2 3.87Å; V70-T93 HydrophobicContact CG2-CG2 4.35Å; W83-T93 HydrophobicContact CH2-CG2 3.94Å; W89-T93 WeakPolarHBondContact O-CB 3.48Å; W89-T93 PolarHBondContact O-N 3.38Å; W89-T93 PolarHBondContact O-OG1 3.34Å; W89-T93 VanDerWaalsContact O-OG1 3.04Å; C90-T93 PolarHBondContact O-N 3Å; T93-L96 PolarHBondContact O-N 2.98Å; T93-Y97 WeakPolarHBondContact O-CB 3.2Å; T93-Y97 PolarHBondContact O-N 3.41Å
94A94.1Very high93.9Very high0 Ų035.6 Ų35.60%019%0.194CC..Hα-helixtrans-61.9-45.2175.900000111.9C90 N91 Y97 L98 F159 C168C90-A94 WeakPolarHBondContact O-CB 3.39Å; C90-A94 PolarHBondContact O-N 3.02Å; N91-A94 PolarHBondContact O-N 2.82Å; A94-Y97 PolarHBondContact O-N 3.3Å; A94-L98 WeakPolarHBondContact O-CG 3.43Å; A94-L98 PolarHBondContact O-N 3.46Å; A94-F159 HydrophobicContact CB-CB 4.12Å; A94-F159 HydrophobicContact CB-CD1 3.44Å; A94-F159 VanDerWaalsContact CB-CD1 3.44Å; A94-F159 HydrophobicContact CB-CD2 4.5Å; A94-F159 HydrophobicContact CB-CE1 3.9Å; A94-F159 HydrophobicContact CB-CG 3.78Å; A94-C168 WeakPolarHBondContact CA-O 3.47Å; A94-C168 HydrophobicContact CB-CB 3.94Å; A94-C168 WeakPolarHBondContact CB-O 3.36Å
95L94.8Very high94Very high25 Ų2532.2 Ų32.213%0.13117%0.174CC..Hα-helixtrans-65.3-43.5177.2-175.6145.6000112.2N91 F92 Y97 L98 L99 C149 L153 F159N91-L95 WeakPolarHBondContact O-CB 3.34Å; N91-L95 PolarHBondContact O-N 3.32Å; F92-L95 PolarHBondContact O-N 3.2Å; L95-Y97 VanDerWaalsContact C-N 3.34Å; L95-Y97 PolarHBondContact O-N 3.03Å; L95-L98 PolarHBondContact O-N 3.07Å; L95-L99 WeakPolarHBondContact O-CB 3.26Å; L95-L99 PolarHBondContact O-N 2.68Å; L95-C149 HydrophobicContact CG-CB 4.49Å; L95-L153 HydrophobicContact CD1-CD1 3.5Å; L95-L153 HydrophobicContact CD1-CD2 3.74Å; L95-L153 HydrophobicContact CD1-CG 3.58Å; L95-F159 HydrophobicContact CB-CE2 4.23Å; L95-F159 HydrophobicContact CB-CZ 4.05Å
96L95.1Very high94.2Very high19 Ų1929.7 Ų29.710%0.09916%0.164CC..Hα-helixtrans-60.3-44.1174.3-77.5-176.6000111.5L69 V70 F92 T93 L98 L99 I100L69-L96 HydrophobicContact CB-CD1 3.93Å; L69-L96 HydrophobicContact CD1-CD1 4.34Å; V70-L96 HydrophobicContact CG2-CB 3.95Å; F92-L96 HydrophobicContact CD1-CD1 3.92Å; F92-L96 HydrophobicContact CD1-CG 4.44Å; F92-L96 HydrophobicContact CE1-CD1 3.43Å; F92-L96 VanDerWaalsContact CE1-CD1 3.43Å; F92-L96 HydrophobicContact CE1-CG 4.14Å; F92-L96 HydrophobicContact CE2-CD1 4.37Å; F92-L96 HydrophobicContact CE2-CD2 4.42Å; F92-L96 HydrophobicContact CE2-CG 4.23Å; F92-L96 HydrophobicContact CZ-CD1 3.69Å; F92-L96 HydrophobicContact CZ-CD2 4.23Å; F92-L96 HydrophobicContact CZ-CG 4.02Å; F92-L96 WeakPolarHBondContact O-CB 3.42Å; F92-L96 WeakPolarHBondContact O-CG 3.28Å; F92-L96 PolarHBondContact O-N 3.2Å; T93-L96 PolarHBondContact O-N 2.98Å; L96-L98 PolarHBondContact O-N 3.3Å; L96-L99 PolarHBondContact O-N 2.97Å; L96-I100 HydrophobicContact CB-CD1 4.17Å; L96-I100 HydrophobicContact CD2-CD1 4.4Å; L96-I100 WeakPolarHBondContact O-CB 3.48Å; L96-I100 WeakPolarHBondContact O-CD1 3.36Å; L96-I100 WeakPolarHBondContact O-CG1 3.29Å; L96-I100 PolarHBondContact O-N 3.42Å
97Y94.6Very high94.4Very high4 Ų428 Ų282%0.01615%0.147CC..Hα-helixtrans-58.4-47.7176.1175.1-105000111.3L66 V70 T93 A94 L95 S101 W272 S302 F303L66-Y97 HydrophobicContact CD1-CD2 3.86Å; L66-Y97 HydrophobicContact CD1-CE2 4.47Å; V70-Y97 HydrophobicContact CG1-CD2 4.42Å; T93-Y97 WeakPolarHBondContact O-CB 3.2Å; T93-Y97 PolarHBondContact O-N 3.41Å; A94-Y97 PolarHBondContact O-N 3.3Å; L95-Y97 VanDerWaalsContact C-N 3.34Å; L95-Y97 PolarHBondContact O-N 3.03Å; Y97-S101 WeakPolarHBondContact O-CB 3.47Å; Y97-S101 PolarHBondContact O-N 2.93Å; Y97-S101 PolarHBondContact O-OG 3.29Å; Y97-W272 HydrophobicContact CE2-CH2 4.49Å; Y97-S302 PolarHBondContact OH-OG 2.69Å; Y97-F303 HydrophobicContact CD2-CE1 4.41Å; Y97-F303 HydrophobicContact CE2-CD1 4.32Å; Y97-F303 AromaticContact CE2-CE1 3.84Å; Y97-F303 HydrophobicContact CE2-CE1 3.84Å
98L94.1Very high94.5Very high2 Ų223.3 Ų23.31%0.0112%0.118CC..Hα-helixtrans-63.3-45177.5-70.5169.3000112.7A94 L95 L96 S101 S102 C149 F159 A170 W172 W182A94-L98 WeakPolarHBondContact O-CG 3.43Å; A94-L98 PolarHBondContact O-N 3.46Å; L95-L98 PolarHBondContact O-N 3.07Å; L96-L98 PolarHBondContact O-N 3.3Å; L98-S101 PolarHBondContact O-OG 2.94Å; L98-S101 VanDerWaalsContact O-OG 3.14Å; L98-S102 VanDerWaalsContact O-CB 3.23Å; L98-S102 WeakPolarHBondContact O-CB 3.14Å; L98-S102 PolarHBondContact O-N 3.42Å; L98-S102 VanDerWaalsContact O-N 3.11Å; L98-S102 PolarHBondContact O-OG 3.04Å; L98-C149 HydrophobicContact CB-CB 4.01Å; L98-F159 HydrophobicContact CD1-CE1 3.68Å; L98-F159 HydrophobicContact CD1-CZ 4.28Å; L98-A170 HydrophobicContact CD1-CB 4.38Å; L98-W172 HydrophobicContact CD2-CH2 3.66Å; L98-W172 HydrophobicContact CD2-CZ2 4.01Å; L98-W182 HydrophobicContact CD2-CD2 4.43Å; L98-W182 HydrophobicContact CD2-CZ2 4.1Å
99L96Very high94.5Very high29 Ų2917.4 Ų17.415%0.1528%0.082CC..Hα-helixtrans-62.4-52.2178.7175.560.5000111.5L95 L96 S102 A103 L146 C149L95-L99 WeakPolarHBondContact O-CB 3.26Å; L95-L99 PolarHBondContact O-N 2.68Å; L96-L99 PolarHBondContact O-N 2.97Å; L99-S102 PolarHBondContact O-N 3.23Å; L99-A103 WeakPolarHBondContact O-CB 3.37Å; L99-A103 PolarHBondContact O-N 3.27Å; L99-L146 HydrophobicContact CD1-CB 4.18Å; L99-L146 HydrophobicContact CD1-CD1 4.46Å; L99-C149 HydrophobicContact CB-CB 4.26Å
100I96.2Very high94.6Very high5 Ų513.4 Ų13.43%0.0267%0.069CC..Hα-helixtrans-71.6-39.4-172.2-65166.9000111S62 L65 L66 L96 A103 S104S62-I100 WeakPolarHBondContact O-CG2 3.31Å; L65-I100 HydrophobicContact CB-CD1 3.93Å; L65-I100 HydrophobicContact CB-CG1 4.47Å; L66-I100 HydrophobicContact CB-CG2 3.83Å; L96-I100 HydrophobicContact CB-CD1 4.17Å; L96-I100 HydrophobicContact CD2-CD1 4.4Å; L96-I100 WeakPolarHBondContact O-CB 3.48Å; L96-I100 WeakPolarHBondContact O-CD1 3.36Å; L96-I100 WeakPolarHBondContact O-CG1 3.29Å; L96-I100 PolarHBondContact O-N 3.42Å; I100-A103 PolarHBondContact O-N 3Å; I100-S104 WeakPolarHBondContact O-CB 3.48Å; I100-S104 PolarHBondContact O-N 2.79Å
101S93.9Very high94.5Very high2 Ų213.3 Ų13.31%0.0147%0.068CC..Hα-helixtrans-63.4-48.4173.958.20000111.4Y97 L98 A103 S104 M105Y97-S101 WeakPolarHBondContact O-CB 3.47Å; Y97-S101 PolarHBondContact O-N 2.93Å; Y97-S101 PolarHBondContact O-OG 3.29Å; L98-S101 PolarHBondContact O-OG 2.94Å; L98-S101 VanDerWaalsContact O-OG 3.14Å; S101-A103 VanDerWaalsContact C-N 3.32Å; S101-A103 PolarHBondContact O-N 3.45Å; S101-S104 WeakPolarHBondContact O-CB 3.48Å; S101-S104 PolarHBondContact O-N 3.12Å; S101-S104 VanDerWaalsContact O-N 3.14Å; S101-M105 WeakPolarHBondContact O-CE 3.36Å; S101-M105 WeakPolarHBondContact O-CG 3.26Å; S101-M105 PolarHBondContact O-N 3.19Å
102S95.1Very high94.4Very high0 Ų010.6 Ų10.60%05%0.053CC..Hα-helixtrans-56.5-45.6177-57.10000111.4L98 L99 S104 M105 L106 W182 C186L98-S102 VanDerWaalsContact O-CB 3.23Å; L98-S102 WeakPolarHBondContact O-CB 3.14Å; L98-S102 PolarHBondContact O-N 3.42Å; L98-S102 VanDerWaalsContact O-N 3.11Å; L98-S102 PolarHBondContact O-OG 3.04Å; L99-S102 PolarHBondContact O-N 3.23Å; S102-S104 PolarHBondContact O-N 3.45Å; S102-M105 PolarHBondContact O-N 3.28Å; S102-L106 WeakPolarHBondContact O-CB 3.45Å; S102-L106 WeakPolarHBondContact O-CG 3.3Å; S102-L106 PolarHBondContact O-N 3.47Å; S102-W182 PolarHBondContact OG-NE1 3.39Å; S102-C186 PolarHBondContact OG-SG 3.11Å
103A96.8Very high94.3Very high0 Ų09.1 Ų9.10%05%0.049CC..Hα-helixtrans-63.9-40177.900000112.4L99 I100 S101 T107 W142 S145L99-A103 WeakPolarHBondContact O-CB 3.37Å; L99-A103 PolarHBondContact O-N 3.27Å; I100-A103 PolarHBondContact O-N 3Å; S101-A103 VanDerWaalsContact C-N 3.32Å; S101-A103 PolarHBondContact O-N 3.45Å; A103-T107 VanDerWaalsContact O-CB 3.26Å; A103-T107 WeakPolarHBondContact O-CB 3.49Å; A103-T107 PolarHBondContact O-N 2.89Å; A103-T107 PolarHBondContact O-OG1 3.02Å; A103-W142 HydrophobicContact CB-CD2 4.02Å; A103-W142 HydrophobicContact CB-CE3 3.87Å; A103-W142 HydrophobicContact CB-CH2 4.13Å; A103-W142 HydrophobicContact CB-CZ2 4.26Å; A103-W142 HydrophobicContact CB-CZ3 3.93Å; A103-S145 WeakPolarHBondContact CA-OG 3.38Å; A103-S145 PolarHBondContact N-OG 3.45Å
104S95.1Very high94.1Very high2 Ų29.2 Ų9.21%0.0145%0.05CC..Hα-helixtrans-61.1-49.3175.1-164.60000111.4L59 N63 I100 S101 S102 T107 L108L59-S104 WeakPolarHBondContact CD1-OG 3.24Å; N63-S104 PolarHBondContact ND2-OG 3.06Å; N63-S104 VanDerWaalsContact ND2-OG 3.09Å; I100-S104 WeakPolarHBondContact O-CB 3.48Å; I100-S104 PolarHBondContact O-N 2.79Å; S101-S104 WeakPolarHBondContact O-CB 3.48Å; S101-S104 PolarHBondContact O-N 3.12Å; S101-S104 VanDerWaalsContact O-N 3.14Å; S102-S104 PolarHBondContact O-N 3.45Å; S104-T107 WeakPolarHBondContact O-CB 3.49Å; S104-T107 PolarHBondContact O-N 3.35Å; S104-L108 PolarHBondContact O-N 3.21Å
105M94Very high93.8Very high0 Ų013.4 Ų13.40%07%0.066CC..Hα-helixtrans-67.6-44.1-177.9-65.9-174.7-76.700112.8S101 S102 T107 L108 G109 W182 I187 P190 F268 W272S101-M105 WeakPolarHBondContact O-CE 3.36Å; S101-M105 WeakPolarHBondContact O-CG 3.26Å; S101-M105 PolarHBondContact O-N 3.19Å; S102-M105 PolarHBondContact O-N 3.28Å; M105-T107 VanDerWaalsContact C-N 3.29Å; M105-T107 PolarHBondContact O-N 2.86Å; M105-L108 WeakPolarHBondContact O-CB 3.41Å; M105-L108 PolarHBondContact O-N 3.03Å; M105-L108 VanDerWaalsContact O-N 3.16Å; M105-G109 PolarHBondContact O-N 3.47Å; M105-G109 VanDerWaalsContact O-N 3.15Å; M105-W182 HydrophobicContact CE-CH2 4.12Å; M105-W182 HydrophobicContact CE-CZ2 4.02Å; M105-I187 HydrophobicContact CE-CD1 3.38Å; M105-I187 HydrophobicContact SD-CD1 3.36Å; M105-I187 WeakPolarHBondContact SD-CD1 3.45Å; M105-P190 HydrophobicContact CB-CG 4.3Å; M105-P190 VanDerWaalsContact O-CB 3.24Å; M105-P190 WeakPolarHBondContact O-CB 3.43Å; M105-F268 HydrophobicContact CB-CE2 4.11Å; M105-F268 HydrophobicContact CG-CE2 3.86Å; M105-F268 HydrophobicContact SD-CE2 4.11Å; M105-W272 HydrophobicContact CE-CD2 4.43Å; M105-W272 HydrophobicContact CE-CE3 4.05Å; M105-W272 HydrophobicContact CE-CH2 4.42Å; M105-W272 HydrophobicContact CE-CZ3 4.04Å; M105-W272 HydrophobicContact CG-CD2 4.23Å; M105-W272 HydrophobicContact CG-CG 4.45Å; M105-W272 HydrophobicContact SD-CB 4.41Å; M105-W272 HydrophobicContact SD-CD2 3.44Å; M105-W272 HydrophobicContact SD-CE3 3.52Å; M105-W272 VanDerWaalsContact SD-CE3 3.52Å; M105-W272 HydrophobicContact SD-CG 3.83Å; M105-W272 HydrophobicContact SD-CZ2 4.48Å; M105-W272 HydrophobicContact SD-CZ3 4.1Å
106L95.6Very high93.5Very high17 Ų1714.8 Ų14.89%0.0897%0.07CC..Hα-helixtrans-64.8-33.4173.8-74.7163.4000111.8S102 G109 A110 V141 H144 P190S102-L106 WeakPolarHBondContact O-CB 3.45Å; S102-L106 WeakPolarHBondContact O-CG 3.3Å; S102-L106 PolarHBondContact O-N 3.47Å; L106-G109 PolarHBondContact O-N 3.4Å; L106-A110 PolarHBondContact O-N 3.14Å; L106-V141 HydrophobicContact CB-CB 4.45Å; L106-V141 HydrophobicContact CB-CG1 3.64Å; L106-V141 HydrophobicContact CB-CG2 4.19Å; L106-H144 HydrophobicContact CD1-CB 4.31Å; L106-H144 WeakPolarHBondContact CD1-ND1 3.32Å; L106-P190 HydrophobicContact CD2-CG 4.29Å
107T95.3Very high93.3Very high1 Ų117.7 Ų17.71%0.0068%0.08CC..Hα-helixtrans-65.6-36.7172.1-58.50000111.9F55 L59 A103 S104 M105 G109 A110 I111F55-T107 HydrophobicContact CB-CG2 4.48Å; F55-T107 VanDerWaalsContact O-CG2 3.29Å; F55-T107 WeakPolarHBondContact O-CG2 3.41Å; L59-T107 HydrophobicContact CB-CG2 3.86Å; A103-T107 VanDerWaalsContact O-CB 3.26Å; A103-T107 WeakPolarHBondContact O-CB 3.49Å; A103-T107 PolarHBondContact O-N 2.89Å; A103-T107 PolarHBondContact O-OG1 3.02Å; S104-T107 WeakPolarHBondContact O-CB 3.49Å; S104-T107 PolarHBondContact O-N 3.35Å; M105-T107 VanDerWaalsContact C-N 3.29Å; M105-T107 PolarHBondContact O-N 2.86Å; T107-G109 VanDerWaalsContact C-N 3.33Å; T107-G109 PolarHBondContact O-N 2.98Å; T107-A110 PolarHBondContact O-N 3.01Å; T107-I111 HydrophobicContact CG2-CD1 4.17Å; T107-I111 VanDerWaalsContact O-CG1 3.31Å; T107-I111 WeakPolarHBondContact O-CG1 3.31Å; T107-I111 PolarHBondContact O-N 3.49Å
108L92.2Very high92.9Very high3 Ų319 Ų192%0.0169%0.091CC..Hα-helixtrans-62.3-40.4172.1-67.8166.9000111.7L59 S104 M105 I111 A112 M194 V264 F268 Y313L59-L108 HydrophobicContact CD1-CD2 4.1Å; L59-L108 HydrophobicContact CD1-CG 4.04Å; L59-L108 HydrophobicContact CD2-CD2 3.75Å; S104-L108 PolarHBondContact O-N 3.21Å; M105-L108 WeakPolarHBondContact O-CB 3.41Å; M105-L108 PolarHBondContact O-N 3.03Å; M105-L108 VanDerWaalsContact O-N 3.16Å; L108-I111 PolarHBondContact O-N 3.07Å; L108-A112 PolarHBondContact O-N 3.42Å; L108-M194 HydrophobicContact CB-SD 4.21Å; L108-V264 HydrophobicContact CD2-CG1 4.39Å; L108-F268 HydrophobicContact CD1-CD2 3.77Å; L108-F268 HydrophobicContact CD1-CE2 4.49Å; L108-Y313 HydrophobicContact CD2-CE2 4.39Å
109G93.9Very high92.4Very high2 Ų220.7 Ų20.72%0.02110%0.102CC..Hα-helixtrans-58.2-45.7170.900000112.7M105 L106 T107 I111 A112 I113 I193M105-G109 PolarHBondContact O-N 3.47Å; M105-G109 VanDerWaalsContact O-N 3.15Å; L106-G109 PolarHBondContact O-N 3.4Å; T107-G109 VanDerWaalsContact C-N 3.33Å; T107-G109 PolarHBondContact O-N 2.98Å; G109-I111 PolarHBondContact O-N 2.98Å; G109-A112 WeakPolarHBondContact O-CB 3.46Å; G109-A112 PolarHBondContact O-N 2.97Å; G109-A112 VanDerWaalsContact O-N 3.16Å; G109-I113 PolarHBondContact O-N 3.49Å; G109-I193 WeakPolarHBondContact O-CG2 3.22Å
110A94.1Very high91.8Very high10 Ų1021 Ų218%0.08310%0.104CC..Hα-helixtrans-63-38.6175.200000112.8F55 L106 T107 A112 I113 D114 V137F55-A110 HydrophobicContact CD1-CB 4.08Å; F55-A110 HydrophobicContact CE1-CB 4.09Å; L106-A110 PolarHBondContact O-N 3.14Å; T107-A110 PolarHBondContact O-N 3.01Å; A110-A112 VanDerWaalsContact C-N 3.31Å; A110-A112 PolarHBondContact O-N 3.43Å; A110-I113 PolarHBondContact O-N 3.29Å; A110-D114 PolarHBondContact O-N 3.15Å; A110-V137 HydrophobicContact CB-CG1 4.12Å
111I92Very high91.3Very high5 Ų525.9 Ų25.93%0.02612%0.122CC..Hα-helixtrans-63.1-37.8173.6-68.3164.9000110.8F55 L59 T107 L108 G109 I113 D114 R115 Y313F55-I111 HydrophobicContact CB-CD1 4.3Å; F55-I111 HydrophobicContact CB-CG1 3.6Å; L59-I111 HydrophobicContact CB-CD1 4.33Å; L59-I111 HydrophobicContact CD2-CD1 3.8Å; T107-I111 HydrophobicContact CG2-CD1 4.17Å; T107-I111 VanDerWaalsContact O-CG1 3.31Å; T107-I111 WeakPolarHBondContact O-CG1 3.31Å; T107-I111 PolarHBondContact O-N 3.49Å; L108-I111 PolarHBondContact O-N 3.07Å; G109-I111 PolarHBondContact O-N 2.98Å; I111-I113 VanDerWaalsContact C-N 3.34Å; I111-I113 PolarHBondContact O-N 2.88Å; I111-D114 PolarHBondContact O-N 2.85Å; I111-R115 HydrophobicContact CG2-CG 4.29Å; I111-R115 WeakPolarHBondContact O-CB 3.44Å; I111-R115 VanDerWaalsContact O-CG 3.3Å; I111-R115 WeakPolarHBondContact O-CG 3.22Å; I111-R115 PolarHBondContact O-N 3.44Å; I111-Y313 HydrophobicContact CG2-CE1 4.15Å
112A91.3Very high90.8Very high0 Ų029.7 Ų29.70%015%0.147CC..Hα-helixtrans-63.7-38.1175.900000112.8L108 G109 A110 R115 Y116 M194 C197 Y198L108-A112 PolarHBondContact O-N 3.42Å; G109-A112 WeakPolarHBondContact O-CB 3.46Å; G109-A112 PolarHBondContact O-N 2.97Å; G109-A112 VanDerWaalsContact O-N 3.16Å; A110-A112 VanDerWaalsContact C-N 3.31Å; A110-A112 PolarHBondContact O-N 3.43Å; A112-R115 PolarHBondContact O-N 3.43Å; A112-Y116 WeakPolarHBondContact O-CB 3.28Å; A112-Y116 PolarHBondContact O-N 3.24Å; A112-M194 HydrophobicContact CB-CB 4.43Å; A112-M194 HydrophobicContact CB-CG 3.71Å; A112-C197 HydrophobicContact CB-CB 4.23Å; A112-Y198 WeakPolarHBondContact CA-OH 3.46Å; A112-Y198 HydrophobicContact CB-CD2 4.32Å; A112-Y198 HydrophobicContact CB-CE1 4.08Å; A112-Y198 HydrophobicContact CB-CE2 3.57Å; A112-Y198 VanDerWaalsContact CB-CZ 3.44Å; A112-Y198 WeakPolarHBondContact CB-OH 3.36Å
113I92Very high90.3Very high65 Ų6537.5 Ų37.533%0.33319%0.185SC..Hα-helixtrans-66.6-44.5173.8-62.9169.9000111.2G109 A110 I111 R115 Y116 Y117 I193G109-I113 PolarHBondContact O-N 3.49Å; A110-I113 PolarHBondContact O-N 3.29Å; I111-I113 VanDerWaalsContact C-N 3.34Å; I111-I113 PolarHBondContact O-N 2.88Å; I113-R115 VanDerWaalsContact C-N 3.34Å; I113-R115 PolarHBondContact O-N 3.22Å; I113-Y116 WeakPolarHBondContact O-CB 3.35Å; I113-Y116 PolarHBondContact O-N 2.89Å; I113-Y117 HydrophobicContact CG2-CD2 3.88Å; I113-Y117 HydrophobicContact CG2-CE2 3.73Å; I113-Y117 WeakPolarHBondContact O-CD2 3.21Å; I113-Y117 PolarHBondContact O-N 3.47Å; I113-I193 HydrophobicContact CD1-CD1 4.46Å; I113-I193 HydrophobicContact CD1-CG2 3.8Å; I113-I193 HydrophobicContact CG1-CG2 3.6Å
114D90.8Very high89.7Confident3 Ų341.2 Ų41.22%0.01621%0.205CC..Hα-helixtrans-58.1-45174.1160.794.5000111.5S52 F55 A110 I111 A118 Y125S52-D114 WeakPolarHBondContact CA-OD1 3.23Å; S52-D114 VanDerWaalsContact CB-OD1 3.27Å; S52-D114 WeakPolarHBondContact CB-OD1 3.36Å; S52-D114 PolarHBondContact OG-OD1 3.04Å; S52-D114 PolarHBondContact OG-OD2 3.28Å; F55-D114 HydrophobicContact CD2-CB 4.12Å; F55-D114 HydrophobicContact CE2-CB 4.1Å; A110-D114 PolarHBondContact O-N 3.15Å; I111-D114 PolarHBondContact O-N 2.85Å; D114-A118 WeakPolarHBondContact O-CB 3.21Å; D114-A118 PolarHBondContact O-N 3.4Å; D114-Y125 PolarHBondContact OD1-OH 3.08Å; D114-Y125 VanDerWaalsContact OD1-OH 3.04Å
115R87.9Confident89.4Confident87 Ų8743 Ų4333%0.32821%0.211SC..Hα-helixtrans-65.3-38174.8-67.8-57.493.7-179.93.1112.7S52 I111 A112 I113 A118 V119 Y198S52-R115 PolarHBondContact OG-NH2 2.98Å; I111-R115 HydrophobicContact CG2-CG 4.29Å; I111-R115 WeakPolarHBondContact O-CB 3.44Å; I111-R115 VanDerWaalsContact O-CG 3.3Å; I111-R115 WeakPolarHBondContact O-CG 3.22Å; I111-R115 PolarHBondContact O-N 3.44Å; A112-R115 PolarHBondContact O-N 3.43Å; I113-R115 VanDerWaalsContact C-N 3.34Å; I113-R115 PolarHBondContact O-N 3.22Å; R115-A118 PolarHBondContact O-N 3.4Å; R115-V119 WeakPolarHBondContact O-CB 3.38Å; R115-V119 VanDerWaalsContact O-CG2 3.31Å; R115-V119 WeakPolarHBondContact O-CG2 3.33Å; R115-V119 PolarHBondContact O-N 3.34Å; R115-Y198 HydrophobicContact CB-CE1 4.29Å
116Y88.5Confident88.9Confident54 Ų5447 Ų4721%0.21224%0.237CC..Hα-helixtrans-57.3-53.8175.3172.3-84.7000111.4A112 I113 A118 V119 L120 Y121 C197 V200A112-Y116 WeakPolarHBondContact O-CB 3.28Å; A112-Y116 PolarHBondContact O-N 3.24Å; I113-Y116 WeakPolarHBondContact O-CB 3.35Å; I113-Y116 PolarHBondContact O-N 2.89Å; Y116-A118 PolarHBondContact O-N 2.93Å; Y116-V119 PolarHBondContact O-N 3.26Å; Y116-L120 HydrophobicContact CD1-CD1 4.27Å; Y116-L120 HydrophobicContact CD2-CD1 3.32Å; Y116-L120 HydrophobicContact CE1-CD1 4.11Å; Y116-L120 HydrophobicContact CE2-CD1 3.16Å; Y116-L120 HydrophobicContact CG-CD1 3.88Å; Y116-L120 WeakPolarHBondContact O-CB 3.48Å; Y116-L120 PolarHBondContact O-N 3.18Å; Y116-Y121 HydrophobicContact CE1-CD2 4.34Å; Y116-Y121 AromaticContact CE1-CE2 3.91Å; Y116-Y121 HydrophobicContact CE1-CE2 3.91Å; Y116-C197 HydrophobicContact CD2-CB 4.19Å; Y116-V200 HydrophobicContact CE2-CB 4.14Å; Y116-V200 HydrophobicContact CE2-CG1 4.03Å
117Y89.8Confident88.3Confident80 Ų8053.2 Ų53.231%0.31427%0.268SS..Hα-helixtrans-64.7-40.5177.9-76-68.7000112.4I113 V119 Y121 I129I113-Y117 HydrophobicContact CG2-CD2 3.88Å; I113-Y117 HydrophobicContact CG2-CE2 3.73Å; I113-Y117 WeakPolarHBondContact O-CD2 3.21Å; I113-Y117 PolarHBondContact O-N 3.47Å; Y117-V119 VanDerWaalsContact C-N 3.34Å; Y117-V119 PolarHBondContact O-N 3.38Å; Y117-Y121 HydrophobicContact CD1-CD2 4.03Å; Y117-Y121 HydrophobicContact CE1-CD2 4.46Å; Y117-Y121 CarbonylContact O-C 3.32Å; Y117-Y121 VanDerWaalsContact O-C 3.32Å; Y117-Y121 WeakPolarHBondContact O-CA 3.44Å; Y117-Y121 PolarHBondContact O-N 2.92Å; Y117-I129 HydrophobicContact CD2-CD1 4.31Å
118A85.9Confident87.7Confident31 Ų3158.8 Ų58.826%0.25629%0.292SS..Hα-helixtrans-64.8-33.9-179.700000113.7D114 R115 Y116 Y125D114-A118 WeakPolarHBondContact O-CB 3.21Å; D114-A118 PolarHBondContact O-N 3.4Å; R115-A118 PolarHBondContact O-N 3.4Å; Y116-A118 PolarHBondContact O-N 2.93Å; A118-Y125 HydrophobicContact CB-CD2 3.83Å; A118-Y125 HydrophobicContact CB-CE2 3.91Å; A118-Y125 HydrophobicContact CB-CG 4.41Å
119V83.4Confident87.4Confident38 Ų3860 Ų6023%0.2330%0.298CS..Hα-helixtrans-88.4-37.6-177.5173.70000112.6R115 Y116 Y117 I201 F258 I261R115-V119 WeakPolarHBondContact O-CB 3.38Å; R115-V119 VanDerWaalsContact O-CG2 3.31Å; R115-V119 WeakPolarHBondContact O-CG2 3.33Å; R115-V119 PolarHBondContact O-N 3.34Å; Y116-V119 PolarHBondContact O-N 3.26Å; Y117-V119 VanDerWaalsContact C-N 3.34Å; Y117-V119 PolarHBondContact O-N 3.38Å; V119-I201 HydrophobicContact CG1-CG1 4.49Å; V119-I201 HydrophobicContact CG1-CG2 4.37Å; V119-F258 HydrophobicContact CG1-CE1 4.37Å; V119-F258 HydrophobicContact CG1-CZ 4.32Å; V119-I261 HydrophobicContact CG2-CD1 4.35Å
120L84.3Confident87.2Confident37 Ų3762.3 Ų62.319%0.19431%0.312CS..Hα-helixtrans-91.3-36.3-175-67.1164000113.1Y116 P122 V200 I201 V204Y116-L120 HydrophobicContact CD1-CD1 4.27Å; Y116-L120 HydrophobicContact CD2-CD1 3.32Å; Y116-L120 HydrophobicContact CE1-CD1 4.11Å; Y116-L120 HydrophobicContact CE2-CD1 3.16Å; Y116-L120 HydrophobicContact CG-CD1 3.88Å; Y116-L120 WeakPolarHBondContact O-CB 3.48Å; Y116-L120 PolarHBondContact O-N 3.18Å; L120-P122 VanDerWaalsContact C-CD 3.42Å; L120-P122 WeakPolarHBondContact O-CD 3.24Å; L120-V200 HydrophobicContact CD1-CG1 3.78Å; L120-V200 HydrophobicContact CD2-CG1 4.39Å; L120-I201 HydrophobicContact CD1-CG1 4.42Å; L120-V204 HydrophobicContact CD2-CB 3.92Å; L120-V204 HydrophobicContact CD2-CG1 3.98Å; L120-V204 HydrophobicContact CD2-CG2 3.66Å
121Y84.8Confident86.9Confident106 Ų10662.9 Ų62.942%0.41632%0.318SS..  trans-127.756.7-171.3-57.7-77.8000112.3Y116 Y117 M123 I124 Y125Y116-Y121 HydrophobicContact CE1-CD2 4.34Å; Y116-Y121 AromaticContact CE1-CE2 3.91Å; Y116-Y121 HydrophobicContact CE1-CE2 3.91Å; Y117-Y121 HydrophobicContact CD1-CD2 4.03Å; Y117-Y121 HydrophobicContact CE1-CD2 4.46Å; Y117-Y121 CarbonylContact O-C 3.32Å; Y117-Y121 VanDerWaalsContact O-C 3.32Å; Y117-Y121 WeakPolarHBondContact O-CA 3.44Å; Y117-Y121 PolarHBondContact O-N 2.92Å; Y121-M123 PolarHBondContact O-N 3.3Å; Y121-M123 VanDerWaalsContact O-N 3.1Å; Y121-I124 HydrophobicContact CD1-CD1 4.25Å; Y121-I124 PolarHBondContact O-N 2.81Å; Y121-Y125 WeakPolarHBondContact O-CB 3.28Å; Y121-Y125 PolarHBondContact O-N 3.43Å
122P83.3Confident86.8Confident83 Ų8368.8 Ų68.854%0.53935%0.35SS..THydrogen-bonded Turntrans-58.9-29.6-17224.3-35.3000114.2L120 P126L120-P122 VanDerWaalsContact C-CD 3.42Å; L120-P122 WeakPolarHBondContact O-CD 3.24Å; P122-P126 WeakPolarHBondContact O-CD 3.45Å
123M84.4Confident86.9Confident163 Ų16375.3 Ų75.380%0.80338%0.375SS*.THydrogen-bonded Turntrans-75.8-33177.4-57.5-59.3-75.300112.9Y121Y121-M123 PolarHBondContact O-N 3.3Å; Y121-M123 VanDerWaalsContact O-N 3.1Å
124I85.4Confident86.9Confident79 Ų7972.3 Ų72.341%0.40536%0.36SS..THydrogen-bonded Turntrans-91.1-26.5-176.5-57.7173000110.9Y121 M127 K128Y121-I124 HydrophobicContact CD1-CD1 4.25Å; Y121-I124 PolarHBondContact O-N 2.81Å; I124-M127 WeakPolarHBondContact O-CB 3.46Å; I124-M127 PolarHBondContact O-N 3.47Å; I124-K128 HydrophobicContact CG2-CG 3.59Å; I124-K128 PolarHBondContact O-N 3.31Å
125Y87.8Confident87.1Confident39 Ų3975.4 Ų75.415%0.15338%0.378CS..Hα-helixtrans-42.6-54.4177.6175.8-92000114.3S52 D114 A118 Y121 M127 K128 I129S52-Y125 PolarHBondContact OG-OH 2.84Å; D114-Y125 PolarHBondContact OD1-OH 3.08Å; D114-Y125 VanDerWaalsContact OD1-OH 3.04Å; A118-Y125 HydrophobicContact CB-CD2 3.83Å; A118-Y125 HydrophobicContact CB-CE2 3.91Å; A118-Y125 HydrophobicContact CB-CG 4.41Å; Y121-Y125 WeakPolarHBondContact O-CB 3.28Å; Y121-Y125 PolarHBondContact O-N 3.43Å; Y125-M127 PolarHBondContact O-N 3.32Å; Y125-K128 PolarHBondContact O-N 3.12Å; Y125-I129 HydrophobicContact CD2-CB 4.23Å; Y125-I129 HydrophobicContact CD2-CG1 3.9Å; Y125-I129 HydrophobicContact CE2-CB 3.74Å; Y125-I129 HydrophobicContact CE2-CG1 3.63Å; Y125-I129 HydrophobicContact CE2-CG2 4Å; Y125-I129 PolarHBondContact O-N 2.94Å
126P84.4Confident87.4Confident84 Ų8476.1 Ų76.155%0.54539%0.392SS..Hα-helixtrans-65.5-22.7-178.226.7-35.8000114P122P122-P126 WeakPolarHBondContact O-CD 3.45Å
127M83.8Confident87.8Confident148 Ų14876.3 Ų76.373%0.72940%0.399SS*.Hα-helixtrans-84.7-29.7177-57.2179.576.900112.6I124 Y125 R133I124-M127 WeakPolarHBondContact O-CB 3.46Å; I124-M127 PolarHBondContact O-N 3.47Å; Y125-M127 PolarHBondContact O-N 3.32Å; M127-R133 PolarHBondContact O-NH1 3.05Å; M127-R133 VanDerWaalsContact O-NH1 3.15Å
128K82.4Confident88.1Confident117 Ų11773.8 Ų73.851%0.50939%0.391SS..Hα-helixtrans-87.7-49.3179.7-68.6-73.2-175.4174.80112I124 Y125 T130 R133I124-K128 HydrophobicContact CG2-CG 3.59Å; I124-K128 PolarHBondContact O-N 3.31Å; Y125-K128 PolarHBondContact O-N 3.12Å; K128-T130 PolarHBondContact O-N 3.32Å; K128-R133 VanDerWaalsContact O-CD 3.28Å; K128-R133 WeakPolarHBondContact O-CD 3.15Å; K128-R133 PolarHBondContact O-NH1 3.36Å
129I84.6Confident88.6Confident29 Ų2976 Ų7615%0.14940%0.401CS..SBendtrans-9485-174.2-56.9-61.5000110.3P51 Y117 Y125P51-I129 HydrophobicContact CB-CG2 3.76Å; Y117-I129 HydrophobicContact CD2-CD1 4.31Å; Y125-I129 HydrophobicContact CD2-CB 4.23Å; Y125-I129 HydrophobicContact CD2-CG1 3.9Å; Y125-I129 HydrophobicContact CE2-CB 3.74Å; Y125-I129 HydrophobicContact CE2-CG1 3.63Å; Y125-I129 HydrophobicContact CE2-CG2 4Å; Y125-I129 PolarHBondContact O-N 2.94Å
130T89.9Confident89.3Confident51 Ų5181 Ų8131%0.31342%0.417SS..  trans-94.8156.6177.371.10000112K128 N132 R133 A134K128-T130 PolarHBondContact O-N 3.32Å; T130-N132 PolarHBondContact O-N 3.04Å; T130-R133 PolarHBondContact O-N 3.19Å; T130-R133 WeakPolarHBondContact OG1-CG 3.21Å; T130-R133 PolarHBondContact OG1-N 3.17Å; T130-A134 PolarHBondContact O-N 3.49Å
131G88Confident89.9Confident21 Ų2179.7 Ų79.722%0.21641%0.41CS..Hα-helixtrans-60.9-25.5-177.800000114.9K54 V135K54-G131 PolarHBondContact NZ-O 3.43Å; G131-V135 WeakPolarHBondContact O-CG2 3.3Å
132N90.9Very high90.5Very high130 Ų13077.7 Ų77.770%0.69540%0.402SS*.Hα-helixtrans-83.6-43.2177.8-65.12.9000111T130 A134 V135 V136T130-N132 PolarHBondContact O-N 3.04Å; N132-A134 VanDerWaalsContact C-N 3.28Å; N132-A134 PolarHBondContact O-N 3.39Å; N132-V135 PolarHBondContact O-N 3.08Å; N132-V135 VanDerWaalsContact O-N 3.07Å; N132-V136 PolarHBondContact O-N 3.23Å
133R92Very high91.1Very high137 Ų13778.5 Ų78.552%0.51740%0.401SS..Hα-helixtrans-58.7-39.8174.1-73.3176.7178.4156.62.7111.7M127 K128 T130 V135 V136 V137M127-R133 PolarHBondContact O-NH1 3.05Å; M127-R133 VanDerWaalsContact O-NH1 3.15Å; K128-R133 VanDerWaalsContact O-CD 3.28Å; K128-R133 WeakPolarHBondContact O-CD 3.15Å; K128-R133 PolarHBondContact O-NH1 3.36Å; T130-R133 PolarHBondContact O-N 3.19Å; T130-R133 WeakPolarHBondContact OG1-CG 3.21Å; T130-R133 PolarHBondContact OG1-N 3.17Å; R133-V135 VanDerWaalsContact C-N 3.31Å; R133-V135 PolarHBondContact O-N 2.67Å; R133-V136 PolarHBondContact O-N 3.25Å; R133-V137 WeakPolarHBondContact O-CG2 3.26Å; R133-V137 PolarHBondContact O-N 2.93Å
134A92.8Very high91.7Very high2 Ų271.9 Ų71.92%0.01737%0.368CS..Hα-helixtrans-59-39.7174.600000112.8K54 F55 T130 N132 V137 I138K54-A134 HydrophobicContact CD-CB 4.32Å; F55-A134 HydrophobicContact CE1-CB 4.43Å; F55-A134 HydrophobicContact CE2-CB 4.15Å; F55-A134 HydrophobicContact CZ-CB 3.89Å; T130-A134 PolarHBondContact O-N 3.49Å; N132-A134 VanDerWaalsContact C-N 3.28Å; N132-A134 PolarHBondContact O-N 3.39Å; A134-V137 PolarHBondContact O-N 3.43Å; A134-I138 WeakPolarHBondContact O-CD1 3.39Å; A134-I138 VanDerWaalsContact O-CG1 3.25Å; A134-I138 WeakPolarHBondContact O-CG1 3.5Å; A134-I138 PolarHBondContact O-N 2.99Å
135V93.9Very high92.2Very high67 Ų6768.1 Ų68.141%0.40635%0.349SS..Hα-helixtrans-67.8-41.6175.9174.80000111.3K54 G131 N132 R133 V137 I138 V139K54-V135 HydrophobicContact CD-CG2 4.04Å; G131-V135 WeakPolarHBondContact O-CG2 3.3Å; N132-V135 PolarHBondContact O-N 3.08Å; N132-V135 VanDerWaalsContact O-N 3.07Å; R133-V135 VanDerWaalsContact C-N 3.31Å; R133-V135 PolarHBondContact O-N 2.67Å; V135-V137 VanDerWaalsContact C-N 3.34Å; V135-V137 PolarHBondContact O-N 2.96Å; V135-I138 PolarHBondContact O-N 3.31Å; V135-V139 HydrophobicContact CG1-CG2 4.43Å; V135-V139 WeakPolarHBondContact O-CG2 3.37Å; V135-V139 PolarHBondContact O-N 3.24Å
136V95.8Very high92.6Very high102 Ų10269.6 Ų69.662%0.61836%0.359SS*.Hα-helixtrans-60.5-43.7175.4175.10000111.3N132 R133 I138 V139 Y140N132-V136 PolarHBondContact O-N 3.23Å; R133-V136 PolarHBondContact O-N 3.25Å; V136-I138 VanDerWaalsContact C-N 3.35Å; V136-I138 PolarHBondContact O-N 3.34Å; V136-V139 PolarHBondContact O-N 2.99Å; V136-Y140 WeakPolarHBondContact O-CB 3.5Å; V136-Y140 PolarHBondContact O-N 3.25Å
137V95.9Very high93.1Very high59 Ų5969 Ų6936%0.35835%0.354SS..Hα-helixtrans-63.2-40.2175.7174.10000111.4F55 A110 R133 A134 V135 Y140 V141F55-V137 HydrophobicContact CE1-CB 3.95Å; F55-V137 HydrophobicContact CE1-CG1 3.71Å; F55-V137 HydrophobicContact CZ-CB 4.25Å; F55-V137 HydrophobicContact CZ-CG1 4.18Å; A110-V137 HydrophobicContact CB-CG1 4.12Å; R133-V137 WeakPolarHBondContact O-CG2 3.26Å; R133-V137 PolarHBondContact O-N 2.93Å; A134-V137 PolarHBondContact O-N 3.43Å; V135-V137 VanDerWaalsContact C-N 3.34Å; V135-V137 PolarHBondContact O-N 2.96Å; V137-Y140 PolarHBondContact O-N 3.15Å; V137-V141 WeakPolarHBondContact O-CG2 3.32Å; V137-V141 PolarHBondContact O-N 3.25Å
138I96.6Very high93.4Very high27 Ų2762 Ų6214%0.13832%0.319CS..Hα-helixtrans-62.3-50.1175.1-70.9161.8000110.5K54 F55 A134 V135 V136 Y140 V141 W142K54-I138 HydrophobicContact CB-CD1 3.99Å; K54-I138 WeakPolarHBondContact O-CD1 3.41Å; F55-I138 HydrophobicContact CD1-CD1 4.15Å; F55-I138 HydrophobicContact CD1-CG1 3.81Å; F55-I138 HydrophobicContact CE1-CD1 4.48Å; F55-I138 HydrophobicContact CE1-CG1 4.01Å; A134-I138 WeakPolarHBondContact O-CD1 3.39Å; A134-I138 VanDerWaalsContact O-CG1 3.25Å; A134-I138 WeakPolarHBondContact O-CG1 3.5Å; A134-I138 PolarHBondContact O-N 2.99Å; V135-I138 PolarHBondContact O-N 3.31Å; V136-I138 VanDerWaalsContact C-N 3.35Å; V136-I138 PolarHBondContact O-N 3.34Å; I138-Y140 VanDerWaalsContact C-N 3.3Å; I138-Y140 PolarHBondContact O-N 3.16Å; I138-V141 WeakPolarHBondContact O-CB 3.5Å; I138-V141 PolarHBondContact O-N 2.89Å; I138-V141 VanDerWaalsContact O-N 3.07Å; I138-W142 VanDerWaalsContact O-CD1 3.22Å; I138-W142 PolarHBondContact O-N 3.16Å
139V97.2Very high93.9Very high76 Ų7656.4 Ų56.446%0.46130%0.295SS..Hα-helixtrans-57.8-44177.9172.10000111V135 V136 V141 W142 L143V135-V139 HydrophobicContact CG1-CG2 4.43Å; V135-V139 WeakPolarHBondContact O-CG2 3.37Å; V135-V139 PolarHBondContact O-N 3.24Å; V136-V139 PolarHBondContact O-N 2.99Å; V139-V141 PolarHBondContact O-N 3.23Å; V139-W142 PolarHBondContact O-N 3.49Å; V139-L143 HydrophobicContact CG1-CD1 3.89Å; V139-L143 HydrophobicContact CG1-CG 4.36Å; V139-L143 WeakPolarHBondContact O-CG 3.46Å; V139-L143 PolarHBondContact O-N 3.22Å
140Y96.4Very high94.3Very high145 Ų14557.8 Ų57.857%0.56930%0.302SS*.Hα-helixtrans-57.5-45.9173.4173.8-94.6000112.4V136 V137 I138 W142 L143 H144V136-Y140 WeakPolarHBondContact O-CB 3.5Å; V136-Y140 PolarHBondContact O-N 3.25Å; V137-Y140 PolarHBondContact O-N 3.15Å; I138-Y140 VanDerWaalsContact C-N 3.3Å; I138-Y140 PolarHBondContact O-N 3.16Å; Y140-W142 VanDerWaalsContact C-N 3.35Å; Y140-W142 PolarHBondContact O-N 2.96Å; Y140-L143 PolarHBondContact O-N 3Å; Y140-H144 HydrophobicContact CE1-CB 4.47Å; Y140-H144 AromaticContact CZ-CD2 3.81Å; Y140-H144 VanDerWaalsContact O-CB 3.24Å; Y140-H144 WeakPolarHBondContact O-CB 3.29Å; Y140-H144 PolarHBondContact O-N 3.44Å; Y140-H144 PolarHBondContact OH-CD2 3.46Å
141V97.4Very high94.3Very high9 Ų956.1 Ų56.16%0.05529%0.292CS..Hα-helixtrans-59.1-43.6177.5161.90000111.9L106 V137 I138 V139 S145L106-V141 HydrophobicContact CB-CB 4.45Å; L106-V141 HydrophobicContact CB-CG1 3.64Å; L106-V141 HydrophobicContact CB-CG2 4.19Å; V137-V141 WeakPolarHBondContact O-CG2 3.32Å; V137-V141 PolarHBondContact O-N 3.25Å; I138-V141 WeakPolarHBondContact O-CB 3.5Å; I138-V141 PolarHBondContact O-N 2.89Å; I138-V141 VanDerWaalsContact O-N 3.07Å; V139-V141 PolarHBondContact O-N 3.23Å; V141-S145 WeakPolarHBondContact O-CB 3.34Å; V141-S145 PolarHBondContact O-N 3.43Å; V141-S145 PolarHBondContact O-OG 3.19Å
142W97.6Very high94.4Very high63 Ų6355.6 Ų55.624%0.23929%0.285CS..Hα-helixtrans-67.2-42.3177.3-76.695.9000112.3S58 L65 A103 I138 V139 Y140 S145 L146S58-W142 PolarHBondContact OG-NE1 2.88Å; L65-W142 HydrophobicContact CD1-CH2 3.91Å; A103-W142 HydrophobicContact CB-CD2 4.02Å; A103-W142 HydrophobicContact CB-CE3 3.87Å; A103-W142 HydrophobicContact CB-CH2 4.13Å; A103-W142 HydrophobicContact CB-CZ2 4.26Å; A103-W142 HydrophobicContact CB-CZ3 3.93Å; I138-W142 VanDerWaalsContact O-CD1 3.22Å; I138-W142 PolarHBondContact O-N 3.16Å; V139-W142 PolarHBondContact O-N 3.49Å; Y140-W142 VanDerWaalsContact C-N 3.35Å; Y140-W142 PolarHBondContact O-N 2.96Å; W142-S145 WeakPolarHBondContact O-CB 3.49Å; W142-S145 PolarHBondContact O-N 2.98Å; W142-L146 PolarHBondContact O-N 3.47Å
143L96.8Very high94.2Very high101 Ų10154.4 Ų54.453%0.52928%0.278SS..Hα-helixtrans-64.9-41.8175.7-68.8173.1000112.3V139 Y140 S145 L146 V147V139-L143 HydrophobicContact CG1-CD1 3.89Å; V139-L143 HydrophobicContact CG1-CG 4.36Å; V139-L143 WeakPolarHBondContact O-CG 3.46Å; V139-L143 PolarHBondContact O-N 3.22Å; Y140-L143 PolarHBondContact O-N 3Å; L143-S145 VanDerWaalsContact C-N 3.29Å; L143-S145 PolarHBondContact O-N 2.83Å; L143-L146 WeakPolarHBondContact O-CB 3.44Å; L143-L146 PolarHBondContact O-N 3.44Å; L143-V147 WeakPolarHBondContact O-CG2 3.37Å; L143-V147 PolarHBondContact O-N 3.43Å
144H95.8Very high94.2Very high24 Ų2455.9 Ų55.911%0.11129%0.289CS..Hα-helixtrans-62.2-37.8175.9-170-67.6000112L106 Y140 G148 W185L106-H144 HydrophobicContact CD1-CB 4.31Å; L106-H144 WeakPolarHBondContact CD1-ND1 3.32Å; Y140-H144 HydrophobicContact CE1-CB 4.47Å; Y140-H144 AromaticContact CZ-CD2 3.81Å; Y140-H144 VanDerWaalsContact O-CB 3.24Å; Y140-H144 WeakPolarHBondContact O-CB 3.29Å; Y140-H144 PolarHBondContact O-N 3.44Å; Y140-H144 PolarHBondContact OH-CD2 3.46Å; H144-G148 PolarHBondContact O-N 3.33Å; H144-W185 AromaticContact CE1-CD1 3.47Å; H144-W185 VanDerWaalsContact CE1-CD1 3.47Å; H144-W185 AromaticContact CE1-CD2 3.83Å; H144-W185 AromaticContact CE1-CE2 3.44Å; H144-W185 VanDerWaalsContact CE1-CE2 3.44Å; H144-W185 AromaticContact CE1-CG 3.84Å; H144-W185 AromaticContact CE1-NE1 3.19Å; H144-W185 PolarHBondContact CE1-NE1 3.36Å; H144-W185 PolarHBondContact CE1-O 2.96Å; H144-W185 VanDerWaalsContact CE1-O 3.28Å; H144-W185 AromaticContact CG-NE1 3.98Å; H144-W185 AromaticContact ND1-CD1 3.68Å; H144-W185 AromaticContact ND1-CE2 3.94Å; H144-W185 AromaticContact ND1-NE1 3.29Å; H144-W185 PolarHBondContact ND1-NE1 2.95Å; H144-W185 AromaticContact NE2-CE2 3.68Å; H144-W185 AromaticContact NE2-CZ2 3.81Å; H144-W185 AromaticContact NE2-NE1 3.84Å; H144-W185 PolarHBondContact O-NE1 3.39Å; H144-W185 VanDerWaalsContact O-NE1 3.12Å
145S97.1Very high93.9Very high0 Ų059 Ų590%032%0.32CS..Hα-helixtrans-68.2-37.7175.3-56.50000112.1A103 V141 W142 L143 G148 C149A103-S145 WeakPolarHBondContact CA-OG 3.38Å; A103-S145 PolarHBondContact N-OG 3.45Å; V141-S145 WeakPolarHBondContact O-CB 3.34Å; V141-S145 PolarHBondContact O-N 3.43Å; V141-S145 PolarHBondContact O-OG 3.19Å; W142-S145 WeakPolarHBondContact O-CB 3.49Å; W142-S145 PolarHBondContact O-N 2.98Å; L143-S145 VanDerWaalsContact C-N 3.29Å; L143-S145 PolarHBondContact O-N 2.83Å; S145-G148 PolarHBondContact O-N 2.8Å; S145-C149 PolarHBondContact O-N 3.43Å; S145-C149 VanDerWaalsContact O-N 3.17Å
146L95.5Very high93.7Very high69 Ų6961.5 Ų61.536%0.36132%0.323SS..Hα-helixtrans-63.1-45.5174.3-176.165.2000111.4L99 W142 L143 G148 C149 L150L99-L146 HydrophobicContact CD1-CB 4.18Å; L99-L146 HydrophobicContact CD1-CD1 4.46Å; W142-L146 PolarHBondContact O-N 3.47Å; L143-L146 WeakPolarHBondContact O-CB 3.44Å; L143-L146 PolarHBondContact O-N 3.44Å; L146-G148 PolarHBondContact O-N 3.42Å; L146-C149 PolarHBondContact O-N 3.17Å; L146-C149 VanDerWaalsContact O-N 3.08Å; L146-C149 PolarHBondContact O-SG 3.1Å; L146-C149 VanDerWaalsContact O-SG 3.39Å; L146-L150 HydrophobicContact CD1-CD1 4.39Å; L146-L150 HydrophobicContact CD1-CD2 4.3Å; L146-L150 HydrophobicContact CD1-CG 4.09Å; L146-L150 HydrophobicContact CG-CD1 3.99Å; L146-L150 HydrophobicContact CG-CG 4.16Å; L146-L150 VanDerWaalsContact O-CG 3.28Å; L146-L150 WeakPolarHBondContact O-CG 3.39Å; L146-L150 PolarHBondContact O-N 2.91Å
147V94.4Very high93.4Very high73 Ų7357.1 Ų57.144%0.44230%0.297SS..Hα-helixtrans-57.4-34173.5174.10000111.8L143 P151 W185L143-V147 WeakPolarHBondContact O-CG2 3.37Å; L143-V147 PolarHBondContact O-N 3.43Å; V147-P151 VanDerWaalsContact O-CD 3.26Å; V147-P151 WeakPolarHBondContact O-CD 3.45Å; V147-W185 HydrophobicContact CB-CZ2 4.41Å; V147-W185 HydrophobicContact CG1-CZ2 3.76Å
148G91.4Very high93.1Very high0 Ų056.5 Ų56.50%030%0.295CS..Hα-helixtrans-71.3-29.8175.700000115.2H144 S145 L146 Y178H144-G148 PolarHBondContact O-N 3.33Å; S145-G148 PolarHBondContact O-N 2.8Å; L146-G148 PolarHBondContact O-N 3.42Å; G148-Y178 PolarHBondContact O-OH 3.33Å
149C92.6Very high92.8Very high0 Ų056.3 Ų56.30%029%0.293CS..Hα-helixtrans-101.8-12.1-174.678.40000114.9L95 L98 L99 S145 L146 P152L95-C149 HydrophobicContact CG-CB 4.49Å; L98-C149 HydrophobicContact CB-CB 4.01Å; L99-C149 HydrophobicContact CB-CB 4.26Å; S145-C149 PolarHBondContact O-N 3.43Å; S145-C149 VanDerWaalsContact O-N 3.17Å; L146-C149 PolarHBondContact O-N 3.17Å; L146-C149 VanDerWaalsContact O-N 3.08Å; L146-C149 PolarHBondContact O-SG 3.1Å; L146-C149 VanDerWaalsContact O-SG 3.39Å; C149-P152 WeakPolarHBondContact O-CD 3.44Å
150L91.7Very high92.5Very high58 Ų5855 Ų5530%0.30428%0.282SS..SBendtrans-70.5-36.7177.3-79.4176.7000115.7L146 P152 L153 F154L146-L150 HydrophobicContact CD1-CD1 4.39Å; L146-L150 HydrophobicContact CD1-CD2 4.3Å; L146-L150 HydrophobicContact CD1-CG 4.09Å; L146-L150 HydrophobicContact CG-CD1 3.99Å; L146-L150 HydrophobicContact CG-CG 4.16Å; L146-L150 VanDerWaalsContact O-CG 3.28Å; L146-L150 WeakPolarHBondContact O-CG 3.39Å; L146-L150 PolarHBondContact O-N 2.91Å; L150-P152 VanDerWaalsContact C-CD 3.44Å; L150-L153 HydrophobicContact CD2-CD1 4.02Å; L150-L153 WeakPolarHBondContact O-CB 3.47Å; L150-L153 PolarHBondContact O-N 3.41Å; L150-F154 HydrophobicContact CB-CE2 4.17Å
151P90.9Very high92.2Very high16 Ų1650.8 Ų50.810%0.10427%0.266CS..G310 helixtrans-53.1-38-172.6-30.436.8000117V147 L153 F154 W156 Y178 F181V147-P151 VanDerWaalsContact O-CD 3.26Å; V147-P151 WeakPolarHBondContact O-CD 3.45Å; P151-L153 VanDerWaalsContact C-N 3.26Å; P151-L153 PolarHBondContact O-N 3.48Å; P151-F154 PolarHBondContact O-N 3.4Å; P151-F154 VanDerWaalsContact O-N 3.12Å; P151-W156 HydrophobicContact CB-CB 4.31Å; P151-W156 HydrophobicContact CB-CD2 4.39Å; P151-W156 HydrophobicContact CB-CE3 3.75Å; P151-W156 HydrophobicContact CB-CZ3 4.4Å; P151-W156 HydrophobicContact CG-CE3 4.44Å; P151-W156 WeakPolarHBondContact O-CB 3.18Å; P151-W156 PolarHBondContact O-N 2.94Å; P151-Y178 HydrophobicContact CB-CD2 4Å; P151-Y178 HydrophobicContact CB-CE2 3.92Å; P151-Y178 HydrophobicContact CG-CE2 4.26Å; P151-F181 HydrophobicContact CG-CD1 4.44Å; P151-F181 HydrophobicContact CG-CE1 3.85Å
152P89.7Confident91.7Very high9 Ų951.4 Ų51.46%0.05827%0.27CS..G310 helixtrans-60.4-32174.3-25.236.6000113.7C149 L150 F154 G155 F159 Y178C149-P152 WeakPolarHBondContact O-CD 3.44Å; L150-P152 VanDerWaalsContact C-CD 3.44Å; P152-F154 PolarHBondContact O-N 2.87Å; P152-G155 PolarHBondContact O-N 3.46Å; P152-G155 VanDerWaalsContact O-N 3.12Å; P152-F159 HydrophobicContact CB-CE1 3.87Å; P152-F159 HydrophobicContact CB-CE2 3.86Å; P152-F159 HydrophobicContact CB-CZ 3.45Å; P152-F159 VanDerWaalsContact CB-CZ 3.45Å; P152-F159 HydrophobicContact CG-CE1 4.05Å; P152-F159 HydrophobicContact CG-CZ 3.85Å; P152-Y178 HydrophobicContact CG-CD1 4.39Å; P152-Y178 HydrophobicContact CG-CD2 4.35Å; P152-Y178 HydrophobicContact CG-CE1 3.8Å; P152-Y178 HydrophobicContact CG-CE2 3.76Å; P152-Y178 VanDerWaalsContact CG-CZ 3.45Å
153L87.8Confident91.1Very high105 Ų10550.3 Ų50.355%0.5527%0.271SS..G310 helixtrans-66.7-24.6177-63.4-176.4000113.1L95 L150 P151 G155 F159L95-L153 HydrophobicContact CD1-CD1 3.5Å; L95-L153 HydrophobicContact CD1-CD2 3.74Å; L95-L153 HydrophobicContact CD1-CG 3.58Å; L150-L153 HydrophobicContact CD2-CD1 4.02Å; L150-L153 WeakPolarHBondContact O-CB 3.47Å; L150-L153 PolarHBondContact O-N 3.41Å; P151-L153 VanDerWaalsContact C-N 3.26Å; P151-L153 PolarHBondContact O-N 3.48Å; L153-G155 VanDerWaalsContact C-N 3.31Å; L153-F159 HydrophobicContact CD2-CE2 4.28Å
154F90.3Very high90.5Very high169 Ų16947.4 Ų47.474%0.74126%0.256SS*.G310 helixtrans-90.88.6176.5-62.1-68000113L150 P151 P152L150-F154 HydrophobicContact CB-CE2 4.17Å; P151-F154 PolarHBondContact O-N 3.4Å; P151-F154 VanDerWaalsContact O-N 3.12Å; P152-F154 PolarHBondContact O-N 2.87Å
155G87.2Confident90Very high66 Ų6646.6 Ų46.668%0.6825%0.252SS*.THydrogen-bonded Turntrans88.68.8176.800000115.3P152 L153 S157P152-G155 PolarHBondContact O-N 3.46Å; P152-G155 VanDerWaalsContact O-N 3.12Å; L153-G155 VanDerWaalsContact C-N 3.31Å; G155-S157 VanDerWaalsContact C-N 3.27Å; G155-S157 PolarHBondContact O-N 3.24Å
156W89.2Confident89.6Confident121 Ų12147.7 Ų47.746%0.45826%0.256SS..SBendtrans-78.8-9.4175.5-162.9-2.6000112.8P151 S177 F181P151-W156 HydrophobicContact CB-CB 4.31Å; P151-W156 HydrophobicContact CB-CD2 4.39Å; P151-W156 HydrophobicContact CB-CE3 3.75Å; P151-W156 HydrophobicContact CB-CZ3 4.4Å; P151-W156 HydrophobicContact CG-CE3 4.44Å; P151-W156 WeakPolarHBondContact O-CB 3.18Å; P151-W156 PolarHBondContact O-N 2.94Å; W156-S177 PolarHBondContact NE1-OG 2.94Å; W156-F181 HydrophobicContact CH2-CD2 4.48Å; W156-F181 HydrophobicContact CH2-CG 4.42Å
157S89.9Confident89.4Confident10 Ų1044.5 Ų44.57%0.0724%0.24CC..SBendtrans-160.6154.1170.1-163.40000111.1G155G155-S157 VanDerWaalsContact C-N 3.27Å; G155-S157 PolarHBondContact O-N 3.24Å
158S89.6Confident89.3Confident46 Ų4641 Ų4132%0.32222%0.219SC..  trans-92.9149.4171.550.90000111.8E160 A170 A171S158-E160 PolarHBondContact OG-OE1 3.11Å; S158-A170 CarbonylContact O-C 3.49Å; S158-A170 WeakPolarHBondContact O-CA 3.33Å; S158-A171 PolarHBondContact O-N 3.44Å; S158-A171 VanDerWaalsContact OG-CB 3.25Å; S158-A171 WeakPolarHBondContact OG-CB 3.3Å
159F91.4Very high89.3Confident22 Ų2241.5 Ų41.510%0.09622%0.221CC..EExtended strand (participates in β ladder)trans-96.7129.7165.1-64.2-54.5000109.9N91 A94 L95 L98 P152 L153 V169 A170N91-F159 HydrophobicContact CB-CB 4.4Å; N91-F159 HydrophobicContact CB-CD2 3.84Å; A94-F159 HydrophobicContact CB-CB 4.12Å; A94-F159 HydrophobicContact CB-CD1 3.44Å; A94-F159 VanDerWaalsContact CB-CD1 3.44Å; A94-F159 HydrophobicContact CB-CD2 4.5Å; A94-F159 HydrophobicContact CB-CE1 3.9Å; A94-F159 HydrophobicContact CB-CG 3.78Å; L95-F159 HydrophobicContact CB-CE2 4.23Å; L95-F159 HydrophobicContact CB-CZ 4.05Å; L98-F159 HydrophobicContact CD1-CE1 3.68Å; L98-F159 HydrophobicContact CD1-CZ 4.28Å; P152-F159 HydrophobicContact CB-CE1 3.87Å; P152-F159 HydrophobicContact CB-CE2 3.86Å; P152-F159 HydrophobicContact CB-CZ 3.45Å; P152-F159 VanDerWaalsContact CB-CZ 3.45Å; P152-F159 HydrophobicContact CG-CE1 4.05Å; P152-F159 HydrophobicContact CG-CZ 3.85Å; L153-F159 HydrophobicContact CD2-CE2 4.28Å; F159-V169 WeakPolarHBondContact CA-O 3.36Å; F159-A170 HydrophobicContact CD1-CB 4.27Å; F159-A170 HydrophobicContact CE1-CB 4.25Å
160E90.6Very high89.2Confident50 Ų5041.5 Ų41.523%0.23422%0.222CC..EExtended strand (participates in β ladder)trans-135.5149.4-176.2-76.3171.8-123.400110.7S158 C168 V169 R174S158-E160 PolarHBondContact OG-OE1 3.11Å; E160-C168 WeakPolarHBondContact O-CA 3.31Å; E160-V169 PolarHBondContact N-O 3.45Å; E160-V169 PolarHBondContact O-N 2.7Å; E160-R174 IonicContact OE1-CZ 3.09Å; E160-R174 IonicContact OE1-NE 2.83Å; E160-R174 IonicContact OE1-NH1 2.95Å; E160-R174 PolarHBondContact OE1-NH1 3.34Å; E160-R174 IonicContact OE1-NH2 2.78Å; E160-R174 IonicContact OE2-CZ 3.56Å; E160-R174 IonicContact OE2-NH1 3.86Å; E160-R174 PolarHBondContact OE2-NH1 3.3Å; E160-R174 IonicContact OE2-NH2 3.35Å; E160-R174 PolarHBondContact OE2-NH2 2.99Å
161F89.9Confident89Confident55 Ų5539 Ų3924%0.24121%0.21CC..EExtended strand (participates in β ladder)trans-77.8123.8174.1175.9-115.9000110.1S77 W83S77-F161 VanDerWaalsContact OG-CE2 3.24Å; S77-F161 WeakPolarHBondContact OG-CE2 3.43Å; S77-F161 WeakPolarHBondContact OG-CZ 3.33Å; W83-F161 HydrophobicContact CB-CB 4.4Å; W83-F161 HydrophobicContact CB-CD1 4.24Å; W83-F161 HydrophobicContact CB-CD2 3.73Å; W83-F161 HydrophobicContact CB-CE1 4.46Å; W83-F161 HydrophobicContact CB-CE2 3.99Å; W83-F161 HydrophobicContact CB-CG 3.85Å; W83-F161 HydrophobicContact CB-CZ 4.35Å; W83-F161 HydrophobicContact CD2-CD2 4.5Å; W83-F161 HydrophobicContact CE3-CD2 4.23Å; W83-F161 HydrophobicContact CE3-CE2 4.26Å; W83-F161 HydrophobicContact CG-CD2 4.34Å
162D86.9Confident88.8Confident23 Ų2338.4 Ų38.412%0.12321%0.205CC..EExtended strand (participates in β ladder)trans-98.5116.5178.3-172.6-47.9000110.3L164 K165 R166 T167 V169D162-L164 VanDerWaalsContact C-N 3.26Å; D162-L164 PolarHBondContact O-N 2.89Å; D162-L164 WeakPolarHBondContact OD1-CA 3.25Å; D162-L164 WeakPolarHBondContact OD1-CB 3.27Å; D162-L164 PolarHBondContact OD1-N 2.9Å; D162-K165 HydrophobicContact CB-CB 4.03Å; D162-K165 HydrophobicContact CB-CD 4.41Å; D162-K165 HydrophobicContact CB-CG 4.35Å; D162-K165 PolarHBondContact OD1-N 3.36Å; D162-K165 VanDerWaalsContact OD2-CD 3.27Å; D162-K165 WeakPolarHBondContact OD2-CD 3.42Å; D162-K165 WeakPolarHBondContact OD2-CE 3.38Å; D162-K165 IonicContact OD2-NZ 2.69Å; D162-K165 PolarHBondContact OD2-NZ 2.9Å; D162-R166 WeakPolarHBondContact O-CA 3.22Å; D162-R166 PolarHBondContact O-N 3.4Å; D162-T167 PolarHBondContact N-O 3.35Å; D162-V169 HydrophobicContact CB-CG2 3.87Å
163C83.8Confident88.5Confident39 Ų3939.2 Ų39.226%0.26421%0.211SC..THydrogen-bonded Turntrans-61.6-30.1-179-79.90000114C7 R166C7-C163 HydrophobicContact CB-CB 3.73Å; C7-C163 WeakPolarHBondContact CB-SG 3.41Å; C7-C163 VanDerWaalsContact SG-CA 3.53Å; C7-C163 WeakPolarHBondContact SG-CB 3.4Å; C7-C163 CovalentContact SG-SG 2.04Å; C7-C163 PolarHBondContact SG-SG 2.92Å; C163-R166 WeakPolarHBondContact O-CD 3.42Å; C163-R166 PolarHBondContact O-NH1 2.9Å; C163-R166 VanDerWaalsContact O-NH1 3.08Å
164L84.4Confident88.3Confident41 Ų4140.3 Ų40.322%0.21521%0.208CC..THydrogen-bonded Turntrans-88.3-46-175-60.7172.3000109.9D162 R166 Q292 E295 T296D162-L164 VanDerWaalsContact C-N 3.26Å; D162-L164 PolarHBondContact O-N 2.89Å; D162-L164 WeakPolarHBondContact OD1-CA 3.25Å; D162-L164 WeakPolarHBondContact OD1-CB 3.27Å; D162-L164 PolarHBondContact OD1-N 2.9Å; L164-R166 PolarHBondContact O-N 3.43Å; L164-Q292 HydrophobicContact CD1-CB 4.25Å; L164-Q292 HydrophobicContact CD1-CG 4Å; L164-Q292 HydrophobicContact CD2-CB 3.71Å; L164-Q292 HydrophobicContact CD2-CG 3.85Å; L164-E295 HydrophobicContact CB-CB 4.18Å; L164-E295 HydrophobicContact CD1-CB 4.19Å; L164-E295 HydrophobicContact CD1-CG 4.34Å; L164-E295 WeakPolarHBondContact CD1-OE2 3.41Å; L164-T296 PolarHBondContact O-OG1 3.03Å
165K86Confident88.1Confident7 Ų736.1 Ų36.13%0.0319%0.191CC..THydrogen-bonded Turntrans-77-6.5178.7-52.3177.2-175.472.40112.6D162 T167 V169 E282 E295 A299D162-K165 HydrophobicContact CB-CB 4.03Å; D162-K165 HydrophobicContact CB-CD 4.41Å; D162-K165 HydrophobicContact CB-CG 4.35Å; D162-K165 PolarHBondContact OD1-N 3.36Å; D162-K165 VanDerWaalsContact OD2-CD 3.27Å; D162-K165 WeakPolarHBondContact OD2-CD 3.42Å; D162-K165 WeakPolarHBondContact OD2-CE 3.38Å; D162-K165 IonicContact OD2-NZ 2.69Å; D162-K165 PolarHBondContact OD2-NZ 2.9Å; K165-T167 HydrophobicContact CB-CG2 4.12Å; K165-T167 WeakPolarHBondContact O-CG2 2.98Å; K165-T167 PolarHBondContact O-N 3.04Å; K165-T167 VanDerWaalsContact O-N 3.09Å; K165-V169 HydrophobicContact CD-CG1 4.32Å; K165-E282 WeakPolarHBondContact CE-OE1 3.16Å; K165-E282 IonicContact NZ-OE1 2.67Å; K165-E282 PolarHBondContact NZ-OE1 3.47Å; K165-E282 IonicContact NZ-OE2 2.7Å; K165-E295 IonicContact NZ-OE2 3.99Å; K165-E295 PolarHBondContact NZ-OE2 2.9Å; K165-A299 HydrophobicContact CB-CB 4.06Å; K165-A299 HydrophobicContact CG-CB 4.17Å
166R88.6Confident88.1Confident22 Ų2235.7 Ų35.78%0.08318%0.175CC..THydrogen-bonded Turntrans5324.3-179.9-57.3-64.3-171.2-162.4-0.9114.3E20 S77 D162 C163 L164E20-R166 IonicContact OE2-CZ 3.9Å; E20-R166 IonicContact OE2-NE 2.72Å; E20-R166 PolarHBondContact OE2-NE 3.36Å; E20-R166 IonicContact OE2-NH2 3.47Å; E20-R166 PolarHBondContact OE2-NH2 3.41Å; S77-R166 PolarHBondContact OG-O 3.03Å; D162-R166 WeakPolarHBondContact O-CA 3.22Å; D162-R166 PolarHBondContact O-N 3.4Å; C163-R166 WeakPolarHBondContact O-CD 3.42Å; C163-R166 PolarHBondContact O-NH1 2.9Å; C163-R166 VanDerWaalsContact O-NH1 3.08Å; L164-R166 PolarHBondContact O-N 3.43Å
167T91.1Very high88.2Confident3 Ų332.5 Ų32.52%0.01817%0.172CC..EExtended strand (participates in β ladder)trans-147165.8-173-168.50000110.6V74 D162 K165 V169 F303V74-T167 WeakPolarHBondContact CG2-OG1 3.37Å; D162-T167 PolarHBondContact N-O 3.35Å; K165-T167 HydrophobicContact CB-CG2 4.12Å; K165-T167 WeakPolarHBondContact O-CG2 2.98Å; K165-T167 PolarHBondContact O-N 3.04Å; K165-T167 VanDerWaalsContact O-N 3.09Å; T167-V169 HydrophobicContact CG2-CG1 3.8Å; T167-F303 HydrophobicContact CG2-CZ 4.38Å
168C92.5Very high88.3Confident0 Ų032 Ų320%017%0.169CC..EExtended strand (participates in β ladder)trans-84.3131.7172.1-62.30000110.5C90 A94 E160C90-C168 WeakPolarHBondContact CA-SG 3.4Å; C90-C168 HydrophobicContact CB-CB 4.04Å; C90-C168 WeakPolarHBondContact CB-SG 3.37Å; C90-C168 WeakPolarHBondContact O-CB 3.3Å; C90-C168 WeakPolarHBondContact SG-CB 3.33Å; C90-C168 CovalentContact SG-SG 2.03Å; C90-C168 PolarHBondContact SG-SG 2.86Å; A94-C168 WeakPolarHBondContact CA-O 3.47Å; A94-C168 HydrophobicContact CB-CB 3.94Å; A94-C168 WeakPolarHBondContact CB-O 3.36Å; E160-C168 WeakPolarHBondContact O-CA 3.31Å
169V91.5Very high88.4Confident9 Ų930 Ų306%0.05515%0.154CC..EExtended strand (participates in β ladder)trans-134.8167.5-177.5-61.50000110.6F159 E160 D162 K165 T167F159-V169 WeakPolarHBondContact CA-O 3.36Å; E160-V169 PolarHBondContact N-O 3.45Å; E160-V169 PolarHBondContact O-N 2.7Å; D162-V169 HydrophobicContact CB-CG2 3.87Å; K165-V169 HydrophobicContact CD-CG1 4.32Å; T167-V169 HydrophobicContact CG2-CG1 3.8Å
170A90.6Very high88.5Confident1 Ų131.6 Ų31.61%0.00817%0.172CC..EExtended strand (participates in β ladder)trans-72.4149167.700000110.7L98 S158 F159 W172 Y178L98-A170 HydrophobicContact CD1-CB 4.38Å; S158-A170 CarbonylContact O-C 3.49Å; S158-A170 WeakPolarHBondContact O-CA 3.33Å; F159-A170 HydrophobicContact CD1-CB 4.27Å; F159-A170 HydrophobicContact CE1-CB 4.25Å; A170-W172 VanDerWaalsContact C-N 3.27Å; A170-W172 HydrophobicContact CB-CD2 4.32Å; A170-W172 HydrophobicContact CB-CE3 4.23Å; A170-W172 HydrophobicContact CB-CH2 4.22Å; A170-W172 HydrophobicContact CB-CZ2 4.25Å; A170-W172 HydrophobicContact CB-CZ3 4.19Å; A170-W172 VanDerWaalsContact O-CD1 3.31Å; A170-W172 PolarHBondContact O-N 2.92Å; A170-W172 PolarHBondContact O-NE1 2.95Å; A170-Y178 HydrophobicContact CB-CD1 4.18Å; A170-Y178 HydrophobicContact CB-CE1 3.7Å
171A87.4Confident88.6Confident6 Ų631.6 Ų31.65%0.0517%0.171CC..  trans-77.672-179.700000112.2S158 S173 R174 E175S158-A171 PolarHBondContact O-N 3.44Å; S158-A171 VanDerWaalsContact OG-CB 3.25Å; S158-A171 WeakPolarHBondContact OG-CB 3.3Å; A171-S173 PolarHBondContact O-N 3.22Å; A171-S173 VanDerWaalsContact O-N 3.1Å; A171-R174 HydrophobicContact CB-CB 4.09Å; A171-R174 HydrophobicContact CB-CG 4.35Å; A171-R174 PolarHBondContact O-N 3.5Å; A171-E175 PolarHBondContact O-N 3.32Å
172W86.2Confident88.8Confident2 Ų229 Ų291%0.00816%0.16CC..THydrogen-bonded Turntrans-51.6-35.6-173.2-53.2119.9000114.9L98 A170 P176 Y178 A179 W182 V279 E282L98-W172 HydrophobicContact CD2-CH2 3.66Å; L98-W172 HydrophobicContact CD2-CZ2 4.01Å; A170-W172 VanDerWaalsContact C-N 3.27Å; A170-W172 HydrophobicContact CB-CD2 4.32Å; A170-W172 HydrophobicContact CB-CE3 4.23Å; A170-W172 HydrophobicContact CB-CH2 4.22Å; A170-W172 HydrophobicContact CB-CZ2 4.25Å; A170-W172 HydrophobicContact CB-CZ3 4.19Å; A170-W172 VanDerWaalsContact O-CD1 3.31Å; A170-W172 PolarHBondContact O-N 2.92Å; A170-W172 PolarHBondContact O-NE1 2.95Å; W172-P176 WeakPolarHBondContact O-CA 3.23Å; W172-Y178 HydrophobicContact CE3-CD1 4.43Å; W172-Y178 HydrophobicContact CE3-CE1 4.43Å; W172-Y178 HydrophobicContact CH2-CE1 4.39Å; W172-Y178 HydrophobicContact CZ3-CD1 4.14Å; W172-Y178 AromaticContact CZ3-CE1 3.76Å; W172-Y178 HydrophobicContact CZ3-CE1 3.76Å; W172-A179 HydrophobicContact CB-CB 4.33Å; W172-A179 HydrophobicContact CE3-CB 3.78Å; W172-W182 AromaticContact CH2-CD2 3.89Å; W172-W182 HydrophobicContact CH2-CD2 3.89Å; W172-W182 AromaticContact CH2-CE3 3.77Å; W172-W182 HydrophobicContact CH2-CE3 3.77Å; W172-W182 HydrophobicContact CH2-CG 4.26Å; W172-W182 HydrophobicContact CH2-CZ3 4.24Å; W172-W182 HydrophobicContact CZ3-CB 4.22Å; W172-W182 HydrophobicContact CZ3-CD2 4.26Å; W172-W182 HydrophobicContact CZ3-CE3 4.1Å; W172-W182 HydrophobicContact CZ3-CG 4.32Å; W172-V279 HydrophobicContact CB-CG1 4.31Å; W172-V279 HydrophobicContact CD2-CG1 3.68Å; W172-V279 HydrophobicContact CD2-CG2 4.21Å; W172-V279 HydrophobicContact CE3-CG1 3.81Å; W172-V279 HydrophobicContact CG-CG1 3.92Å; W172-V279 HydrophobicContact CG-CG2 4.26Å; W172-V279 HydrophobicContact CZ2-CG2 4.34Å; W172-V279 HydrophobicContact CZ3-CG1 4.3Å; W172-E282 HydrophobicContact CB-CB 4.41Å
173S83.3Confident89.1Confident26 Ų2628.5 Ų28.518%0.18216%0.158CC..THydrogen-bonded Turntrans-85.4-22.9-178.761.60000114.8A171 E282 Q287A171-S173 PolarHBondContact O-N 3.22Å; A171-S173 VanDerWaalsContact O-N 3.1Å; S173-E282 WeakPolarHBondContact CA-O 3.43Å; S173-E282 WeakPolarHBondContact CB-O 3.35Å; S173-Q287 WeakPolarHBondContact OG-CG 3.37Å
174R83.3Confident89.6Confident129 Ų12930.7 Ų30.749%0.48717%0.17SC..THydrogen-bonded Turntrans-82.3-42.2178-72-168-178.8149.522.8110.7E160 A171 P176E160-R174 IonicContact OE1-CZ 3.09Å; E160-R174 IonicContact OE1-NE 2.83Å; E160-R174 IonicContact OE1-NH1 2.95Å; E160-R174 PolarHBondContact OE1-NH1 3.34Å; E160-R174 IonicContact OE1-NH2 2.78Å; E160-R174 IonicContact OE2-CZ 3.56Å; E160-R174 IonicContact OE2-NH1 3.86Å; E160-R174 PolarHBondContact OE2-NH1 3.3Å; E160-R174 IonicContact OE2-NH2 3.35Å; E160-R174 PolarHBondContact OE2-NH2 2.99Å; A171-R174 HydrophobicContact CB-CB 4.09Å; A171-R174 HydrophobicContact CB-CG 4.35Å; A171-R174 PolarHBondContact O-N 3.5Å; R174-P176 VanDerWaalsContact C-CD 3.4Å; R174-P176 VanDerWaalsContact O-CD 3.26Å; R174-P176 WeakPolarHBondContact O-CD 3.37Å
175E86.4Confident90.1Very high81 Ų8133.1 Ų33.138%0.37918%0.176SC..  trans-119.172.1178.8-65.6-59.3157.600110.4A171 S177 Y178 A179A171-E175 PolarHBondContact O-N 3.32Å; E175-S177 PolarHBondContact O-N 2.94Å; E175-S177 VanDerWaalsContact O-N 3.13Å; E175-Y178 PolarHBondContact O-N 3.33Å; E175-A179 PolarHBondContact O-N 3.48Å
176P87.9Confident90.4Very high56 Ų5632.8 Ų32.836%0.36418%0.175SC..Hα-helixtrans-64.1-19.2-179.328.4-36.5000112.5W172 R174 A179 A180 A283W172-P176 WeakPolarHBondContact O-CA 3.23Å; R174-P176 VanDerWaalsContact C-CD 3.4Å; R174-P176 VanDerWaalsContact O-CD 3.26Å; R174-P176 WeakPolarHBondContact O-CD 3.37Å; P176-A179 PolarHBondContact O-N 3.5Å; P176-A180 WeakPolarHBondContact O-CB 3.46Å; P176-A180 PolarHBondContact O-N 3.05Å; P176-A283 HydrophobicContact CB-CB 3.91Å; P176-A283 VanDerWaalsContact CB-O 3.26Å; P176-A283 WeakPolarHBondContact CB-O 3.4Å
177S91.4Very high90.4Very high55 Ų5532.1 Ų32.139%0.38517%0.173SC..Hα-helixtrans-60.9-44.2170.768.50000111.9W156 E175 F181W156-S177 PolarHBondContact NE1-OG 2.94Å; E175-S177 PolarHBondContact O-N 2.94Å; E175-S177 VanDerWaalsContact O-N 3.13Å; S177-F181 WeakPolarHBondContact O-CB 3.36Å; S177-F181 PolarHBondContact O-N 3.29Å
178Y90.9Very high90.5Very high0 Ų034.9 Ų34.90%019%0.187CC..Hα-helixtrans-70.4-38.6175.1174.5-105.6000111.9G148 P151 P152 A170 W172 E175 A180 F181 W182G148-Y178 PolarHBondContact O-OH 3.33Å; P151-Y178 HydrophobicContact CB-CD2 4Å; P151-Y178 HydrophobicContact CB-CE2 3.92Å; P151-Y178 HydrophobicContact CG-CE2 4.26Å; P152-Y178 HydrophobicContact CG-CD1 4.39Å; P152-Y178 HydrophobicContact CG-CD2 4.35Å; P152-Y178 HydrophobicContact CG-CE1 3.8Å; P152-Y178 HydrophobicContact CG-CE2 3.76Å; P152-Y178 VanDerWaalsContact CG-CZ 3.45Å; A170-Y178 HydrophobicContact CB-CD1 4.18Å; A170-Y178 HydrophobicContact CB-CE1 3.7Å; W172-Y178 HydrophobicContact CE3-CD1 4.43Å; W172-Y178 HydrophobicContact CE3-CE1 4.43Å; W172-Y178 HydrophobicContact CH2-CE1 4.39Å; W172-Y178 HydrophobicContact CZ3-CD1 4.14Å; W172-Y178 AromaticContact CZ3-CE1 3.76Å; W172-Y178 HydrophobicContact CZ3-CE1 3.76Å; E175-Y178 PolarHBondContact O-N 3.33Å; Y178-A180 PolarHBondContact O-N 2.95Å; Y178-F181 HydrophobicContact CD2-CD1 4.16Å; Y178-F181 HydrophobicContact CE2-CD1 4.16Å; Y178-F181 PolarHBondContact O-N 2.97Å; Y178-W182 HydrophobicContact CE1-CB 4.48Å; Y178-W182 HydrophobicContact CE2-CB 4.42Å; Y178-W182 WeakPolarHBondContact O-CB 3.24Å; Y178-W182 PolarHBondContact O-N 2.99Å
179A91.9Very high90.5Very high2 Ų236.9 Ų36.92%0.01720%0.2CC..Hα-helixtrans-58.6-48.9174.800000111.5W172 E175 P176 F181 W182 V183 V279 A283W172-A179 HydrophobicContact CB-CB 4.33Å; W172-A179 HydrophobicContact CE3-CB 3.78Å; E175-A179 PolarHBondContact O-N 3.48Å; P176-A179 PolarHBondContact O-N 3.5Å; A179-F181 PolarHBondContact O-N 2.89Å; A179-W182 PolarHBondContact O-N 2.99Å; A179-V183 WeakPolarHBondContact O-CG2 3.36Å; A179-V183 PolarHBondContact O-N 3.49Å; A179-V279 HydrophobicContact CB-CG1 4.41Å; A179-A283 HydrophobicContact CB-CB 3.75Å
180A93Very high90.6Very high57 Ų5736.5 Ų36.547%0.47120%0.198SC..Hα-helixtrans-62.3-41.3176.500000112.2P176 Y178 T184P176-A180 WeakPolarHBondContact O-CB 3.46Å; P176-A180 PolarHBondContact O-N 3.05Å; Y178-A180 PolarHBondContact O-N 2.95Å; A180-T184 WeakPolarHBondContact O-CB 3.48Å; A180-T184 PolarHBondContact O-N 2.95Å; A180-T184 PolarHBondContact O-OG1 2.96Å
181F93.8Very high90.7Very high50 Ų5039.8 Ų39.822%0.21921%0.212CC..Hα-helixtrans-59.7-53.5173.5169.3-98.6000111.5P151 W156 S177 Y178 A179 V183 T184 W185P151-F181 HydrophobicContact CG-CD1 4.44Å; P151-F181 HydrophobicContact CG-CE1 3.85Å; W156-F181 HydrophobicContact CH2-CD2 4.48Å; W156-F181 HydrophobicContact CH2-CG 4.42Å; S177-F181 WeakPolarHBondContact O-CB 3.36Å; S177-F181 PolarHBondContact O-N 3.29Å; Y178-F181 HydrophobicContact CD2-CD1 4.16Å; Y178-F181 HydrophobicContact CE2-CD1 4.16Å; Y178-F181 PolarHBondContact O-N 2.97Å; A179-F181 PolarHBondContact O-N 2.89Å; F181-V183 PolarHBondContact O-N 3.3Å; F181-T184 PolarHBondContact O-N 3.41Å; F181-T184 VanDerWaalsContact O-N 3.17Å; F181-W185 HydrophobicContact CE1-CB 4.44Å; F181-W185 HydrophobicContact CE2-CB 4.24Å; F181-W185 HydrophobicContact CE2-CD2 4.15Å; F181-W185 HydrophobicContact CE2-CE3 4.12Å; F181-W185 HydrophobicContact CE2-CG 4.23Å; F181-W185 HydrophobicContact CZ-CB 4.14Å; F181-W185 HydrophobicContact CZ-CD2 4.1Å; F181-W185 AromaticContact CZ-CG 3.93Å; F181-W185 HydrophobicContact CZ-CG 3.93Å; F181-W185 WeakPolarHBondContact O-CB 3.44Å; F181-W185 PolarHBondContact O-N 3.4Å
182W93.4Very high91Very high0 Ų045.2 Ų45.20%024%0.235CC..Hα-helixtrans-63.5-40.9-176.5-178.484000112.4L98 S102 M105 W172 Y178 A179 W185 C186 I187L98-W182 HydrophobicContact CD2-CD2 4.43Å; L98-W182 HydrophobicContact CD2-CZ2 4.1Å; S102-W182 PolarHBondContact OG-NE1 3.39Å; M105-W182 HydrophobicContact CE-CH2 4.12Å; M105-W182 HydrophobicContact CE-CZ2 4.02Å; W172-W182 AromaticContact CH2-CD2 3.89Å; W172-W182 HydrophobicContact CH2-CD2 3.89Å; W172-W182 AromaticContact CH2-CE3 3.77Å; W172-W182 HydrophobicContact CH2-CE3 3.77Å; W172-W182 HydrophobicContact CH2-CG 4.26Å; W172-W182 HydrophobicContact CH2-CZ3 4.24Å; W172-W182 HydrophobicContact CZ3-CB 4.22Å; W172-W182 HydrophobicContact CZ3-CD2 4.26Å; W172-W182 HydrophobicContact CZ3-CE3 4.1Å; W172-W182 HydrophobicContact CZ3-CG 4.32Å; Y178-W182 HydrophobicContact CE1-CB 4.48Å; Y178-W182 HydrophobicContact CE2-CB 4.42Å; Y178-W182 WeakPolarHBondContact O-CB 3.24Å; Y178-W182 PolarHBondContact O-N 2.99Å; A179-W182 PolarHBondContact O-N 2.99Å; W182-W185 PolarHBondContact O-N 3Å; W182-C186 HydrophobicContact CD2-CB 4.5Å; W182-C186 HydrophobicContact CZ2-CB 4.48Å; W182-C186 WeakPolarHBondContact O-CB 3.47Å; W182-C186 PolarHBondContact O-N 3.15Å; W182-I187 HydrophobicContact CE3-CG1 4.28Å; W182-I187 HydrophobicContact CH2-CD1 3.71Å; W182-I187 HydrophobicContact CH2-CG1 4.12Å; W182-I187 HydrophobicContact CZ2-CD1 4.36Å; W182-I187 HydrophobicContact CZ3-CD1 3.92Å; W182-I187 HydrophobicContact CZ3-CG1 3.82Å
183V93.3Very high91.3Very high13 Ų1347.9 Ų47.98%0.07925%0.249CC..Iπ-helixtrans-62.8-45.8173.5172.50000110.7A179 F181 W185 I187 L188 V276 V279A179-V183 WeakPolarHBondContact O-CG2 3.36Å; A179-V183 PolarHBondContact O-N 3.49Å; F181-V183 PolarHBondContact O-N 3.3Å; V183-W185 VanDerWaalsContact C-N 3.33Å; V183-W185 PolarHBondContact O-N 3.3Å; V183-I187 HydrophobicContact CG1-CB 4.3Å; V183-I187 WeakPolarHBondContact O-CA 3.4Å; V183-I187 VanDerWaalsContact O-CB 3.28Å; V183-I187 WeakPolarHBondContact O-CB 3.31Å; V183-I187 PolarHBondContact O-N 3.37Å; V183-L188 HydrophobicContact CG1-CG 4.48Å; V183-L188 PolarHBondContact O-N 3.49Å; V183-V276 HydrophobicContact CG1-CG1 4.05Å; V183-V276 HydrophobicContact CG2-CG1 4.37Å; V183-V279 HydrophobicContact CG2-CG1 4.32Å
184T94.1Very high91.7Very high84 Ų8446.9 Ų46.952%0.51524%0.241SC..Iπ-helixtrans-67.1-33.5-179.6-56.70000112.7A180 F181 L188 P189A180-T184 WeakPolarHBondContact O-CB 3.48Å; A180-T184 PolarHBondContact O-N 2.95Å; A180-T184 PolarHBondContact O-OG1 2.96Å; F181-T184 PolarHBondContact O-N 3.41Å; F181-T184 VanDerWaalsContact O-N 3.17Å; T184-L188 HydrophobicContact CG2-CD1 4.36Å; T184-P189 VanDerWaalsContact O-CD 3.31Å; T184-P189 WeakPolarHBondContact O-CD 3.48Å
185W95Very high92.1Very high92 Ų9245.8 Ų45.835%0.34824%0.244SC..Iπ-helixtrans-86.2-47.1-176.9-165.1-102.2000112.5H144 V147 F181 W182 V183 P189H144-W185 AromaticContact CE1-CD1 3.47Å; H144-W185 VanDerWaalsContact CE1-CD1 3.47Å; H144-W185 AromaticContact CE1-CD2 3.83Å; H144-W185 AromaticContact CE1-CE2 3.44Å; H144-W185 VanDerWaalsContact CE1-CE2 3.44Å; H144-W185 AromaticContact CE1-CG 3.84Å; H144-W185 AromaticContact CE1-NE1 3.19Å; H144-W185 PolarHBondContact CE1-NE1 3.36Å; H144-W185 PolarHBondContact CE1-O 2.96Å; H144-W185 VanDerWaalsContact CE1-O 3.28Å; H144-W185 AromaticContact CG-NE1 3.98Å; H144-W185 AromaticContact ND1-CD1 3.68Å; H144-W185 AromaticContact ND1-CE2 3.94Å; H144-W185 AromaticContact ND1-NE1 3.29Å; H144-W185 PolarHBondContact ND1-NE1 2.95Å; H144-W185 AromaticContact NE2-CE2 3.68Å; H144-W185 AromaticContact NE2-CZ2 3.81Å; H144-W185 AromaticContact NE2-NE1 3.84Å; H144-W185 PolarHBondContact O-NE1 3.39Å; H144-W185 VanDerWaalsContact O-NE1 3.12Å; V147-W185 HydrophobicContact CB-CZ2 4.41Å; V147-W185 HydrophobicContact CG1-CZ2 3.76Å; F181-W185 HydrophobicContact CE1-CB 4.44Å; F181-W185 HydrophobicContact CE2-CB 4.24Å; F181-W185 HydrophobicContact CE2-CD2 4.15Å; F181-W185 HydrophobicContact CE2-CE3 4.12Å; F181-W185 HydrophobicContact CE2-CG 4.23Å; F181-W185 HydrophobicContact CZ-CB 4.14Å; F181-W185 HydrophobicContact CZ-CD2 4.1Å; F181-W185 AromaticContact CZ-CG 3.93Å; F181-W185 HydrophobicContact CZ-CG 3.93Å; F181-W185 WeakPolarHBondContact O-CB 3.44Å; F181-W185 PolarHBondContact O-N 3.4Å; W182-W185 PolarHBondContact O-N 3Å; V183-W185 VanDerWaalsContact C-N 3.33Å; V183-W185 PolarHBondContact O-N 3.3Å; W185-P189 WeakPolarHBondContact O-CD 3.3Å; W185-P189 WeakPolarHBondContact O-CG 3.28Å
186C92.1Very high92.4Very high0 Ų044.9 Ų44.90%025%0.251CS..Iπ-helixtrans-99.5-26.7-171.4-66.20000114.5S102 W182 P190S102-C186 PolarHBondContact OG-SG 3.11Å; W182-C186 HydrophobicContact CD2-CB 4.5Å; W182-C186 HydrophobicContact CZ2-CB 4.48Å; W182-C186 WeakPolarHBondContact O-CB 3.47Å; W182-C186 PolarHBondContact O-N 3.15Å; C186-P190 WeakPolarHBondContact O-CD 3.44Å; C186-P190 WeakPolarHBondContact O-CG 3.25Å
187I90.2Very high92.5Very high9 Ų943 Ų435%0.04624%0.238CC..Iπ-helixtrans-101.9-49.9-173.4-54.7-62.5000112.4M105 W182 V183 P190 F191 V276M105-I187 HydrophobicContact CE-CD1 3.38Å; M105-I187 HydrophobicContact SD-CD1 3.36Å; M105-I187 WeakPolarHBondContact SD-CD1 3.45Å; W182-I187 HydrophobicContact CE3-CG1 4.28Å; W182-I187 HydrophobicContact CH2-CD1 3.71Å; W182-I187 HydrophobicContact CH2-CG1 4.12Å; W182-I187 HydrophobicContact CZ2-CD1 4.36Å; W182-I187 HydrophobicContact CZ3-CD1 3.92Å; W182-I187 HydrophobicContact CZ3-CG1 3.82Å; V183-I187 HydrophobicContact CG1-CB 4.3Å; V183-I187 WeakPolarHBondContact O-CA 3.4Å; V183-I187 VanDerWaalsContact O-CB 3.28Å; V183-I187 WeakPolarHBondContact O-CB 3.31Å; V183-I187 PolarHBondContact O-N 3.37Å; I187-P190 VanDerWaalsContact O-CD 3.23Å; I187-P190 WeakPolarHBondContact O-CD 3.44Å; I187-P190 WeakPolarHBondContact O-CG 3.46Å; I187-F191 VanDerWaalsContact O-CB 3.3Å; I187-F191 WeakPolarHBondContact O-CB 3.48Å; I187-F191 PolarHBondContact O-N 3.42Å; I187-F191 VanDerWaalsContact O-N 3.1Å; I187-V276 HydrophobicContact CB-CG2 4.4Å; I187-V276 HydrophobicContact CD1-CG2 3.89Å; I187-V276 HydrophobicContact CG1-CG2 3.89Å; I187-V276 HydrophobicContact CG2-CG1 4.14Å; I187-V276 HydrophobicContact CG2-CG2 3.7Å
188L92.4Very high92.2Very high60 Ų6040.8 Ų40.831%0.31422%0.222SC..Hα-helixtrans-61.8-43.2-174.8-67.4-173.1000113V183 T184 F191 F192V183-L188 HydrophobicContact CG1-CG 4.48Å; V183-L188 PolarHBondContact O-N 3.49Å; T184-L188 HydrophobicContact CG2-CD1 4.36Å; L188-F191 PolarHBondContact O-N 3.23Å; L188-F192 HydrophobicContact CB-CD2 4.03Å; L188-F192 HydrophobicContact CB-CE2 3.92Å; L188-F192 HydrophobicContact CD1-CE2 4.3Å; L188-F192 HydrophobicContact CD2-CE2 4.04Å; L188-F192 HydrophobicContact CG-CE2 4.31Å; L188-F192 WeakPolarHBondContact O-CD2 3.13Å; L188-F192 PolarHBondContact O-N 3.09Å
189P93.6Very high92.1Very high43 Ų4342.2 Ų42.228%0.27924%0.236SC..Hα-helixtrans-60.1-52.8179.9-25.236.7000113.7T184 W185 F191 F192 I193T184-P189 VanDerWaalsContact O-CD 3.31Å; T184-P189 WeakPolarHBondContact O-CD 3.48Å; W185-P189 WeakPolarHBondContact O-CD 3.3Å; W185-P189 WeakPolarHBondContact O-CG 3.28Å; P189-F191 VanDerWaalsContact C-N 3.34Å; P189-F191 PolarHBondContact O-N 3.5Å; P189-F192 PolarHBondContact O-N 3.47Å; P189-I193 VanDerWaalsContact O-CB 3.28Å; P189-I193 WeakPolarHBondContact O-CB 3.36Å; P189-I193 WeakPolarHBondContact O-CD1 3.41Å; P189-I193 WeakPolarHBondContact O-CG1 3.41Å; P189-I193 PolarHBondContact O-N 3.15Å
190P93.1Very high91.9Very high0 Ų044.9 Ų44.90%025%0.252CS..Hα-helixtrans-64.8-36.6176.824.2-30.9000112.2M105 L106 C186 I187 M194M105-P190 HydrophobicContact CB-CG 4.3Å; M105-P190 VanDerWaalsContact O-CB 3.24Å; M105-P190 WeakPolarHBondContact O-CB 3.43Å; L106-P190 HydrophobicContact CD2-CG 4.29Å; C186-P190 WeakPolarHBondContact O-CD 3.44Å; C186-P190 WeakPolarHBondContact O-CG 3.25Å; I187-P190 VanDerWaalsContact O-CD 3.23Å; I187-P190 WeakPolarHBondContact O-CD 3.44Å; I187-P190 WeakPolarHBondContact O-CG 3.46Å; P190-M194 WeakPolarHBondContact O-CB 3.35Å; P190-M194 VanDerWaalsContact O-CG 3.22Å; P190-M194 WeakPolarHBondContact O-CG 3.07Å; P190-M194 PolarHBondContact O-N 3.23Å
191F91.8Very high91.6Very high70 Ų7042.2 Ų42.231%0.30723%0.23SC..Hα-helixtrans-59.3-52175.8174.4-95.8000112.3I187 L188 P189 M194 L195 F268 L269I187-F191 VanDerWaalsContact O-CB 3.3Å; I187-F191 WeakPolarHBondContact O-CB 3.48Å; I187-F191 PolarHBondContact O-N 3.42Å; I187-F191 VanDerWaalsContact O-N 3.1Å; L188-F191 PolarHBondContact O-N 3.23Å; P189-F191 VanDerWaalsContact C-N 3.34Å; P189-F191 PolarHBondContact O-N 3.5Å; F191-M194 PolarHBondContact O-N 3.08Å; F191-L195 HydrophobicContact CE1-CD2 4.26Å; F191-L195 HydrophobicContact CZ-CD2 4.45Å; F191-L195 WeakPolarHBondContact O-CB 3.36Å; F191-L195 PolarHBondContact O-N 2.85Å; F191-F268 HydrophobicContact CB-CE1 4.38Å; F191-F268 HydrophobicContact CD2-CE1 4.33Å; F191-L269 HydrophobicContact CD2-CD2 3.95Å; F191-L269 HydrophobicContact CE2-CD2 3.66Å
192F93.4Very high91.1Very high120 Ų12044.4 Ų44.453%0.52624%0.24SC..Hα-helixtrans-67.1-40.7179.5-74.4-58.9000112.5L188 P189 M194 L195 A196L188-F192 HydrophobicContact CB-CD2 4.03Å; L188-F192 HydrophobicContact CB-CE2 3.92Å; L188-F192 HydrophobicContact CD1-CE2 4.3Å; L188-F192 HydrophobicContact CD2-CE2 4.04Å; L188-F192 HydrophobicContact CG-CE2 4.31Å; L188-F192 WeakPolarHBondContact O-CD2 3.13Å; L188-F192 PolarHBondContact O-N 3.09Å; P189-F192 PolarHBondContact O-N 3.47Å; F192-M194 PolarHBondContact O-N 3.28Å; F192-L195 PolarHBondContact O-N 3.41Å; F192-A196 VanDerWaalsContact O-CB 3.3Å; F192-A196 WeakPolarHBondContact O-CB 3.31Å; F192-A196 PolarHBondContact O-N 3.45Å
193I93.9Very high90.8Very high59 Ų5953.4 Ų53.430%0.30327%0.273SS..Hα-helixtrans-58.8-47.6175.4-72.9166.2000110.3G109 I113 P189 C197G109-I193 WeakPolarHBondContact O-CG2 3.22Å; I113-I193 HydrophobicContact CD1-CD1 4.46Å; I113-I193 HydrophobicContact CD1-CG2 3.8Å; I113-I193 HydrophobicContact CG1-CG2 3.6Å; P189-I193 VanDerWaalsContact O-CB 3.28Å; P189-I193 WeakPolarHBondContact O-CB 3.36Å; P189-I193 WeakPolarHBondContact O-CD1 3.41Å; P189-I193 WeakPolarHBondContact O-CG1 3.41Å; P189-I193 PolarHBondContact O-N 3.15Å; I193-C197 WeakPolarHBondContact O-CB 3.03Å; I193-C197 PolarHBondContact O-N 3.2Å; I193-C197 PolarHBondContact O-SG 2.9Å
194M91.3Very high90.3Very high5 Ų554.4 Ų54.43%0.02528%0.28CS..Hα-helixtrans-64.1-47.2177.7-71.7-152.8-64.300111.7L108 A112 P190 F191 F192 A196 C197 Y198 F268L108-M194 HydrophobicContact CB-SD 4.21Å; A112-M194 HydrophobicContact CB-CB 4.43Å; A112-M194 HydrophobicContact CB-CG 3.71Å; P190-M194 WeakPolarHBondContact O-CB 3.35Å; P190-M194 VanDerWaalsContact O-CG 3.22Å; P190-M194 WeakPolarHBondContact O-CG 3.07Å; P190-M194 PolarHBondContact O-N 3.23Å; F191-M194 PolarHBondContact O-N 3.08Å; F192-M194 PolarHBondContact O-N 3.28Å; M194-A196 VanDerWaalsContact C-N 3.34Å; M194-A196 PolarHBondContact O-N 2.96Å; M194-C197 PolarHBondContact O-N 3.49Å; M194-Y198 HydrophobicContact CB-CD2 3.84Å; M194-Y198 HydrophobicContact CB-CE2 3.89Å; M194-Y198 HydrophobicContact CG-CD2 4.35Å; M194-Y198 HydrophobicContact CG-CE2 3.88Å; M194-Y198 VanDerWaalsContact O-CB 3.26Å; M194-Y198 WeakPolarHBondContact O-CB 3.37Å; M194-Y198 WeakPolarHBondContact O-CD2 3.47Å; M194-Y198 PolarHBondContact O-N 3.33Å; M194-Y198 HydrophobicContact SD-CE2 3.86Å; M194-F268 HydrophobicContact CE-CB 3.78Å; M194-F268 HydrophobicContact CE-CD1 3.23Å; M194-F268 HydrophobicContact CE-CD2 3.87Å; M194-F268 HydrophobicContact CE-CE1 3.66Å; M194-F268 HydrophobicContact CE-CE2 4.23Å; M194-F268 HydrophobicContact CE-CG 3.35Å; M194-F268 HydrophobicContact CE-CZ 4.13Å
195L91.3Very high89.4Confident106 Ų10651.4 Ų51.456%0.55526%0.263SS*.Hα-helixtrans-59.1-43.9179.4-175.763.4000111.9F191 F192 G199F191-L195 HydrophobicContact CE1-CD2 4.26Å; F191-L195 HydrophobicContact CZ-CD2 4.45Å; F191-L195 WeakPolarHBondContact O-CB 3.36Å; F191-L195 PolarHBondContact O-N 2.85Å; F192-L195 PolarHBondContact O-N 3.41Å; L195-G199 WeakPolarHBondContact O-CA 3.41Å; L195-G199 PolarHBondContact O-N 3.28Å
196A92.3Very high88.7Confident62 Ų6253.9 Ų53.951%0.51227%0.272SS..Hα-helixtrans-67.8-54.2177.600000112F192 M194 Y198 G199 V200F192-A196 VanDerWaalsContact O-CB 3.3Å; F192-A196 WeakPolarHBondContact O-CB 3.31Å; F192-A196 PolarHBondContact O-N 3.45Å; M194-A196 VanDerWaalsContact C-N 3.34Å; M194-A196 PolarHBondContact O-N 2.96Å; A196-Y198 PolarHBondContact O-N 3.26Å; A196-G199 PolarHBondContact O-N 3.24Å; A196-V200 WeakPolarHBondContact O-CG2 3.41Å; A196-V200 PolarHBondContact O-N 3.27Å
197C90.8Very high88Confident15 Ų1558.8 Ų58.810%0.10130%0.297CS..Hα-helixtrans-56.4-51.7-178.6-720000111A112 Y116 I193 M194 V200 I201A112-C197 HydrophobicContact CB-CB 4.23Å; Y116-C197 HydrophobicContact CD2-CB 4.19Å; I193-C197 WeakPolarHBondContact O-CB 3.03Å; I193-C197 PolarHBondContact O-N 3.2Å; I193-C197 PolarHBondContact O-SG 2.9Å; M194-C197 PolarHBondContact O-N 3.49Å; C197-V200 PolarHBondContact O-N 3.38Å; C197-I201 WeakPolarHBondContact O-CB 3.21Å; C197-I201 WeakPolarHBondContact O-CD1 3.44Å; C197-I201 VanDerWaalsContact O-CG1 3.24Å; C197-I201 WeakPolarHBondContact O-CG1 3.27Å; C197-I201 PolarHBondContact O-N 3.3Å
198Y85.8Confident87.1Confident10 Ų1064.7 Ų64.74%0.03932%0.322CS..Hα-helixtrans-76.6-28.9-176.1-59.4-50.3000113.1A112 R115 M194 A196 I201 F202 I261 I265A112-Y198 WeakPolarHBondContact CA-OH 3.46Å; A112-Y198 HydrophobicContact CB-CD2 4.32Å; A112-Y198 HydrophobicContact CB-CE1 4.08Å; A112-Y198 HydrophobicContact CB-CE2 3.57Å; A112-Y198 VanDerWaalsContact CB-CZ 3.44Å; A112-Y198 WeakPolarHBondContact CB-OH 3.36Å; R115-Y198 HydrophobicContact CB-CE1 4.29Å; M194-Y198 HydrophobicContact CB-CD2 3.84Å; M194-Y198 HydrophobicContact CB-CE2 3.89Å; M194-Y198 HydrophobicContact CG-CD2 4.35Å; M194-Y198 HydrophobicContact CG-CE2 3.88Å; M194-Y198 VanDerWaalsContact O-CB 3.26Å; M194-Y198 WeakPolarHBondContact O-CB 3.37Å; M194-Y198 WeakPolarHBondContact O-CD2 3.47Å; M194-Y198 PolarHBondContact O-N 3.33Å; M194-Y198 HydrophobicContact SD-CE2 3.86Å; A196-Y198 PolarHBondContact O-N 3.26Å; Y198-I201 HydrophobicContact CD1-CD1 3.62Å; Y198-I201 HydrophobicContact CE1-CD1 4.16Å; Y198-I201 PolarHBondContact O-N 3.29Å; Y198-F202 VanDerWaalsContact O-CB 3.29Å; Y198-F202 WeakPolarHBondContact O-CB 3.36Å; Y198-F202 PolarHBondContact O-N 2.92Å; Y198-I261 HydrophobicContact CD1-CB 4.43Å; Y198-I261 HydrophobicContact CD1-CG2 3.24Å; Y198-I261 HydrophobicContact CE1-CB 4.28Å; Y198-I261 HydrophobicContact CE1-CG1 4.05Å; Y198-I261 HydrophobicContact CE1-CG2 3.49Å; Y198-I261 VanDerWaalsContact CE1-CG2 3.49Å; Y198-I261 HydrophobicContact CG-CG2 3.89Å; Y198-I265 VanDerWaalsContact CB-CD1 3.42Å; Y198-I265 HydrophobicContact CD1-CD1 4.34Å; Y198-I265 HydrophobicContact CD2-CD1 3.33Å; Y198-I265 HydrophobicContact CD2-CG1 3.24Å; Y198-I265 HydrophobicContact CE2-CD1 4.04Å; Y198-I265 HydrophobicContact CE2-CG1 3.52Å; Y198-I265 HydrophobicContact CG-CD1 3.47Å; Y198-I265 VanDerWaalsContact CG-CD1 3.47Å; Y198-I265 HydrophobicContact CG-CG1 3.93Å
199G87.4Confident86Confident29 Ų2964.6 Ų64.630%0.29933%0.33SS..Hα-helixtrans-60.7-44.1169.400000112.6L195 A196 R203L195-G199 WeakPolarHBondContact O-CA 3.41Å; L195-G199 PolarHBondContact O-N 3.28Å; A196-G199 PolarHBondContact O-N 3.24Å; G199-R203 WeakPolarHBondContact O-CB 3.33Å; G199-R203 WeakPolarHBondContact O-CG 3.14Å; G199-R203 PolarHBondContact O-N 2.85Å
200V89.3Confident84.7Confident58 Ų5870.5 Ų70.535%0.35235%0.347SS..Hα-helixtrans-66.6-47174.8177.20000111.1Y116 L120 A196 C197 F202 R203 V204Y116-V200 HydrophobicContact CE2-CB 4.14Å; Y116-V200 HydrophobicContact CE2-CG1 4.03Å; L120-V200 HydrophobicContact CD1-CG1 3.78Å; L120-V200 HydrophobicContact CD2-CG1 4.39Å; A196-V200 WeakPolarHBondContact O-CG2 3.41Å; A196-V200 PolarHBondContact O-N 3.27Å; C197-V200 PolarHBondContact O-N 3.38Å; V200-F202 VanDerWaalsContact C-N 3.3Å; V200-F202 PolarHBondContact O-N 3.31Å; V200-R203 PolarHBondContact O-N 2.94Å; V200-V204 HydrophobicContact CG1-CG2 4.48Å; V200-V204 WeakPolarHBondContact O-CG2 3.38Å; V200-V204 PolarHBondContact O-N 3.23Å
201I85.9Confident83.1Confident2 Ų278.7 Ų78.71%0.0138%0.382CS..Hα-helixtrans-53.2-47.5175.4-74.4163.4000110.8V119 L120 C197 Y198 V204 A205 F258 I261V119-I201 HydrophobicContact CG1-CG1 4.49Å; V119-I201 HydrophobicContact CG1-CG2 4.37Å; L120-I201 HydrophobicContact CD1-CG1 4.42Å; C197-I201 WeakPolarHBondContact O-CB 3.21Å; C197-I201 WeakPolarHBondContact O-CD1 3.44Å; C197-I201 VanDerWaalsContact O-CG1 3.24Å; C197-I201 WeakPolarHBondContact O-CG1 3.27Å; C197-I201 PolarHBondContact O-N 3.3Å; Y198-I201 HydrophobicContact CD1-CD1 3.62Å; Y198-I201 HydrophobicContact CE1-CD1 4.16Å; Y198-I201 PolarHBondContact O-N 3.29Å; I201-V204 PolarHBondContact O-N 3.48Å; I201-A205 WeakPolarHBondContact O-CB 3.28Å; I201-A205 PolarHBondContact O-N 2.88Å; I201-F258 HydrophobicContact CG2-CD1 3.84Å; I201-F258 HydrophobicContact CG2-CE1 3.49Å; I201-F258 VanDerWaalsContact CG2-CE1 3.49Å; I201-I261 HydrophobicContact CG2-CD1 4.22Å
202F83.6Confident81.5Confident96 Ų9680.2 Ų80.242%0.42139%0.393SS..Hα-helixtrans-67.3-41.5179.5-174.7-109.3000112.7Y198 V200 V204 A205 R206Y198-F202 VanDerWaalsContact O-CB 3.29Å; Y198-F202 WeakPolarHBondContact O-CB 3.36Å; Y198-F202 PolarHBondContact O-N 2.92Å; V200-F202 VanDerWaalsContact C-N 3.3Å; V200-F202 PolarHBondContact O-N 3.31Å; F202-V204 PolarHBondContact O-N 3.49Å; F202-A205 WeakPolarHBondContact O-CB 3.39Å; F202-A205 PolarHBondContact O-N 3.13Å; F202-R206 HydrophobicContact CE1-CG 4.36Å; F202-R206 HydrophobicContact CE2-CG 4.49Å; F202-R206 HydrophobicContact CZ-CG 4.35Å; F202-R206 WeakPolarHBondContact O-CG 3.32Å; F202-R206 PolarHBondContact O-N 3.42Å
203R86.4Confident79.3Confident188 Ų18881.5 Ų81.571%0.70940%0.4SS*.Hα-helixtrans-58.1-48.9173.9-77.3177.7179.6-162.61.8111.1G199 V200 A205 R206 M207G199-R203 WeakPolarHBondContact O-CB 3.33Å; G199-R203 WeakPolarHBondContact O-CG 3.14Å; G199-R203 PolarHBondContact O-N 2.85Å; V200-R203 PolarHBondContact O-N 2.94Å; R203-A205 PolarHBondContact O-N 3.19Å; R203-R206 PolarHBondContact O-N 3.44Å; R203-M207 WeakPolarHBondContact O-CG 3.19Å; R203-M207 PolarHBondContact O-N 3.39Å
204V82.8Confident76.8Confident35 Ų3582.6 Ų82.621%0.21241%0.412CS..Hα-helixtrans-65.2-39.5178.7173.80000111.6L120 V200 I201 F202 M207 K208L120-V204 HydrophobicContact CD2-CB 3.92Å; L120-V204 HydrophobicContact CD2-CG1 3.98Å; L120-V204 HydrophobicContact CD2-CG2 3.66Å; V200-V204 HydrophobicContact CG1-CG2 4.48Å; V200-V204 WeakPolarHBondContact O-CG2 3.38Å; V200-V204 PolarHBondContact O-N 3.23Å; I201-V204 PolarHBondContact O-N 3.48Å; F202-V204 PolarHBondContact O-N 3.49Å; V204-M207 HydrophobicContact CB-CE 4.47Å; V204-M207 HydrophobicContact CG2-CE 3.91Å; V204-M207 PolarHBondContact O-N 3.48Å; V204-K208 HydrophobicContact CG1-CD 4.35Å; V204-K208 WeakPolarHBondContact O-CG 3.44Å; V204-K208 PolarHBondContact O-N 3.28Å
205A76Confident74.4Confident20 Ų2084.1 Ų84.117%0.16543%0.428CS..Hα-helixtrans-58-48.7173.600000112.1I201 F202 R203 M207 K208 A209 F258I201-A205 WeakPolarHBondContact O-CB 3.28Å; I201-A205 PolarHBondContact O-N 2.88Å; F202-A205 WeakPolarHBondContact O-CB 3.39Å; F202-A205 PolarHBondContact O-N 3.13Å; R203-A205 PolarHBondContact O-N 3.19Å; A205-M207 PolarHBondContact O-N 3.11Å; A205-K208 PolarHBondContact O-N 3.45Å; A205-A209 WeakPolarHBondContact O-CB 3.29Å; A205-A209 PolarHBondContact O-N 2.89Å; A205-F258 HydrophobicContact CB-CD1 4.08Å; A205-F258 HydrophobicContact CB-CE1 3.48Å; A205-F258 VanDerWaalsContact CB-CE1 3.48Å; A205-F258 HydrophobicContact CB-CE2 4.13Å; A205-F258 HydrophobicContact CB-CZ 3.53Å
206R79.3Confident72.1Confident144 Ų14483.4 Ų83.454%0.54343%0.429SS..Hα-helixtrans-68.7-31.2178.5-66.9-167.484.21282.4113.1F202 R203 R210F202-R206 HydrophobicContact CE1-CG 4.36Å; F202-R206 HydrophobicContact CE2-CG 4.49Å; F202-R206 HydrophobicContact CZ-CG 4.35Å; F202-R206 WeakPolarHBondContact O-CG 3.32Å; F202-R206 PolarHBondContact O-N 3.42Å; R203-R206 PolarHBondContact O-N 3.44Å; R206-R210 WeakPolarHBondContact O-CB 3.36Å; R206-R210 WeakPolarHBondContact O-CG 3.43Å; R206-R210 PolarHBondContact O-N 2.89Å; R206-R210 PolarHBondContact O-NE 2.89Å
207M78Confident69.6Low104 Ų10484.1 Ų84.151%0.51243%0.426SS..Hα-helixtrans-65.3-45.9171.4-72.5-170.4-63.900111.4R203 V204 A205 R210 K211R203-M207 WeakPolarHBondContact O-CG 3.19Å; R203-M207 PolarHBondContact O-N 3.39Å; V204-M207 HydrophobicContact CB-CE 4.47Å; V204-M207 HydrophobicContact CG2-CE 3.91Å; V204-M207 PolarHBondContact O-N 3.48Å; A205-M207 PolarHBondContact O-N 3.11Å; M207-R210 PolarHBondContact O-N 2.92Å; M207-K211 PolarHBondContact O-N 2.94Å
208K70.9Confident67.3Low133 Ų13387.4 Ų87.458%0.57845%0.446SS*.Hα-helixtrans-63.3-43.8175.9-69.6-176.7-179.6-177.30111.9V204 A205 R210 K211 I212V204-K208 HydrophobicContact CG1-CD 4.35Å; V204-K208 WeakPolarHBondContact O-CG 3.44Å; V204-K208 PolarHBondContact O-N 3.28Å; A205-K208 PolarHBondContact O-N 3.45Å; K208-R210 PolarHBondContact O-N 3.44Å; K208-K211 PolarHBondContact O-N 2.73Å; K208-I212 WeakPolarHBondContact O-CG1 3.44Å; K208-I212 PolarHBondContact O-N 3.06Å
209A69.1Low65.5Low58 Ų5892.2 Ų92.248%0.47948%0.476SS..Hα-helixtrans-61.1-44176.200000112.8A205 I212 H213A205-A209 WeakPolarHBondContact O-CB 3.29Å; A205-A209 PolarHBondContact O-N 2.89Å; A209-I212 PolarHBondContact O-N 3.02Å; A209-H213 PolarHBondContact O-N 3.11Å
210R66Low63.5Low166 Ų16694.4 Ų94.463%0.62649%0.491SS*.Hα-helixtrans-64.8-38.7175.7-75.7-175.5-68-167.55.1112.6R206 M207 K208 I212 H213 C214R206-R210 WeakPolarHBondContact O-CB 3.36Å; R206-R210 WeakPolarHBondContact O-CG 3.43Å; R206-R210 PolarHBondContact O-N 2.89Å; R206-R210 PolarHBondContact O-NE 2.89Å; M207-R210 PolarHBondContact O-N 2.92Å; K208-R210 PolarHBondContact O-N 3.44Å; R210-I212 VanDerWaalsContact C-N 3.33Å; R210-I212 PolarHBondContact O-N 3.19Å; R210-H213 PolarHBondContact O-N 3.14Å; R210-C214 WeakPolarHBondContact O-CB 3.44Å; R210-C214 PolarHBondContact O-N 3.49Å
211K59.6Low61.2Low172 Ų17298.4 Ų98.475%0.74851%0.506SS*.Hα-helixtrans-67-33.9177.5-161.5168.9-173.61760112.3M207 K208 G215M207-K211 PolarHBondContact O-N 2.94Å; K208-K211 PolarHBondContact O-N 2.73Å; K211-G215 PolarHBondContact O-N 3.02Å
212I58.9Low59.1Low103 Ų103104.9 Ų104.953%0.52854%0.541SS..Hα-helixtrans-67.4-48.6172.1-65.1161.9000110.4K208 A209 R210 C214 G215 T216K208-I212 WeakPolarHBondContact O-CG1 3.44Å; K208-I212 PolarHBondContact O-N 3.06Å; A209-I212 PolarHBondContact O-N 3.02Å; R210-I212 VanDerWaalsContact C-N 3.33Å; R210-I212 PolarHBondContact O-N 3.19Å; I212-C214 VanDerWaalsContact C-N 3.35Å; I212-C214 PolarHBondContact O-N 3.12Å; I212-G215 PolarHBondContact O-N 2.89Å; I212-T216 PolarHBondContact O-N 2.64Å; I212-T216 PolarHBondContact O-OG1 2.63Å
213H46Very low57.4Low147 Ų147107.4 Ų107.468%0.68156%0.559SS**Hα-helixtrans-61.4-41.3-179.5-162.865.3000112.5A209 R210 V217A209-H213 PolarHBondContact O-N 3.11Å; R210-H213 PolarHBondContact O-N 3.14Å; H213-V217 WeakPolarHBondContact O-CG2 3.43Å; H213-V217 PolarHBondContact O-N 3.14Å
214C42.2Very low55.5Low82 Ų82103.3 Ų103.355%0.55456%0.559SS**Hα-helixtrans-70.9-42.5176-174.20000112.4R210 I212 T216 V217 V218R210-C214 WeakPolarHBondContact O-CB 3.44Å; R210-C214 PolarHBondContact O-N 3.49Å; I212-C214 VanDerWaalsContact C-N 3.35Å; I212-C214 PolarHBondContact O-N 3.12Å; C214-T216 VanDerWaalsContact C-N 3.33Å; C214-T216 PolarHBondContact O-N 2.93Å; C214-V217 PolarHBondContact O-N 3.33Å; C214-V217 VanDerWaalsContact O-N 3.15Å; C214-V218 PolarHBondContact O-N 3Å; C214-V218 VanDerWaalsContact O-N 3.11Å
215G41.3Very low53.6Low36 Ų36106.5 Ų106.537%0.37159%0.589SS.*Hα-helixtrans-64.5-32.3177.700000114K211 I212 V219K211-G215 PolarHBondContact O-N 3.02Å; I212-G215 PolarHBondContact O-N 2.89Å; G215-V219 WeakPolarHBondContact O-CG2 3.18Å; G215-V219 PolarHBondContact O-N 3.47Å
216T42.8Very low51.8Low92 Ų92108.9 Ų108.956%0.56462%0.615SS**Hα-helixtrans-70.3-31.5173.5-550000112.5I212 C214 A220I212-T216 PolarHBondContact O-N 2.64Å; I212-T216 PolarHBondContact O-OG1 2.63Å; C214-T216 VanDerWaalsContact C-N 3.33Å; C214-T216 PolarHBondContact O-N 2.93Å; T216-A220 PolarHBondContact O-N 3.26Å
217V40.4Very low49.9Very low76 Ų76109.2 Ų109.246%0.46163%0.633SS.*Hα-helixtrans-73.7-40.4176.9172.40000111.6H213 C214 V219 A220 Q221H213-V217 WeakPolarHBondContact O-CG2 3.43Å; H213-V217 PolarHBondContact O-N 3.14Å; C214-V217 PolarHBondContact O-N 3.33Å; C214-V217 VanDerWaalsContact O-N 3.15Å; V217-V219 PolarHBondContact O-N 3.09Å; V217-A220 PolarHBondContact O-N 3.03Å; V217-A220 VanDerWaalsContact O-N 3.11Å; V217-Q221 PolarHBondContact O-N 3.46Å
218V42.9Very low48.4Very low84 Ų84113 Ų11351%0.50965%0.65SS.*Hα-helixtrans-61.5-44.6177.6175.80000111.4C214 A220 Q221C214-V218 PolarHBondContact O-N 3Å; C214-V218 VanDerWaalsContact O-N 3.11Å; V218-A220 PolarHBondContact O-N 2.97Å; V218-Q221 PolarHBondContact O-N 2.97Å; V218-Q221 VanDerWaalsContact O-N 3.15Å
219V47.7Very low46.8Very low112 Ų112118.5 Ų118.568%0.67967%0.667SS**Hα-helixtrans-65.5-21.8177176.10000112.9G215 V217G215-V219 WeakPolarHBondContact O-CG2 3.18Å; G215-V219 PolarHBondContact O-N 3.47Å; V217-V219 PolarHBondContact O-N 3.09Å
220A45.5Very low45.6Very low74 Ų74124 Ų12461%0.61269%0.688SS**THydrogen-bonded Turntrans-87.9-6.3177.600000114T216 V217 V218T216-A220 PolarHBondContact O-N 3.26Å; V217-A220 PolarHBondContact O-N 3.03Å; V217-A220 VanDerWaalsContact O-N 3.11Å; V218-A220 PolarHBondContact O-N 2.97Å
221Q40Very low44.2Very low143 Ų143119.6 Ų119.667%0.66870%0.695SS**THydrogen-bonded Turntrans-110.6-18-171.5-165.5162.7-17.500114.3V217 V218 D223V217-Q221 PolarHBondContact O-N 3.46Å; V218-Q221 PolarHBondContact O-N 2.97Å; V218-Q221 VanDerWaalsContact O-N 3.15Å; Q221-D223 VanDerWaalsContact C-N 3.28Å; Q221-D223 PolarHBondContact O-N 3.49Å
222D41.7Very low43.1Very low137 Ų137123 Ų12373%0.73370%0.703SS**G310 helixtrans-73.6-14.3175.8-77.8-24.8000113.8S224D222-S224 PolarHBondContact O-N 3.17Å
223D48.2Very low42.5Very low149 Ų149127.6 Ų127.680%0.79772%0.719SS**G310 helixtrans-79.19.1178-80.4-19.8000114.1Q221Q221-D223 VanDerWaalsContact C-N 3.28Å; Q221-D223 PolarHBondContact O-N 3.49Å
224S46.1Very low42.3Very low103 Ų103127.8 Ų127.872%0.7273%0.725SS**G310 helixtrans-132.831.4-168.6-710000116.7D222D222-S224 PolarHBondContact O-N 3.17Å
225A44Very low42.2Very low101 Ų101129.3 Ų129.384%0.83574%0.737SS**SBendtrans-159.1104.3162.200000114.1
226G38.2Very low42.4Very low70 Ų70133 Ų13372%0.72276%0.758SS**  trans150.870.3161.600000120.2
227T39.2Very low42.2Very low151 Ų151133.5 Ų133.593%0.92676%0.76SS**  trans68.5141142.2-36.80000120.5
228Q46.7Very low42.1Very low184 Ų184135.5 Ų135.586%0.8678%0.778SS**  trans-67.1148.6-174.6-59179.6-4.400115.9
229R36.9Very low42.1Very low249 Ų249136.8 Ų136.894%0.9479%0.786SS**  -160.2150.6125.4-122.5169154.9172.7-8.7113.8
230N42.7Very low41.9Very low172 Ų172136.7 Ų136.792%0.9279%0.79SS**  trans-62.9137.6-176-75.3-32.8000113.8
231G38.1Very low41.8Very low75 Ų75136.1 Ų136.177%0.77378%0.782SS**  trans-166.491.3175.900000113.9
232R36.5Very low42Very low242 Ų242132.3 Ų132.391%0.91377%0.771SS**  trans1.9111.3161.5-147.4169.4-167.5140.3-1.9117N234R232-N234 PolarHBondContact O-N 3.27Å
233K46.4Very low42.3Very low200 Ų200128.2 Ų128.287%0.8776%0.761SS**  trans-55.8125.9162.5-73.8177.3176.9175.30109.5
234N40.4Very low42.2Very low151 Ų151124.8 Ų124.881%0.80775%0.749SS**  trans175.6103.8150.2-92-7.7000110.4R232R232-N234 PolarHBondContact O-N 3.27Å
235S40.1Very low42.1Very low114 Ų114128 Ų12880%0.79775%0.745SS**  trans175.2138.314241.30000111.3
236S46.6Very low42.1Very low115 Ų115132.2 Ų132.280%0.80474%0.74SS**  trans-77116.4173.446.60000111.9
237T37.6Very low42.5Very low101 Ų101132.6 Ų132.662%0.6273%0.731SS**  trans-137.768.6170.2-46.80000111.7T239T237-T239 VanDerWaalsContact C-N 3.28Å; T237-T239 PolarHBondContact O-N 3.12Å; T237-T239 VanDerWaalsContact O-N 3.11Å
238S39.4Very low42.9Very low118 Ų118131.6 Ų131.683%0.82572%0.72SS**  trans-84.549-178.3-53.90000113.5
239T42Very low43Very low111 Ų111127.9 Ų127.968%0.68171%0.709SS**  trans-121.413.4-168.846.10000116.4T237T237-T239 VanDerWaalsContact C-N 3.28Å; T237-T239 PolarHBondContact O-N 3.12Å; T237-T239 VanDerWaalsContact O-N 3.11Å
240S43.2Very low43.3Very low110 Ų110123.5 Ų123.577%0.76969%0.694SS**  trans-96.96.2-177.4-53.20000116.2
241S43Very low43.4Very low62 Ų62117.8 Ų117.843%0.43467%0.67SS.*Hα-helixtrans-93.6-5.9-176.774.90000115.9R245S241-R245 PolarHBondContact O-N 3.23Å; S241-R245 PolarHBondContact O-NE 3.43Å; S241-R245 PolarHBondContact OG-NH2 3.03Å
242S44.7Very low43.8Very low63 Ų63115.4 Ų115.444%0.44165%0.646SS.*Hα-helixtrans-81.8-40.3-177.6-170.50000112.8R245 R246S242-R245 PolarHBondContact O-N 3.32Å; S242-R246 PolarHBondContact O-N 3.3Å
243G48.8Very low44.6Very low52 Ų52106.8 Ų106.854%0.53662%0.623SS.*Hα-helixtrans-62.7-46177.200000112.7R246 S247G243-R246 PolarHBondContact O-N 3.39Å; G243-S247 WeakPolarHBondContact O-CB 3.4Å; G243-S247 PolarHBondContact O-N 3.17Å
244S46.5Very low44.9Very low77 Ų77100.8 Ų100.854%0.53860%0.598SS.*Hα-helixtrans-59.5-48.3175.5178.50000111.9R246 S247 L248S244-R246 PolarHBondContact O-N 3.02Å; S244-S247 PolarHBondContact O-N 3.29Å; S244-L248 PolarHBondContact O-N 3.37Å
245R42.8Very low45.8Very low170 Ų17097.1 Ų97.164%0.64258%0.583SS**Hα-helixtrans-61.8-41.1176.5-82.9-174.6-90.2-168.2-7.9113.1S241 S242 L248 V249S241-R245 PolarHBondContact O-N 3.23Å; S241-R245 PolarHBondContact O-NE 3.43Å; S241-R245 PolarHBondContact OG-NH2 3.03Å; S242-R245 PolarHBondContact O-N 3.32Å; R245-L248 PolarHBondContact O-N 2.87Å; R245-V249 WeakPolarHBondContact O-CB 3.22Å; R245-V249 VanDerWaalsContact O-CG2 3.25Å; R245-V249 WeakPolarHBondContact O-CG2 3.32Å; R245-V249 PolarHBondContact O-N 2.98Å
246R45.2Very low46.9Very low189 Ų18997.6 Ų97.671%0.71357%0.571SS**Hα-helixtrans-63.6-42.1174.8-77.4179.1173.9167.1-1112.1S242 G243 S244 V249 Y250S242-R246 PolarHBondContact O-N 3.3Å; G243-R246 PolarHBondContact O-N 3.39Å; S244-R246 PolarHBondContact O-N 3.02Å; R246-V249 PolarHBondContact O-N 3.47Å; R246-Y250 WeakPolarHBondContact O-CB 3.35Å; R246-Y250 PolarHBondContact O-N 2.94Å
247S45.3Very low47.8Very low78 Ų7894.2 Ų94.255%0.54555%0.55SS.*Hα-helixtrans-61.5-47175.4-173.90000111.9G243 S244 V249 Y250 A251G243-S247 WeakPolarHBondContact O-CB 3.4Å; G243-S247 PolarHBondContact O-N 3.17Å; S244-S247 PolarHBondContact O-N 3.29Å; S247-V249 PolarHBondContact O-N 3.4Å; S247-Y250 PolarHBondContact O-N 2.79Å; S247-A251 WeakPolarHBondContact O-CB 3.38Å; S247-A251 PolarHBondContact O-N 3.22Å
248L48Very low49.2Very low131 Ų13191.7 Ų91.769%0.68653%0.53SS*.Hα-helixtrans-63.7-39.3178.8-133.6107.4000112.4S244 R245 G252S244-L248 PolarHBondContact O-N 3.37Å; R245-L248 PolarHBondContact O-N 2.87Å; L248-G252 PolarHBondContact O-N 2.99Å
249V48.5Very low50.9Low106 Ų10688.9 Ų88.964%0.64251%0.508SS*.Hα-helixtrans-66.4-39.6175.4169.30000111.4R245 R246 S247 G252 S253R245-V249 WeakPolarHBondContact O-CB 3.22Å; R245-V249 VanDerWaalsContact O-CG2 3.25Å; R245-V249 WeakPolarHBondContact O-CG2 3.32Å; R245-V249 PolarHBondContact O-N 2.98Å; R246-V249 PolarHBondContact O-N 3.47Å; S247-V249 PolarHBondContact O-N 3.4Å; V249-G252 CarbonylContact O-C 3.34Å; V249-G252 PolarHBondContact O-N 3.18Å; V249-S253 PolarHBondContact O-N 3.45Å
250Y43.7Very low52.3Low157 Ų15785 Ų8562%0.61648%0.484SS*.Hα-helixtrans-68.1-45.3176.5-154.2-99.7000111.6R246 S247 G252 S253 Q254R246-Y250 WeakPolarHBondContact O-CB 3.35Å; R246-Y250 PolarHBondContact O-N 2.94Å; S247-Y250 PolarHBondContact O-N 2.79Å; Y250-G252 VanDerWaalsContact C-N 3.3Å; Y250-G252 PolarHBondContact O-N 3.41Å; Y250-S253 PolarHBondContact O-N 3.31Å; Y250-S253 PolarHBondContact O-OG 3.03Å; Y250-Q254 HydrophobicContact CD1-CG 4.21Å; Y250-Q254 HydrophobicContact CE1-CG 4.3Å; Y250-Q254 VanDerWaalsContact O-CG 3.28Å; Y250-Q254 WeakPolarHBondContact O-CG 3.49Å; Y250-Q254 PolarHBondContact O-N 3.13Å
251A44.5Very low53.9Low51 Ų5180.3 Ų80.342%0.42145%0.45SS..Hα-helixtrans-58.7-42.8172.500000111.6S247 S253 Q254 C255S247-A251 WeakPolarHBondContact O-CB 3.38Å; S247-A251 PolarHBondContact O-N 3.22Å; A251-S253 VanDerWaalsContact C-N 3.32Å; A251-S253 PolarHBondContact O-N 2.9Å; A251-Q254 PolarHBondContact O-N 3.27Å; A251-C255 WeakPolarHBondContact O-CB 3.18Å; A251-C255 PolarHBondContact O-N 3.37Å
252G47.6Very low55.5Low26 Ų2681.8 Ų81.827%0.26845%0.453SS..Hα-helixtrans-69.8-19.4176.900000115.1L248 V249 Y250 K256L248-G252 PolarHBondContact O-N 2.99Å; V249-G252 CarbonylContact O-C 3.34Å; V249-G252 PolarHBondContact O-N 3.18Å; Y250-G252 VanDerWaalsContact C-N 3.3Å; Y250-G252 PolarHBondContact O-N 3.41Å; G252-K256 WeakPolarHBondContact O-CG 3.41Å; G252-K256 PolarHBondContact O-NZ 3.44Å
253S52.2Low57.4Low60 Ų6081.1 Ų81.142%0.4245%0.446SS..Hα-helixtrans-85.2-40.217065.40000112V249 Y250 A251 K256 A257V249-S253 PolarHBondContact O-N 3.45Å; Y250-S253 PolarHBondContact O-N 3.31Å; Y250-S253 PolarHBondContact O-OG 3.03Å; A251-S253 VanDerWaalsContact C-N 3.32Å; A251-S253 PolarHBondContact O-N 2.9Å; S253-K256 PolarHBondContact O-N 2.85Å; S253-A257 PolarHBondContact O-N 3.38Å
254Q53.8Low59Low75 Ų7579 Ų7935%0.3542%0.423SS..Hα-helixtrans-60.9-45.4174.8-66.8-66.9-15.300110.9Y250 A251 K256 A257 F258Y250-Q254 HydrophobicContact CD1-CG 4.21Å; Y250-Q254 HydrophobicContact CE1-CG 4.3Å; Y250-Q254 VanDerWaalsContact O-CG 3.28Å; Y250-Q254 WeakPolarHBondContact O-CG 3.49Å; Y250-Q254 PolarHBondContact O-N 3.13Å; A251-Q254 PolarHBondContact O-N 3.27Å; Q254-K256 VanDerWaalsContact C-N 3.27Å; Q254-K256 PolarHBondContact O-N 3.48Å; Q254-A257 WeakPolarHBondContact O-CB 3.37Å; Q254-A257 PolarHBondContact O-N 3.29Å; Q254-F258 HydrophobicContact CB-CE2 4.3Å; Q254-F258 WeakPolarHBondContact O-CD2 3.02Å; Q254-F258 PolarHBondContact O-N 3.07Å; Q254-F258 VanDerWaalsContact O-N 3.16Å
255C57.9Low60.7Low74 Ų7477 Ų7750%0.541%0.406SS..Hα-helixtrans-54.4-39.9177-167.50000112.8A251 A257 F258 V259A251-C255 WeakPolarHBondContact O-CB 3.18Å; A251-C255 PolarHBondContact O-N 3.37Å; C255-A257 VanDerWaalsContact C-N 3.34Å; C255-A257 PolarHBondContact O-N 3.49Å; C255-F258 PolarHBondContact O-N 3.21Å; C255-V259 WeakPolarHBondContact O-CG2 3.34Å; C255-V259 PolarHBondContact O-N 3.43Å
256K64.4Low62.8Low124 Ų12470.2 Ų70.254%0.53939%0.388SS..Hα-helixtrans-64.9-34177.6-68.8178-177.672.90113.3G252 S253 Q254 T260G252-K256 WeakPolarHBondContact O-CG 3.41Å; G252-K256 PolarHBondContact O-NZ 3.44Å; S253-K256 PolarHBondContact O-N 2.85Å; Q254-K256 VanDerWaalsContact C-N 3.27Å; Q254-K256 PolarHBondContact O-N 3.48Å; K256-T260 PolarHBondContact O-N 2.99Å; K256-T260 PolarHBondContact O-OG1 3.21Å
257A63.9Low64.9Low44 Ų4462.4 Ų62.436%0.36436%0.362SS..Hα-helixtrans-69.1-40.5174.600000111.3S253 Q254 C255 T260 I261S253-A257 PolarHBondContact O-N 3.38Å; Q254-A257 WeakPolarHBondContact O-CB 3.37Å; Q254-A257 PolarHBondContact O-N 3.29Å; C255-A257 VanDerWaalsContact C-N 3.34Å; C255-A257 PolarHBondContact O-N 3.49Å; A257-T260 WeakPolarHBondContact O-CB 3.25Å; A257-T260 PolarHBondContact O-N 3Å; A257-I261 PolarHBondContact O-N 3.16Å; A257-I261 VanDerWaalsContact O-N 3.12Å
258F68.2Low66.9Low47 Ų4759.1 Ų59.121%0.20634%0.338CS..Hα-helixtrans-63.6-39.5173.5-69.8-70.8000112.9V119 I201 A205 Q254 C255 T260 I261 L262V119-F258 HydrophobicContact CG1-CE1 4.37Å; V119-F258 HydrophobicContact CG1-CZ 4.32Å; I201-F258 HydrophobicContact CG2-CD1 3.84Å; I201-F258 HydrophobicContact CG2-CE1 3.49Å; I201-F258 VanDerWaalsContact CG2-CE1 3.49Å; A205-F258 HydrophobicContact CB-CD1 4.08Å; A205-F258 HydrophobicContact CB-CE1 3.48Å; A205-F258 VanDerWaalsContact CB-CE1 3.48Å; A205-F258 HydrophobicContact CB-CE2 4.13Å; A205-F258 HydrophobicContact CB-CZ 3.53Å; Q254-F258 HydrophobicContact CB-CE2 4.3Å; Q254-F258 WeakPolarHBondContact O-CD2 3.02Å; Q254-F258 PolarHBondContact O-N 3.07Å; Q254-F258 VanDerWaalsContact O-N 3.16Å; C255-F258 PolarHBondContact O-N 3.21Å; F258-T260 VanDerWaalsContact C-N 3.34Å; F258-T260 PolarHBondContact O-N 2.94Å; F258-I261 WeakPolarHBondContact O-CB 3.44Å; F258-I261 PolarHBondContact O-N 2.94Å; F258-L262 WeakPolarHBondContact O-CG 3.26Å; F258-L262 PolarHBondContact O-N 3.01Å
259V73.7Confident68.9Low59 Ų5956.5 Ų56.536%0.35832%0.324SS..Hα-helixtrans-61.8-43.3174.71780000110.9C255 I261 L262 V263 W316C255-V259 WeakPolarHBondContact O-CG2 3.34Å; C255-V259 PolarHBondContact O-N 3.43Å; V259-I261 VanDerWaalsContact C-N 3.27Å; V259-I261 PolarHBondContact O-N 2.85Å; V259-L262 PolarHBondContact O-N 2.92Å; V259-V263 HydrophobicContact CG1-CG2 4.23Å; V259-V263 VanDerWaalsContact O-CG2 3.3Å; V259-V263 WeakPolarHBondContact O-CG2 3.34Å; V259-V263 PolarHBondContact O-N 2.97Å; V259-W316 HydrophobicContact CB-CZ2 4.09Å; V259-W316 HydrophobicContact CG1-CH2 3.57Å; V259-W316 HydrophobicContact CG1-CZ2 3.54Å
260T73.3Confident70.9Confident30 Ų3056.5 Ų56.518%0.18432%0.319CS..Hα-helixtrans-57.3-43.3176.2-43.20000111K256 A257 F258 V263 V264 I312 W316K256-T260 PolarHBondContact O-N 2.99Å; K256-T260 PolarHBondContact O-OG1 3.21Å; A257-T260 WeakPolarHBondContact O-CB 3.25Å; A257-T260 PolarHBondContact O-N 3Å; F258-T260 VanDerWaalsContact C-N 3.34Å; F258-T260 PolarHBondContact O-N 2.94Å; T260-V263 PolarHBondContact O-N 3.22Å; T260-V264 VanDerWaalsContact O-CG2 3.31Å; T260-V264 WeakPolarHBondContact O-CG2 3.33Å; T260-V264 PolarHBondContact O-N 2.96Å; T260-I312 HydrophobicContact CG2-CG2 4.46Å; T260-W316 HydrophobicContact CG2-CG 4.37Å; T260-W316 PolarHBondContact OG1-NE1 2.92Å
261I75.8Confident73.2Confident11 Ų1149.3 Ų49.36%0.05629%0.292CS..Hα-helixtrans-62.6-47.6177.3-75.6166.6000111.7V119 Y198 I201 A257 F258 V259 V263 V264 I265V119-I261 HydrophobicContact CG2-CD1 4.35Å; Y198-I261 HydrophobicContact CD1-CB 4.43Å; Y198-I261 HydrophobicContact CD1-CG2 3.24Å; Y198-I261 HydrophobicContact CE1-CB 4.28Å; Y198-I261 HydrophobicContact CE1-CG1 4.05Å; Y198-I261 HydrophobicContact CE1-CG2 3.49Å; Y198-I261 VanDerWaalsContact CE1-CG2 3.49Å; Y198-I261 HydrophobicContact CG-CG2 3.89Å; I201-I261 HydrophobicContact CG2-CD1 4.22Å; A257-I261 PolarHBondContact O-N 3.16Å; A257-I261 VanDerWaalsContact O-N 3.12Å; F258-I261 WeakPolarHBondContact O-CB 3.44Å; F258-I261 PolarHBondContact O-N 2.94Å; V259-I261 VanDerWaalsContact C-N 3.27Å; V259-I261 PolarHBondContact O-N 2.85Å; I261-V263 VanDerWaalsContact C-N 3.32Å; I261-V263 PolarHBondContact O-N 2.91Å; I261-V264 PolarHBondContact O-N 3.11Å; I261-I265 HydrophobicContact CG2-CD1 4.14Å; I261-I265 WeakPolarHBondContact O-CG1 3.45Å; I261-I265 PolarHBondContact O-N 3.48Å
262L77.1Confident75.5Confident94 Ų9447.1 Ų47.149%0.49227%0.272SS..Hα-helixtrans-63.4-37.9178.5-70.1171.9000112.1F258 V259 I265 G266F258-L262 WeakPolarHBondContact O-CG 3.26Å; F258-L262 PolarHBondContact O-N 3.01Å; V259-L262 PolarHBondContact O-N 2.92Å; L262-I265 PolarHBondContact O-N 3.15Å; L262-G266 PolarHBondContact O-N 2.97Å
263V83.3Confident77.6Confident48 Ų4847.5 Ų47.529%0.29128%0.277SS..Hα-helixtrans-63.9-45.3175.3170.60000111.1V259 T260 I261 I265 G266 T267 I312 W316V259-V263 HydrophobicContact CG1-CG2 4.23Å; V259-V263 VanDerWaalsContact O-CG2 3.3Å; V259-V263 WeakPolarHBondContact O-CG2 3.34Å; V259-V263 PolarHBondContact O-N 2.97Å; T260-V263 PolarHBondContact O-N 3.22Å; I261-V263 VanDerWaalsContact C-N 3.32Å; I261-V263 PolarHBondContact O-N 2.91Å; V263-I265 VanDerWaalsContact C-N 3.33Å; V263-I265 PolarHBondContact O-N 3.03Å; V263-G266 PolarHBondContact O-N 3.34Å; V263-T267 WeakPolarHBondContact O-CB 3.3Å; V263-T267 PolarHBondContact O-N 3.42Å; V263-T267 PolarHBondContact O-OG1 3.34Å; V263-T267 VanDerWaalsContact O-OG1 3.11Å; V263-I312 HydrophobicContact CG1-CD1 3.99Å; V263-I312 HydrophobicContact CG1-CG1 3.84Å; V263-W316 HydrophobicContact CG2-CH2 4.09Å; V263-W316 HydrophobicContact CG2-CZ3 4.17Å
264V82.8Confident79.5Confident7 Ų747 Ų474%0.04227%0.272CS..Hα-helixtrans-55.8-46.9176.9168.90000111.7L108 T260 I261 F268 I312 Y313L108-V264 HydrophobicContact CD2-CG1 4.39Å; T260-V264 VanDerWaalsContact O-CG2 3.31Å; T260-V264 WeakPolarHBondContact O-CG2 3.33Å; T260-V264 PolarHBondContact O-N 2.96Å; I261-V264 PolarHBondContact O-N 3.11Å; V264-F268 PolarHBondContact O-N 3.4Å; V264-F268 VanDerWaalsContact O-N 3.08Å; V264-I312 HydrophobicContact CG2-CG2 3.6Å; V264-Y313 WeakPolarHBondContact CG1-OH 3.46Å; V264-Y313 HydrophobicContact CG2-CE1 4.19Å; V264-Y313 HydrophobicContact CG2-CE2 4.33Å; V264-Y313 VanDerWaalsContact CG2-OH 3.24Å; V264-Y313 WeakPolarHBondContact CG2-OH 3.27Å
265I83.8Confident81.3Confident37 Ų3743.6 Ų43.619%0.1926%0.256CS..Hα-helixtrans-64.5-51178.4-57.8160.7000110.5Y198 I261 L262 V263 T267 F268 L269Y198-I265 VanDerWaalsContact CB-CD1 3.42Å; Y198-I265 HydrophobicContact CD1-CD1 4.34Å; Y198-I265 HydrophobicContact CD2-CD1 3.33Å; Y198-I265 HydrophobicContact CD2-CG1 3.24Å; Y198-I265 HydrophobicContact CE2-CD1 4.04Å; Y198-I265 HydrophobicContact CE2-CG1 3.52Å; Y198-I265 HydrophobicContact CG-CD1 3.47Å; Y198-I265 VanDerWaalsContact CG-CD1 3.47Å; Y198-I265 HydrophobicContact CG-CG1 3.93Å; I261-I265 HydrophobicContact CG2-CD1 4.14Å; I261-I265 WeakPolarHBondContact O-CG1 3.45Å; I261-I265 PolarHBondContact O-N 3.48Å; L262-I265 PolarHBondContact O-N 3.15Å; V263-I265 VanDerWaalsContact C-N 3.33Å; V263-I265 PolarHBondContact O-N 3.03Å; I265-T267 VanDerWaalsContact C-N 3.32Å; I265-T267 PolarHBondContact O-N 3.32Å; I265-F268 PolarHBondContact O-N 3.03Å; I265-F268 VanDerWaalsContact O-N 3.16Å; I265-L269 HydrophobicContact CG2-CD1 3.78Å; I265-L269 HydrophobicContact CG2-CG 4.17Å; I265-L269 WeakPolarHBondContact O-CG 3.38Å; I265-L269 PolarHBondContact O-N 3.41Å
266G86.3Confident82.9Confident26 Ų2641.1 Ų41.127%0.26824%0.239SC..Hα-helixtrans-57.4-46.2-178.500000111.4L262 V263 L269 I270L262-G266 PolarHBondContact O-N 2.97Å; V263-G266 PolarHBondContact O-N 3.34Å; G266-L269 PolarHBondContact O-N 3Å; G266-I270 VanDerWaalsContact O-CB 3.3Å; G266-I270 WeakPolarHBondContact O-CB 3.31Å; G266-I270 WeakPolarHBondContact O-CD1 3.47Å; G266-I270 WeakPolarHBondContact O-CG1 3.25Å; G266-I270 PolarHBondContact O-N 3.48Å
267T88.1Confident84.2Confident26 Ų2637 Ų3716%0.1623%0.231CC..Hα-helixtrans-58.6-48.9174.4-65.30000111.8V263 I265 L269 I270 T271 C308 I312V263-T267 WeakPolarHBondContact O-CB 3.3Å; V263-T267 PolarHBondContact O-N 3.42Å; V263-T267 PolarHBondContact O-OG1 3.34Å; V263-T267 VanDerWaalsContact O-OG1 3.11Å; I265-T267 VanDerWaalsContact C-N 3.32Å; I265-T267 PolarHBondContact O-N 3.32Å; T267-L269 PolarHBondContact O-N 3.28Å; T267-I270 PolarHBondContact O-N 2.91Å; T267-T271 HydrophobicContact CG2-CG2 4.19Å; T267-T271 WeakPolarHBondContact O-CB 3.45Å; T267-T271 WeakPolarHBondContact O-CG2 3.37Å; T267-T271 PolarHBondContact O-N 3.45Å; T267-T271 PolarHBondContact O-OG1 3.47Å; T267-C308 HydrophobicContact CG2-CB 3.53Å; T267-I312 HydrophobicContact CG2-CD1 3.94Å; T267-I312 WeakPolarHBondContact OG1-CD1 3.26Å
268F88.4Confident85.5Confident8 Ų835.2 Ų35.24%0.03522%0.216CC..Hα-helixtrans-60.1-47.6178.5175.8-96.9000112.2M105 L108 F191 M194 V264 I265 I270 T271 W272M105-F268 HydrophobicContact CB-CE2 4.11Å; M105-F268 HydrophobicContact CG-CE2 3.86Å; M105-F268 HydrophobicContact SD-CE2 4.11Å; L108-F268 HydrophobicContact CD1-CD2 3.77Å; L108-F268 HydrophobicContact CD1-CE2 4.49Å; F191-F268 HydrophobicContact CB-CE1 4.38Å; F191-F268 HydrophobicContact CD2-CE1 4.33Å; M194-F268 HydrophobicContact CE-CB 3.78Å; M194-F268 HydrophobicContact CE-CD1 3.23Å; M194-F268 HydrophobicContact CE-CD2 3.87Å; M194-F268 HydrophobicContact CE-CE1 3.66Å; M194-F268 HydrophobicContact CE-CE2 4.23Å; M194-F268 HydrophobicContact CE-CG 3.35Å; M194-F268 HydrophobicContact CE-CZ 4.13Å; V264-F268 PolarHBondContact O-N 3.4Å; V264-F268 VanDerWaalsContact O-N 3.08Å; I265-F268 PolarHBondContact O-N 3.03Å; I265-F268 VanDerWaalsContact O-N 3.16Å; F268-I270 PolarHBondContact O-N 3.44Å; F268-T271 PolarHBondContact O-N 3.34Å; F268-W272 HydrophobicContact CD2-CB 4.39Å; F268-W272 HydrophobicContact CD2-CG 4.42Å; F268-W272 HydrophobicContact CE2-CB 4.23Å; F268-W272 HydrophobicContact CE2-CG 4.33Å; F268-W272 WeakPolarHBondContact O-CB 3.37Å; F268-W272 PolarHBondContact O-N 2.94Å
269L90.3Very high86.5Confident77 Ų7733 Ų3340%0.40321%0.206SC..Hα-helixtrans-63.4-39.5179.8-65.4178.7000112.3F191 I265 G266 T267 G273 P274F191-L269 HydrophobicContact CD2-CD2 3.95Å; F191-L269 HydrophobicContact CE2-CD2 3.66Å; I265-L269 HydrophobicContact CG2-CD1 3.78Å; I265-L269 HydrophobicContact CG2-CG 4.17Å; I265-L269 WeakPolarHBondContact O-CG 3.38Å; I265-L269 PolarHBondContact O-N 3.41Å; G266-L269 PolarHBondContact O-N 3Å; T267-L269 PolarHBondContact O-N 3.28Å; L269-G273 VanDerWaalsContact O-CA 3.25Å; L269-G273 WeakPolarHBondContact O-CA 3.26Å; L269-G273 PolarHBondContact O-N 3.34Å; L269-P274 VanDerWaalsContact O-CD 3.29Å; L269-P274 WeakPolarHBondContact O-CD 3.26Å
270I91.1Very high87.3Confident106 Ų10632.4 Ų32.454%0.54420%0.204SC..Hα-helixtrans-74.2-36.5-180-68.6166.6000111.9G266 T267 F268 P274 L301G266-I270 VanDerWaalsContact O-CB 3.3Å; G266-I270 WeakPolarHBondContact O-CB 3.31Å; G266-I270 WeakPolarHBondContact O-CD1 3.47Å; G266-I270 WeakPolarHBondContact O-CG1 3.25Å; G266-I270 PolarHBondContact O-N 3.48Å; T267-I270 PolarHBondContact O-N 2.91Å; F268-I270 PolarHBondContact O-N 3.44Å; I270-P274 WeakPolarHBondContact O-CD 3.34Å; I270-P274 WeakPolarHBondContact O-CG 3.42Å; I270-L301 HydrophobicContact CG2-CD2 4.42Å
271T91.3Very high88.2Confident6 Ų633 Ų334%0.03721%0.207CC..Hα-helixtrans-86.7-36.3-175.454.60000113.7T267 F268 L301 S302T267-T271 HydrophobicContact CG2-CG2 4.19Å; T267-T271 WeakPolarHBondContact O-CB 3.45Å; T267-T271 WeakPolarHBondContact O-CG2 3.37Å; T267-T271 PolarHBondContact O-N 3.45Å; T267-T271 PolarHBondContact O-OG1 3.47Å; F268-T271 PolarHBondContact O-N 3.34Å; T271-L301 WeakPolarHBondContact CB-O 3.02Å; T271-L301 VanDerWaalsContact CG2-O 3.31Å; T271-L301 WeakPolarHBondContact CG2-O 3.2Å; T271-L301 CarbonylContact O-C 3.55Å; T271-S302 WeakPolarHBondContact O-CA 3.36Å; T271-S302 PolarHBondContact O-N 3.1Å
272W91.8Very high88.8Confident4 Ų432.7 Ų32.72%0.01521%0.206CC..Hα-helixtrans-108-29-176.9-73.192.7000114Y97 M105 F268 Y275 V276 S305Y97-W272 HydrophobicContact CE2-CH2 4.49Å; M105-W272 HydrophobicContact CE-CD2 4.43Å; M105-W272 HydrophobicContact CE-CE3 4.05Å; M105-W272 HydrophobicContact CE-CH2 4.42Å; M105-W272 HydrophobicContact CE-CZ3 4.04Å; M105-W272 HydrophobicContact CG-CD2 4.23Å; M105-W272 HydrophobicContact CG-CG 4.45Å; M105-W272 HydrophobicContact SD-CB 4.41Å; M105-W272 HydrophobicContact SD-CD2 3.44Å; M105-W272 HydrophobicContact SD-CE3 3.52Å; M105-W272 VanDerWaalsContact SD-CE3 3.52Å; M105-W272 HydrophobicContact SD-CG 3.83Å; M105-W272 HydrophobicContact SD-CZ2 4.48Å; M105-W272 HydrophobicContact SD-CZ3 4.1Å; F268-W272 HydrophobicContact CD2-CB 4.39Å; F268-W272 HydrophobicContact CD2-CG 4.42Å; F268-W272 HydrophobicContact CE2-CB 4.23Å; F268-W272 HydrophobicContact CE2-CG 4.33Å; F268-W272 WeakPolarHBondContact O-CB 3.37Å; F268-W272 PolarHBondContact O-N 2.94Å; W272-Y275 HydrophobicContact CE3-CD1 4.2Å; W272-Y275 HydrophobicContact CZ3-CD1 4.05Å; W272-Y275 HydrophobicContact CZ3-CE1 4.38Å; W272-Y275 PolarHBondContact O-N 3.41Å; W272-Y275 VanDerWaalsContact O-N 3.16Å; W272-V276 VanDerWaalsContact O-CG2 3.31Å; W272-V276 WeakPolarHBondContact O-CG2 3.43Å; W272-V276 PolarHBondContact O-N 3.43Å; W272-S305 PolarHBondContact NE1-OG 3.39Å
273G91.4Very high89.4Confident35 Ų3529.1 Ų29.136%0.36119%0.19SC..Hα-helixtrans-56.2-51-179.600000113.7L269 Y275 V276 G277L269-G273 VanDerWaalsContact O-CA 3.25Å; L269-G273 WeakPolarHBondContact O-CA 3.26Å; L269-G273 PolarHBondContact O-N 3.34Å; G273-Y275 VanDerWaalsContact C-N 3.32Å; G273-Y275 PolarHBondContact O-N 2.9Å; G273-V276 PolarHBondContact O-N 3.12Å; G273-G277 PolarHBondContact O-N 3.08Å
274P93.4Very high89.7Confident48 Ų4832.9 Ų32.931%0.31221%0.207SC..Hα-helixtrans-59.7-38.4174.9-27.136.3000113.4L269 I270 G277 V278 V298 L301L269-P274 VanDerWaalsContact O-CD 3.29Å; L269-P274 WeakPolarHBondContact O-CD 3.26Å; I270-P274 WeakPolarHBondContact O-CD 3.34Å; I270-P274 WeakPolarHBondContact O-CG 3.42Å; P274-G277 WeakPolarHBondContact O-CA 3.26Å; P274-G277 PolarHBondContact O-N 3.5Å; P274-V278 WeakPolarHBondContact O-CG2 3.32Å; P274-V278 PolarHBondContact O-N 2.88Å; P274-V298 VanDerWaalsContact C-CG1 3.46Å; P274-V298 HydrophobicContact CB-CB 4.48Å; P274-V298 HydrophobicContact CB-CG1 4.09Å; P274-V298 HydrophobicContact CB-CG2 3.66Å; P274-L301 HydrophobicContact CG-CD1 4.35Å
275Y91Very high90Very high5 Ų541.7 Ų41.72%0.0224%0.24CC..Hα-helixtrans-64.7-44.2179.8-172.8-92.2000111.9W272 G273 G277 V278 V279 V298W272-Y275 HydrophobicContact CE3-CD1 4.2Å; W272-Y275 HydrophobicContact CZ3-CD1 4.05Å; W272-Y275 HydrophobicContact CZ3-CE1 4.38Å; W272-Y275 PolarHBondContact O-N 3.41Å; W272-Y275 VanDerWaalsContact O-N 3.16Å; G273-Y275 VanDerWaalsContact C-N 3.32Å; G273-Y275 PolarHBondContact O-N 2.9Å; Y275-G277 VanDerWaalsContact C-N 3.3Å; Y275-G277 PolarHBondContact O-N 3.46Å; Y275-V278 PolarHBondContact O-N 3.4Å; Y275-V279 HydrophobicContact CD1-CG2 4.18Å; Y275-V279 HydrophobicContact CE1-CG2 3.82Å; Y275-V279 WeakPolarHBondContact O-CG2 3.32Å; Y275-V279 PolarHBondContact O-N 2.87Å; Y275-V298 HydrophobicContact CD2-CG1 4.02Å; Y275-V298 HydrophobicContact CG-CG1 4.35Å; Y275-V298 VanDerWaalsContact N-CG1 3.29Å
276V91.3Very high89.9Confident22 Ų2241 Ų4113%0.13324%0.242CC..Hα-helixtrans-64.4-38.5173.8176.90000110.7V183 I187 W272 G273 V279 C280V183-V276 HydrophobicContact CG1-CG1 4.05Å; V183-V276 HydrophobicContact CG2-CG1 4.37Å; I187-V276 HydrophobicContact CB-CG2 4.4Å; I187-V276 HydrophobicContact CD1-CG2 3.89Å; I187-V276 HydrophobicContact CG1-CG2 3.89Å; I187-V276 HydrophobicContact CG2-CG1 4.14Å; I187-V276 HydrophobicContact CG2-CG2 3.7Å; W272-V276 VanDerWaalsContact O-CG2 3.31Å; W272-V276 WeakPolarHBondContact O-CG2 3.43Å; W272-V276 PolarHBondContact O-N 3.43Å; G273-V276 PolarHBondContact O-N 3.12Å; V276-V279 PolarHBondContact O-N 3.42Å; V276-C280 WeakPolarHBondContact O-CB 3.37Å; V276-C280 PolarHBondContact O-N 3Å; V276-C280 PolarHBondContact O-SG 3.4Å
277G91.8Very high89.5Confident36 Ų3645.4 Ų45.437%0.37126%0.256SS..Hα-helixtrans-55.8-52.3172.800000112.5G273 P274 Y275 C280 T281G273-G277 PolarHBondContact O-N 3.08Å; P274-G277 WeakPolarHBondContact O-CA 3.26Å; P274-G277 PolarHBondContact O-N 3.5Å; Y275-G277 VanDerWaalsContact C-N 3.3Å; Y275-G277 PolarHBondContact O-N 3.46Å; G277-C280 PolarHBondContact O-N 3.02Å; G277-T281 WeakPolarHBondContact O-CG2 3.28Å; G277-T281 PolarHBondContact O-N 3.46Å; G277-T281 PolarHBondContact O-OG1 3.44Å
278V91.2Very high88.9Confident8 Ų847.1 Ų47.15%0.04828%0.278CS..Hα-helixtrans-61.3-47.6178.8172.30000111.6P274 Y275 C280 T281 E282 V290 E295 V298P274-V278 WeakPolarHBondContact O-CG2 3.32Å; P274-V278 PolarHBondContact O-N 2.88Å; Y275-V278 PolarHBondContact O-N 3.4Å; V278-C280 VanDerWaalsContact C-N 3.34Å; V278-C280 PolarHBondContact O-N 3.12Å; V278-T281 WeakPolarHBondContact CA-OG1 3.47Å; V278-T281 PolarHBondContact O-N 2.91Å; V278-T281 VanDerWaalsContact O-N 3.13Å; V278-T281 PolarHBondContact O-OG1 3.42Å; V278-E282 HydrophobicContact CG1-CG 4.38Å; V278-E282 VanDerWaalsContact CG1-OE1 3.31Å; V278-E282 WeakPolarHBondContact CG1-OE1 3.33Å; V278-E282 WeakPolarHBondContact O-CG 3.04Å; V278-E282 PolarHBondContact O-N 3.3Å; V278-V290 HydrophobicContact CG1-CG2 4.45Å; V278-V290 HydrophobicContact CG2-CG1 4.25Å; V278-E295 HydrophobicContact CG1-CG 4.15Å; V278-V298 HydrophobicContact CB-CG1 4.37Å; V278-V298 HydrophobicContact CG2-CB 4.27Å; V278-V298 HydrophobicContact CG2-CG1 3.94Å; V278-V298 HydrophobicContact CG2-CG2 4.16Å
279V89.6Confident88.6Confident0 Ų049.4 Ų49.40%030%0.295CS..Hα-helixtrans-58.6-43.4176.7169.20000111.8W172 A179 V183 Y275 V276 A283W172-V279 HydrophobicContact CB-CG1 4.31Å; W172-V279 HydrophobicContact CD2-CG1 3.68Å; W172-V279 HydrophobicContact CD2-CG2 4.21Å; W172-V279 HydrophobicContact CE3-CG1 3.81Å; W172-V279 HydrophobicContact CG-CG1 3.92Å; W172-V279 HydrophobicContact CG-CG2 4.26Å; W172-V279 HydrophobicContact CZ2-CG2 4.34Å; W172-V279 HydrophobicContact CZ3-CG1 4.3Å; A179-V279 HydrophobicContact CB-CG1 4.41Å; V183-V279 HydrophobicContact CG2-CG1 4.32Å; Y275-V279 HydrophobicContact CD1-CG2 4.18Å; Y275-V279 HydrophobicContact CE1-CG2 3.82Å; Y275-V279 WeakPolarHBondContact O-CG2 3.32Å; Y275-V279 PolarHBondContact O-N 2.87Å; V276-V279 PolarHBondContact O-N 3.42Å; V279-A283 WeakPolarHBondContact O-CB 3Å; V279-A283 PolarHBondContact O-N 3.35Å
280C91.5Very high88.4Confident47 Ų4746.9 Ų46.932%0.31828%0.283SS..Hα-helixtrans-65.4-38.6175.8-73.30000112.2V276 G277 V278 A283 L284V276-C280 WeakPolarHBondContact O-CB 3.37Å; V276-C280 PolarHBondContact O-N 3Å; V276-C280 PolarHBondContact O-SG 3.4Å; G277-C280 PolarHBondContact O-N 3.02Å; V278-C280 VanDerWaalsContact C-N 3.34Å; V278-C280 PolarHBondContact O-N 3.12Å; C280-A283 PolarHBondContact O-N 2.79Å; C280-L284 WeakPolarHBondContact O-CB 3.31Å; C280-L284 VanDerWaalsContact O-CG 3.26Å; C280-L284 WeakPolarHBondContact O-CG 3.44Å; C280-L284 PolarHBondContact O-N 3.23Å
281T90.9Very high88.1Confident41 Ų4145.3 Ų45.325%0.25228%0.282SS..Hα-helixtrans-69.9-40.6176.849.80000112.7G277 V278 A283 L284 W285 V290G277-T281 WeakPolarHBondContact O-CG2 3.28Å; G277-T281 PolarHBondContact O-N 3.46Å; G277-T281 PolarHBondContact O-OG1 3.44Å; V278-T281 WeakPolarHBondContact CA-OG1 3.47Å; V278-T281 PolarHBondContact O-N 2.91Å; V278-T281 VanDerWaalsContact O-N 3.13Å; V278-T281 PolarHBondContact O-OG1 3.42Å; T281-A283 VanDerWaalsContact C-N 3.29Å; T281-A283 PolarHBondContact O-N 3.21Å; T281-L284 PolarHBondContact O-N 3.27Å; T281-W285 HydrophobicContact CG2-CE3 4.13Å; T281-W285 HydrophobicContact CG2-CZ3 4.06Å; T281-W285 PolarHBondContact O-N 3.03Å; T281-V290 VanDerWaalsContact OG1-CG2 3.26Å; T281-V290 WeakPolarHBondContact OG1-CG2 3.23Å
282E88.3Confident87.8Confident6 Ų651.4 Ų51.43%0.02831%0.31CS..Hα-helixtrans-61.9-38.2174.7-76.8177.9-152.400111.3K165 W172 S173 V278 G286K165-E282 WeakPolarHBondContact CE-OE1 3.16Å; K165-E282 IonicContact NZ-OE1 2.67Å; K165-E282 PolarHBondContact NZ-OE1 3.47Å; K165-E282 IonicContact NZ-OE2 2.7Å; W172-E282 HydrophobicContact CB-CB 4.41Å; S173-E282 WeakPolarHBondContact CA-O 3.43Å; S173-E282 WeakPolarHBondContact CB-O 3.35Å; V278-E282 HydrophobicContact CG1-CG 4.38Å; V278-E282 VanDerWaalsContact CG1-OE1 3.31Å; V278-E282 WeakPolarHBondContact CG1-OE1 3.33Å; V278-E282 WeakPolarHBondContact O-CG 3.04Å; V278-E282 PolarHBondContact O-N 3.3Å; E282-G286 CarbonylContact O-C 3.6Å; E282-G286 WeakPolarHBondContact O-CA 3.19Å; E282-G286 PolarHBondContact O-N 3Å
283A89.1Confident87.5Confident19 Ų1958.3 Ų58.316%0.15734%0.342CS..Hα-helixtrans-70.5-32.5176.900000113.5P176 A179 V279 C280 T281P176-A283 HydrophobicContact CB-CB 3.91Å; P176-A283 VanDerWaalsContact CB-O 3.26Å; P176-A283 WeakPolarHBondContact CB-O 3.4Å; A179-A283 HydrophobicContact CB-CB 3.75Å; V279-A283 WeakPolarHBondContact O-CB 3Å; V279-A283 PolarHBondContact O-N 3.35Å; C280-A283 PolarHBondContact O-N 2.79Å; T281-A283 VanDerWaalsContact C-N 3.29Å; T281-A283 PolarHBondContact O-N 3.21Å
284L90.4Very high87.2Confident126 Ų12660.3 Ų60.366%0.6634%0.344SS*.Hα-helixtrans-91.9-35.9-176.9-70.1172.8000114C280 T281C280-L284 WeakPolarHBondContact O-CB 3.31Å; C280-L284 VanDerWaalsContact O-CG 3.26Å; C280-L284 WeakPolarHBondContact O-CG 3.44Å; C280-L284 PolarHBondContact O-N 3.23Å; T281-L284 PolarHBondContact O-N 3.27Å
285W89.1Confident86.9Confident192 Ų19258.5 Ų58.573%0.72733%0.332SS*.Hα-helixtrans-119.1-1.9-173.9-71.2-78.4000114.2T281T281-W285 HydrophobicContact CG2-CE3 4.13Å; T281-W285 HydrophobicContact CG2-CZ3 4.06Å; T281-W285 PolarHBondContact O-N 3.03Å
286G82.3Confident86.7Confident23 Ų2359 Ų5924%0.23734%0.335CS..  trans87.8178.9176.800000114.6E282 S289E282-G286 CarbonylContact O-C 3.6Å; E282-G286 WeakPolarHBondContact O-CA 3.19Å; E282-G286 PolarHBondContact O-N 3Å; G286-S289 PolarHBondContact O-OG 3.19Å
287Q77.2Confident86.6Confident118 Ų11862.5 Ų62.555%0.55135%0.352SS*.THydrogen-bonded Turntrans-67.1140.3179.3-56.4-164.9-58.700111.4S173 S289S173-Q287 WeakPolarHBondContact OG-CG 3.37Å; Q287-S289 VanDerWaalsContact C-N 3.34Å
288G76.3Confident86.6Confident62 Ų6260.9 Ų60.964%0.63934%0.336SS*.THydrogen-bonded Turntrans80.210.2179.600000114.8V290G288-V290 PolarHBondContact O-N 3.49Å
289S82.3Confident86.4Confident56 Ų5660.7 Ų60.739%0.39234%0.335SS..SBendtrans-70.7-10.3169.665.90000113.5G286 Q287G286-S289 PolarHBondContact O-OG 3.19Å; Q287-S289 VanDerWaalsContact C-N 3.34Å
290V84.5Confident86.5Confident25 Ų2563.4 Ų63.415%0.15235%0.345CS..SBendtrans-122.3151.8-176.7-172.40000109.2V278 T281 G288 L294 E295V278-V290 HydrophobicContact CG1-CG2 4.45Å; V278-V290 HydrophobicContact CG2-CG1 4.25Å; T281-V290 VanDerWaalsContact OG1-CG2 3.26Å; T281-V290 WeakPolarHBondContact OG1-CG2 3.23Å; G288-V290 PolarHBondContact O-N 3.49Å; V290-L294 HydrophobicContact CG1-CB 4.02Å; V290-L294 HydrophobicContact CG1-CD2 3.78Å; V290-L294 HydrophobicContact CG1-CG 4.02Å; V290-E295 HydrophobicContact CB-CG 4.18Å; V290-E295 HydrophobicContact CG1-CG 4.13Å
291S86.5Confident86.5Confident72 Ų7263.4 Ų63.450%0.50334%0.342SS..  trans-70.2142.517561.10000111.7E293 L294 E295S291-E293 VanDerWaalsContact C-N 3.29Å; S291-E293 PolarHBondContact O-N 2.89Å; S291-L294 PolarHBondContact O-N 2.94Å; S291-L294 VanDerWaalsContact OG-CB 3.31Å; S291-L294 WeakPolarHBondContact OG-CB 3.5Å; S291-E295 PolarHBondContact O-N 3.34Å; S291-E295 VanDerWaalsContact O-N 3.09Å
292Q85.2Confident86.6Confident134 Ų13461.5 Ų61.563%0.62633%0.33SS*.Hα-helixtrans-56.2-42.1-177.7-65.3-1751.600112.7L164 L294 E295 T296L164-Q292 HydrophobicContact CD1-CB 4.25Å; L164-Q292 HydrophobicContact CD1-CG 4Å; L164-Q292 HydrophobicContact CD2-CB 3.71Å; L164-Q292 HydrophobicContact CD2-CG 3.85Å; Q292-L294 VanDerWaalsContact C-N 3.31Å; Q292-L294 PolarHBondContact O-N 3.04Å; Q292-E295 PolarHBondContact O-N 2.83Å; Q292-T296 PolarHBondContact O-N 3.5Å; Q292-T296 VanDerWaalsContact O-N 3.14Å; Q292-T296 PolarHBondContact O-OG1 3.46Å
293E83.6Confident86.7Confident150 Ų15061.4 Ų61.470%0.70133%0.329SS*.Hα-helixtrans-60.9-38.7176.5-61.6178.8176.100112.4S291 L297S291-E293 VanDerWaalsContact C-N 3.29Å; S291-E293 PolarHBondContact O-N 2.89Å; E293-L297 VanDerWaalsContact O-CB 3.23Å; E293-L297 WeakPolarHBondContact O-CB 3.47Å; E293-L297 PolarHBondContact O-N 2.85Å
294L87Confident86.8Confident77 Ų7762.4 Ų62.440%0.40334%0.335SS..Hα-helixtrans-72.2-40.2-179.9-177.259.4000110.8V290 S291 Q292 T296 L297 V298V290-L294 HydrophobicContact CG1-CB 4.02Å; V290-L294 HydrophobicContact CG1-CD2 3.78Å; V290-L294 HydrophobicContact CG1-CG 4.02Å; S291-L294 PolarHBondContact O-N 2.94Å; S291-L294 VanDerWaalsContact OG-CB 3.31Å; S291-L294 WeakPolarHBondContact OG-CB 3.5Å; Q292-L294 VanDerWaalsContact C-N 3.31Å; Q292-L294 PolarHBondContact O-N 3.04Å; L294-T296 PolarHBondContact O-N 3.36Å; L294-L297 HydrophobicContact CD1-CD2 4.29Å; L294-L297 PolarHBondContact O-N 2.91Å; L294-V298 HydrophobicContact CD1-CG2 3.67Å; L294-V298 HydrophobicContact CG-CG2 4.12Å; L294-V298 WeakPolarHBondContact O-CB 3.25Å; L294-V298 WeakPolarHBondContact O-CG2 3.42Å; L294-V298 PolarHBondContact O-N 3.12Å
295E85.9Confident86.8Confident10 Ų1056.4 Ų56.45%0.04730%0.304CS..Hα-helixtrans-58.5-47.3173.6-70.1-167.8-140.600112.3L164 K165 V278 V290 S291 Q292 V298 A299L164-E295 HydrophobicContact CB-CB 4.18Å; L164-E295 HydrophobicContact CD1-CB 4.19Å; L164-E295 HydrophobicContact CD1-CG 4.34Å; L164-E295 WeakPolarHBondContact CD1-OE2 3.41Å; K165-E295 IonicContact NZ-OE2 3.99Å; K165-E295 PolarHBondContact NZ-OE2 2.9Å; V278-E295 HydrophobicContact CG1-CG 4.15Å; V290-E295 HydrophobicContact CB-CG 4.18Å; V290-E295 HydrophobicContact CG1-CG 4.13Å; S291-E295 PolarHBondContact O-N 3.34Å; S291-E295 VanDerWaalsContact O-N 3.09Å; Q292-E295 PolarHBondContact O-N 2.83Å; E295-V298 PolarHBondContact O-N 3.39Å; E295-A299 PolarHBondContact O-N 3Å
296T86.9Confident86.9Confident15 Ų1547.3 Ų47.39%0.09227%0.269CS..Hα-helixtrans-61.7-50.5177.2-56.30000111.4L164 Q292 L294 V298 A299 W300L164-T296 PolarHBondContact O-OG1 3.03Å; Q292-T296 PolarHBondContact O-N 3.5Å; Q292-T296 VanDerWaalsContact O-N 3.14Å; Q292-T296 PolarHBondContact O-OG1 3.46Å; L294-T296 PolarHBondContact O-N 3.36Å; T296-V298 VanDerWaalsContact C-N 3.28Å; T296-V298 PolarHBondContact O-N 3.25Å; T296-A299 PolarHBondContact O-N 3.23Å; T296-W300 HydrophobicContact CG2-CZ2 4.17Å; T296-W300 PolarHBondContact O-N 3.32Å; T296-W300 VanDerWaalsContact O-N 3.08Å
297L88.8Confident87.4Confident95 Ų9547.3 Ų47.350%0.49727%0.265SS..Hα-helixtrans-60.6-38.5-179.7177.9139.2000112.1E293 L294 W300 L301E293-L297 VanDerWaalsContact O-CB 3.23Å; E293-L297 WeakPolarHBondContact O-CB 3.47Å; E293-L297 PolarHBondContact O-N 2.85Å; L294-L297 HydrophobicContact CD1-CD2 4.29Å; L294-L297 PolarHBondContact O-N 2.91Å; L297-W300 PolarHBondContact O-N 2.95Å; L297-L301 HydrophobicContact CD2-CD1 3.68Å; L297-L301 HydrophobicContact CD2-CG 4.39Å; L297-L301 WeakPolarHBondContact O-CG 3.33Å; L297-L301 PolarHBondContact O-N 3.43Å
298V91.4Very high87.9Confident3 Ų343.2 Ų43.22%0.01825%0.248CC..Hα-helixtrans-72.1-36.3-179.9166.10000112.2P274 Y275 V278 L294 E295 T296 W300 L301 S302P274-V298 VanDerWaalsContact C-CG1 3.46Å; P274-V298 HydrophobicContact CB-CB 4.48Å; P274-V298 HydrophobicContact CB-CG1 4.09Å; P274-V298 HydrophobicContact CB-CG2 3.66Å; Y275-V298 HydrophobicContact CD2-CG1 4.02Å; Y275-V298 HydrophobicContact CG-CG1 4.35Å; Y275-V298 VanDerWaalsContact N-CG1 3.29Å; V278-V298 HydrophobicContact CB-CG1 4.37Å; V278-V298 HydrophobicContact CG2-CB 4.27Å; V278-V298 HydrophobicContact CG2-CG1 3.94Å; V278-V298 HydrophobicContact CG2-CG2 4.16Å; L294-V298 HydrophobicContact CD1-CG2 3.67Å; L294-V298 HydrophobicContact CG-CG2 4.12Å; L294-V298 WeakPolarHBondContact O-CB 3.25Å; L294-V298 WeakPolarHBondContact O-CG2 3.42Å; L294-V298 PolarHBondContact O-N 3.12Å; E295-V298 PolarHBondContact O-N 3.39Å; T296-V298 VanDerWaalsContact C-N 3.28Å; T296-V298 PolarHBondContact O-N 3.25Å; V298-W300 VanDerWaalsContact C-N 3.31Å; V298-L301 PolarHBondContact O-N 2.91Å; V298-S302 PolarHBondContact O-N 3.21Å
299A88.8Confident88.3Confident4 Ų440.5 Ų40.53%0.03322%0.219CC..Hα-helixtrans-63.5-36.9169.800000112K165 E295 T296 S302 F303K165-A299 HydrophobicContact CB-CB 4.06Å; K165-A299 HydrophobicContact CG-CB 4.17Å; E295-A299 PolarHBondContact O-N 3Å; T296-A299 PolarHBondContact O-N 3.23Å; A299-S302 PolarHBondContact O-N 3.07Å; A299-S302 PolarHBondContact O-OG 3.22Å; A299-F303 HydrophobicContact CB-CE2 4.5Å; A299-F303 VanDerWaalsContact O-CD2 3.25Å; A299-F303 WeakPolarHBondContact O-CD2 3.21Å; A299-F303 WeakPolarHBondContact O-CG 3.31Å; A299-F303 PolarHBondContact O-N 2.94Å
300W90.7Very high88.3Confident56 Ų5638.3 Ų38.321%0.21220%0.204CC..Hα-helixtrans-70.5-37.6176.6-6922.8000112.7E20 S23 T296 L297 V298 S302 F303 C304E20-W300 HydrophobicContact CB-CH2 4.29Å; E20-W300 HydrophobicContact CB-CZ2 3.71Å; E20-W300 HydrophobicContact CG-CH2 4.32Å; E20-W300 HydrophobicContact CG-CZ2 3.78Å; S23-W300 WeakPolarHBondContact OG-CZ3 3.31Å; T296-W300 HydrophobicContact CG2-CZ2 4.17Å; T296-W300 PolarHBondContact O-N 3.32Å; T296-W300 VanDerWaalsContact O-N 3.08Å; L297-W300 PolarHBondContact O-N 2.95Å; V298-W300 VanDerWaalsContact C-N 3.31Å; W300-S302 VanDerWaalsContact C-N 3.28Å; W300-S302 PolarHBondContact O-N 3.23Å; W300-F303 PolarHBondContact O-N 3.37Å; W300-C304 WeakPolarHBondContact O-CB 3.48Å; W300-C304 PolarHBondContact O-N 2.95Å; W300-C304 PolarHBondContact O-SG 2.89Å; W300-C304 VanDerWaalsContact O-SG 3.33Å
301L92Very high88.1Confident47 Ų4741.6 Ų41.625%0.24622%0.22CC..Hα-helixtrans-59.3-39.6174.5-77.3172.7000111.5I270 T271 P274 L297 V298 C304 S305I270-L301 HydrophobicContact CG2-CD2 4.42Å; T271-L301 WeakPolarHBondContact CB-O 3.02Å; T271-L301 VanDerWaalsContact CG2-O 3.31Å; T271-L301 WeakPolarHBondContact CG2-O 3.2Å; T271-L301 CarbonylContact O-C 3.55Å; P274-L301 HydrophobicContact CG-CD1 4.35Å; L297-L301 HydrophobicContact CD2-CD1 3.68Å; L297-L301 HydrophobicContact CD2-CG 4.39Å; L297-L301 WeakPolarHBondContact O-CG 3.33Å; L297-L301 PolarHBondContact O-N 3.43Å; V298-L301 PolarHBondContact O-N 2.91Å; L301-C304 PolarHBondContact O-N 3.01Å; L301-S305 PolarHBondContact O-N 3.45Å
302S91.6Very high87.9Confident1 Ų138.6 Ų38.61%0.00720%0.198CC..Hα-helixtrans-68-41.6175.379.30000112Y97 T271 V298 A299 W300 C304 S305Y97-S302 PolarHBondContact OH-OG 2.69Å; T271-S302 WeakPolarHBondContact O-CA 3.36Å; T271-S302 PolarHBondContact O-N 3.1Å; V298-S302 PolarHBondContact O-N 3.21Å; A299-S302 PolarHBondContact O-N 3.07Å; A299-S302 PolarHBondContact O-OG 3.22Å; W300-S302 VanDerWaalsContact C-N 3.28Å; W300-S302 PolarHBondContact O-N 3.23Å; S302-C304 PolarHBondContact O-N 2.72Å; S302-S305 WeakPolarHBondContact O-CB 3.48Å; S302-S305 PolarHBondContact O-N 2.89Å; S302-S305 PolarHBondContact O-OG 3.48Å; S302-S305 VanDerWaalsContact O-OG 3.07Å
303F91.8Very high87.4Confident4 Ų433.7 Ų33.72%0.01817%0.174CC..Hα-helixtrans-63.8-37.7174.5-58.1-33.4000112.9I27 L71 V74 Y97 T167 A299 W300 S305 A306I27-F303 HydrophobicContact CG2-CB 4.08Å; L71-F303 HydrophobicContact CD2-CB 4.24Å; L71-F303 HydrophobicContact CD2-CD1 3.62Å; L71-F303 HydrophobicContact CD2-CD2 4.41Å; L71-F303 HydrophobicContact CD2-CE1 4.03Å; L71-F303 HydrophobicContact CD2-CG 3.84Å; V74-F303 HydrophobicContact CG1-CE2 3.99Å; V74-F303 HydrophobicContact CG1-CZ 4.12Å; Y97-F303 HydrophobicContact CD2-CE1 4.41Å; Y97-F303 HydrophobicContact CE2-CD1 4.32Å; Y97-F303 AromaticContact CE2-CE1 3.84Å; Y97-F303 HydrophobicContact CE2-CE1 3.84Å; T167-F303 HydrophobicContact CG2-CZ 4.38Å; A299-F303 HydrophobicContact CB-CE2 4.5Å; A299-F303 VanDerWaalsContact O-CD2 3.25Å; A299-F303 WeakPolarHBondContact O-CD2 3.21Å; A299-F303 WeakPolarHBondContact O-CG 3.31Å; A299-F303 PolarHBondContact O-N 2.94Å; W300-F303 PolarHBondContact O-N 3.37Å; F303-S305 PolarHBondContact O-N 3.17Å; F303-A306 WeakPolarHBondContact O-CB 3.29Å; F303-A306 PolarHBondContact O-N 2.89Å
304C91.2Very high86.8Confident40 Ų4026.5 Ų26.527%0.2714%0.141SC..Hα-helixtrans-61.2-22.5176.3-80.20000113.4W300 L301 S302 A306 V307 C308W300-C304 WeakPolarHBondContact O-CB 3.48Å; W300-C304 PolarHBondContact O-N 2.95Å; W300-C304 PolarHBondContact O-SG 2.89Å; W300-C304 VanDerWaalsContact O-SG 3.33Å; L301-C304 PolarHBondContact O-N 3.01Å; S302-C304 PolarHBondContact O-N 2.72Å; C304-A306 PolarHBondContact O-N 3.08Å; C304-V307 WeakPolarHBondContact O-CB 3.49Å; C304-V307 PolarHBondContact O-N 3.11Å; C304-C308 PolarHBondContact O-N 2.86Å; C304-C308 VanDerWaalsContact O-N 3.13Å; C304-C308 PolarHBondContact O-SG 3.48Å; C304-C308 VanDerWaalsContact O-SG 3.36Å
305S90.6Very high85.8Confident1 Ų126.5 Ų26.51%0.00714%0.141CC..Hα-helixtrans-56.3-38.4175.987.50000111.5W272 L301 S302 F303 V307 C308 H309W272-S305 PolarHBondContact NE1-OG 3.39Å; L301-S305 PolarHBondContact O-N 3.45Å; S302-S305 WeakPolarHBondContact O-CB 3.48Å; S302-S305 PolarHBondContact O-N 2.89Å; S302-S305 PolarHBondContact O-OG 3.48Å; S302-S305 VanDerWaalsContact O-OG 3.07Å; F303-S305 PolarHBondContact O-N 3.17Å; S305-V307 PolarHBondContact O-N 3.29Å; S305-C308 PolarHBondContact O-N 2.63Å; S305-C308 VanDerWaalsContact O-N 3.1Å; S305-H309 PolarHBondContact O-CD2 3.04Å; S305-H309 PolarHBondContact O-N 3.18Å; S305-H309 PolarHBondContact O-NE2 3.1Å
306A91.3Very high84.8Confident0 Ų031.3 Ų31.30%016%0.158CC..Hα-helixtrans-62.4-28.717800000113.6A31 N35 N63 L66 F303 C304 P310A31-A306 HydrophobicContact CB-CB 3.97Å; N35-A306 PolarHBondContact ND2-O 3.3Å; N63-A306 HydrophobicContact CB-CB 4.09Å; N63-A306 WeakPolarHBondContact OD1-CA 3.49Å; N63-A306 WeakPolarHBondContact OD1-CB 3.35Å; L66-A306 HydrophobicContact CD2-CB 4.16Å; F303-A306 WeakPolarHBondContact O-CB 3.29Å; F303-A306 PolarHBondContact O-N 2.89Å; C304-A306 PolarHBondContact O-N 3.08Å; A306-P310 WeakPolarHBondContact O-CD 3.3Å
307V91.9Very high83.9Confident24 Ų2433.3 Ų33.315%0.14517%0.169CC..Hα-helixtrans-80.5-35.2174.8-174.80000110.9I27 L30 A31 C304 S305 H309 P310I27-V307 HydrophobicContact CG2-CG2 4.06Å; L30-V307 HydrophobicContact CB-CG1 4.02Å; L30-V307 HydrophobicContact CB-CG2 4.13Å; A31-V307 HydrophobicContact CB-CG2 3.97Å; C304-V307 WeakPolarHBondContact O-CB 3.49Å; C304-V307 PolarHBondContact O-N 3.11Å; S305-V307 PolarHBondContact O-N 3.29Å; V307-H309 PolarHBondContact O-N 3.37Å; V307-P310 WeakPolarHBondContact O-CD 3.18Å
308C88Confident82.8Confident31 Ų3135.8 Ų35.821%0.20918%0.175CC..Hα-helixtrans-66.1-37.2-180-62.40000113.1T267 C304 S305 L311 I312T267-C308 HydrophobicContact CG2-CB 3.53Å; C304-C308 PolarHBondContact O-N 2.86Å; C304-C308 VanDerWaalsContact O-N 3.13Å; C304-C308 PolarHBondContact O-SG 3.48Å; C304-C308 VanDerWaalsContact O-SG 3.36Å; S305-C308 PolarHBondContact O-N 2.63Å; S305-C308 VanDerWaalsContact O-N 3.1Å; C308-L311 PolarHBondContact O-N 3.39Å; C308-L311 VanDerWaalsContact O-N 3.12Å; C308-I312 HydrophobicContact CB-CD1 4.05Å; C308-I312 VanDerWaalsContact O-CG1 3.26Å; C308-I312 WeakPolarHBondContact O-CG1 3.33Å; C308-I312 PolarHBondContact O-N 3.06Å
309H83.8Confident81.7Confident5 Ų538.8 Ų38.82%0.02319%0.194CC..Hα-helixtrans-59.9-44.4-175.7-59.7-52.4000113.5L59 N63 S305 V307 L311 I312 Y313L59-H309 HydrophobicContact CD2-CB 4.19Å; L59-H309 HydrophobicContact CG-CB 4.41Å; N63-H309 PolarHBondContact ND2-CD2 3.06Å; S305-H309 PolarHBondContact O-CD2 3.04Å; S305-H309 PolarHBondContact O-N 3.18Å; S305-H309 PolarHBondContact O-NE2 3.1Å; V307-H309 PolarHBondContact O-N 3.37Å; H309-L311 PolarHBondContact O-N 3.16Å; H309-I312 PolarHBondContact O-N 2.9Å; H309-Y313 HydrophobicContact CB-CD2 4.48Å; H309-Y313 WeakPolarHBondContact O-CD2 3.49Å; H309-Y313 PolarHBondContact O-N 3.42Å
310P82.6Confident80.6Confident10 Ų1039 Ų397%0.06519%0.194CC..Iπ-helixtrans-57.9-40.1170.6-30.936.4000115.7N35 I38 A306 V307 G314 L315N35-P310 HydrophobicContact CB-CG 4.42Å; N35-P310 WeakPolarHBondContact OD1-CG 3.18Å; I38-P310 HydrophobicContact CD1-CB 3.56Å; I38-P310 HydrophobicContact CD1-CG 4.18Å; A306-P310 WeakPolarHBondContact O-CD 3.3Å; V307-P310 WeakPolarHBondContact O-CD 3.18Å; P310-G314 VanDerWaalsContact O-CA 3.22Å; P310-G314 WeakPolarHBondContact O-CA 3.42Å; P310-G314 PolarHBondContact O-N 3.43Å; P310-L315 PolarHBondContact O-N 2.99Å
311L81.1Confident80Confident94 Ų9441 Ų4149%0.49220%0.202SC..Iπ-helixtrans-66.3-43.7178.9-58.2175.3000110.9C308 H309 L315C308-L311 PolarHBondContact O-N 3.39Å; C308-L311 VanDerWaalsContact O-N 3.12Å; H309-L311 PolarHBondContact O-N 3.16Å; L311-L315 HydrophobicContact CD2-CD1 3.61Å
312I81.7Confident79.1Confident10 Ų1042.8 Ų42.85%0.05121%0.208CC..Iπ-helixtrans-73.9-45.2-176-63.4166.1000112T260 V263 V264 T267 C308 H309 W316T260-I312 HydrophobicContact CG2-CG2 4.46Å; V263-I312 HydrophobicContact CG1-CD1 3.99Å; V263-I312 HydrophobicContact CG1-CG1 3.84Å; V264-I312 HydrophobicContact CG2-CG2 3.6Å; T267-I312 HydrophobicContact CG2-CD1 3.94Å; T267-I312 WeakPolarHBondContact OG1-CD1 3.26Å; C308-I312 HydrophobicContact CB-CD1 4.05Å; C308-I312 VanDerWaalsContact O-CG1 3.26Å; C308-I312 WeakPolarHBondContact O-CG1 3.33Å; C308-I312 PolarHBondContact O-N 3.06Å; H309-I312 PolarHBondContact O-N 2.9Å; I312-W316 WeakPolarHBondContact O-CB 3.46Å
313Y74.9Confident78.3Confident30 Ų3043.6 Ų43.612%0.11821%0.211CC..Iπ-helixtrans-99.6-32.8-173.4-64.3-76.4000113.8V56 L59 L108 I111 V264 H309 N317V56-Y313 HydrophobicContact CG1-CG 4.21Å; V56-Y313 HydrophobicContact CG2-CD1 3.98Å; V56-Y313 HydrophobicContact CG2-CE1 4.49Å; V56-Y313 HydrophobicContact CG2-CG 4.37Å; L59-Y313 HydrophobicContact CD2-CD2 3.86Å; L59-Y313 HydrophobicContact CD2-CE2 3.49Å; L59-Y313 VanDerWaalsContact CD2-CE2 3.49Å; L108-Y313 HydrophobicContact CD2-CE2 4.39Å; I111-Y313 HydrophobicContact CG2-CE1 4.15Å; V264-Y313 WeakPolarHBondContact CG1-OH 3.46Å; V264-Y313 HydrophobicContact CG2-CE1 4.19Å; V264-Y313 HydrophobicContact CG2-CE2 4.33Å; V264-Y313 VanDerWaalsContact CG2-OH 3.24Å; V264-Y313 WeakPolarHBondContact CG2-OH 3.27Å; H309-Y313 HydrophobicContact CB-CD2 4.48Å; H309-Y313 WeakPolarHBondContact O-CD2 3.49Å; H309-Y313 PolarHBondContact O-N 3.42Å; Y313-N317 WeakPolarHBondContact O-CB 3.48Å
314G69.8Low77.4Confident0 Ų044.3 Ų44.30%022%0.215CC..Iπ-helixtrans-80.3-53.9179.700000113.3P310 R321P310-G314 VanDerWaalsContact O-CA 3.22Å; P310-G314 WeakPolarHBondContact O-CA 3.42Å; P310-G314 PolarHBondContact O-N 3.43Å; G314-R321 PolarHBondContact O-N 3.02Å
315L67.5Low76.7Confident77 Ų7744.8 Ų44.840%0.40322%0.215SC..Iπ-helixtrans-79.7-35.3-175.5-59.5-178.3000113.2P310 L311 N317 R321 L324P310-L315 PolarHBondContact O-N 2.99Å; L311-L315 HydrophobicContact CD2-CD1 3.61Å; L315-N317 PolarHBondContact O-N 3.4Å; L315-R321 HydrophobicContact CD2-CG 4.47Å; L315-R321 VanDerWaalsContact O-CD 3.32Å; L315-R321 WeakPolarHBondContact O-CD 3.45Å; L315-L324 HydrophobicContact CD2-CD2 3.78Å
316W64.9Low75.9Confident111 Ų11145.2 Ų45.242%0.4222%0.22SC..SBendtrans-69.5-33.4-179.3-151.4-68.1000112.7V259 T260 V263 I312 K318V259-W316 HydrophobicContact CB-CZ2 4.09Å; V259-W316 HydrophobicContact CG1-CH2 3.57Å; V259-W316 HydrophobicContact CG1-CZ2 3.54Å; T260-W316 HydrophobicContact CG2-CG 4.37Å; T260-W316 PolarHBondContact OG1-NE1 2.92Å; V263-W316 HydrophobicContact CG2-CH2 4.09Å; V263-W316 HydrophobicContact CG2-CZ3 4.17Å; I312-W316 WeakPolarHBondContact O-CB 3.46Å; W316-K318 PolarHBondContact O-N 3.16Å
317N67.1Low75.1Confident57 Ų5748.5 Ų48.531%0.30524%0.236SC..SBendtrans-76.1106.6176.8-174.3-25000110.3Y313 L315 T319 V320 R321Y313-N317 WeakPolarHBondContact O-CB 3.48Å; L315-N317 PolarHBondContact O-N 3.4Å; N317-T319 PolarHBondContact O-N 2.93Å; N317-T319 PolarHBondContact OD1-N 3.47Å; N317-V320 HydrophobicContact CB-CB 4.11Å; N317-V320 HydrophobicContact CB-CG2 4.07Å; N317-V320 PolarHBondContact O-N 3.49Å; N317-V320 VanDerWaalsContact O-N 3.13Å; N317-R321 WeakPolarHBondContact O-CB 3.4Å; N317-R321 PolarHBondContact O-N 3.26Å
318K66.8Low74.4Confident147 Ų14750.5 Ų50.564%0.63925%0.25SS*.Hα-helixtrans-54.1-26.4-179-69.6-172.5177.7-173.40114.6W316 K322W316-K318 PolarHBondContact O-N 3.16Å; K318-K322 VanDerWaalsContact O-CG 3.27Å; K318-K322 WeakPolarHBondContact O-CG 3.39Å; K318-K322 PolarHBondContact O-N 3.4Å
319T66.7Low73.8Confident66 Ų6657 Ų5741%0.40528%0.275SS..Hα-helixtrans-79.6-49.9177.6-52.90000110.6L48 N317 R321 K322 E323L48-T319 HydrophobicContact CD2-CG2 3.81Å; N317-T319 PolarHBondContact O-N 2.93Å; N317-T319 PolarHBondContact OD1-N 3.47Å; T319-R321 PolarHBondContact O-N 2.92Å; T319-K322 PolarHBondContact O-N 2.92Å; T319-E323 PolarHBondContact O-N 3.39Å
320V66.9Low72.8Confident7 Ų758.6 Ų58.64%0.04229%0.293CS..Hα-helixtrans-62.7-45178.2-179.80000110.6N317 K322 E323 L324N317-V320 HydrophobicContact CB-CB 4.11Å; N317-V320 HydrophobicContact CB-CG2 4.07Å; N317-V320 PolarHBondContact O-N 3.49Å; N317-V320 VanDerWaalsContact O-N 3.13Å; V320-K322 VanDerWaalsContact C-N 3.28Å; V320-K322 PolarHBondContact O-N 3.07Å; V320-E323 PolarHBondContact O-N 3.32Å; V320-L324 VanDerWaalsContact O-CB 3.25Å; V320-L324 WeakPolarHBondContact O-CB 3.43Å; V320-L324 PolarHBondContact O-N 3.07Å
321R78.1Confident71.8Confident98 Ų9862.4 Ų62.437%0.3731%0.313SS..Hα-helixtrans-56.6-38.2175.1-174.8177.264.598.11.8112.8G314 L315 N317 T319 L325G314-R321 PolarHBondContact O-N 3.02Å; L315-R321 HydrophobicContact CD2-CG 4.47Å; L315-R321 VanDerWaalsContact O-CD 3.32Å; L315-R321 WeakPolarHBondContact O-CD 3.45Å; N317-R321 WeakPolarHBondContact O-CB 3.4Å; N317-R321 PolarHBondContact O-N 3.26Å; T319-R321 PolarHBondContact O-N 2.92Å; R321-L325 HydrophobicContact CG-CD1 3.49Å; R321-L325 VanDerWaalsContact CG-CD1 3.49Å; R321-L325 WeakPolarHBondContact O-CD1 3.32Å; R321-L325 PolarHBondContact O-N 3.04Å
322K72.8Confident70.5Confident85 Ų8570 Ų7037%0.3734%0.335SS..Hα-helixtrans-67.3-46.6178.8-84.4-179.4174.1-158.40112.1K318 T319 V320 L324 L325 G326K318-K322 VanDerWaalsContact O-CG 3.27Å; K318-K322 WeakPolarHBondContact O-CG 3.39Å; K318-K322 PolarHBondContact O-N 3.4Å; T319-K322 PolarHBondContact O-N 2.92Å; V320-K322 VanDerWaalsContact C-N 3.28Å; V320-K322 PolarHBondContact O-N 3.07Å; K322-L324 VanDerWaalsContact C-N 3.34Å; K322-L325 PolarHBondContact O-N 3.38Å; K322-G326 PolarHBondContact O-N 3.21Å
323E75.2Confident68.9Low18 Ų1879 Ų798%0.08437%0.37CS..Hα-helixtrans-66-39177.3-64.7-69.113800111.4T41 R45 Y47 L48 T319 V320 G326 M327T41-E323 HydrophobicContact CG2-CB 3.8Å; R45-E323 IonicContact CZ-OE2 2.61Å; R45-E323 IonicContact NE-OE2 3.7Å; R45-E323 PolarHBondContact NE-OE2 3.45Å; R45-E323 IonicContact NH2-OE2 2.97Å; Y47-E323 PolarHBondContact OH-OE1 3.48Å; Y47-E323 VanDerWaalsContact OH-OE1 3.08Å; Y47-E323 PolarHBondContact OH-OE2 3.15Å; L48-E323 HydrophobicContact CD1-CB 4.46Å; L48-E323 HydrophobicContact CD1-CG 4.12Å; T319-E323 PolarHBondContact O-N 3.39Å; V320-E323 PolarHBondContact O-N 3.32Å; E323-G326 PolarHBondContact O-N 2.85Å; E323-M327 WeakPolarHBondContact O-CG 3.46Å; E323-M327 PolarHBondContact O-N 2.91Å
324L73.6Confident67.7Low19 Ų1981.7 Ų81.710%0.09938%0.38CS..Hα-helixtrans-59.4-49.4173.4179.166.8000111.8L37 L315 V320 K322 G326 M327 C328L37-L324 HydrophobicContact CB-CD1 3.74Å; L37-L324 HydrophobicContact CD1-CD1 4.32Å; L37-L324 HydrophobicContact CD2-CD1 4.36Å; L37-L324 HydrophobicContact CG-CD1 4.37Å; L315-L324 HydrophobicContact CD2-CD2 3.78Å; V320-L324 VanDerWaalsContact O-CB 3.25Å; V320-L324 WeakPolarHBondContact O-CB 3.43Å; V320-L324 PolarHBondContact O-N 3.07Å; K322-L324 VanDerWaalsContact C-N 3.34Å; L324-G326 VanDerWaalsContact C-N 3.35Å; L324-G326 PolarHBondContact O-N 2.92Å; L324-M327 PolarHBondContact O-N 3.47Å; L324-C328 PolarHBondContact O-N 2.92Å; L324-C328 PolarHBondContact O-SG 3.32Å; L324-C328 VanDerWaalsContact O-SG 3.34Å
325L76.3Confident66.7Low50 Ų5090.7 Ų90.726%0.26241%0.414SS..Hα-helixtrans-65.2-36.6175.2-91.5104.8000112.3R321 K322 M327 C328 F329R321-L325 HydrophobicContact CG-CD1 3.49Å; R321-L325 VanDerWaalsContact CG-CD1 3.49Å; R321-L325 WeakPolarHBondContact O-CD1 3.32Å; R321-L325 PolarHBondContact O-N 3.04Å; K322-L325 PolarHBondContact O-N 3.38Å; L325-M327 VanDerWaalsContact C-N 3.31Å; L325-M327 PolarHBondContact O-N 2.92Å; L325-C328 PolarHBondContact O-N 2.81Å; L325-F329 HydrophobicContact CB-CD2 4.18Å; L325-F329 HydrophobicContact CD2-CD2 3.87Å; L325-F329 HydrophobicContact CD2-CE2 3.95Å; L325-F329 HydrophobicContact CG-CD2 3.95Å; L325-F329 HydrophobicContact CG-CE2 4.03Å; L325-F329 WeakPolarHBondContact O-CB 3.34Å; L325-F329 WeakPolarHBondContact O-CD2 3.24Å; L325-F329 PolarHBondContact O-N 2.85Å
326G73.1Confident65.7Low11 Ų1194.5 Ų94.511%0.11343%0.43CS..Hα-helixtrans-61.6-38.2173.800000112.7K322 E323 L324 G330K322-G326 PolarHBondContact O-N 3.21Å; E323-G326 PolarHBondContact O-N 2.85Å; L324-G326 VanDerWaalsContact C-N 3.35Å; L324-G326 PolarHBondContact O-N 2.92Å; G326-G330 CarbonylContact O-C 3.58Å; G326-G330 VanDerWaalsContact O-CA 3.31Å; G326-G330 WeakPolarHBondContact O-CA 3.35Å; G326-G330 PolarHBondContact O-N 2.03Å
327M74.3Confident64.9Low69 Ų6992.7 Ų92.734%0.3443%0.434SS..Hα-helixtrans-70.5-38.5174.2-75.7178.350.900113.2A40 T41 E323 L324 L325A40-M327 HydrophobicContact CB-CE 4.4Å; T41-M327 HydrophobicContact CG2-SD 4.18Å; T41-M327 PolarHBondContact OG1-SD 3.49Å; E323-M327 WeakPolarHBondContact O-CG 3.46Å; E323-M327 PolarHBondContact O-N 2.91Å; L324-M327 PolarHBondContact O-N 3.47Å; L325-M327 VanDerWaalsContact C-N 3.31Å; L325-M327 PolarHBondContact O-N 2.92Å
328C77Confident64.1Low66 Ų6693.7 Ų93.745%0.44644%0.436SS..Hα-helixtrans-82.1-32.2-177.9-64.70000114.2L324 L325L324-C328 PolarHBondContact O-N 2.92Å; L324-C328 PolarHBondContact O-SG 3.32Å; L324-C328 VanDerWaalsContact O-SG 3.34Å; L325-C328 PolarHBondContact O-N 2.81Å
329F76.5Confident63.3Low168 Ų16889.6 Ų89.674%0.73743%0.43SS*.Hα-helixtrans-118.6-1.5-171.8-59.8-78000114.3L325L325-F329 HydrophobicContact CB-CD2 4.18Å; L325-F329 HydrophobicContact CD2-CD2 3.87Å; L325-F329 HydrophobicContact CD2-CE2 3.95Å; L325-F329 HydrophobicContact CG-CD2 3.95Å; L325-F329 HydrophobicContact CG-CE2 4.03Å; L325-F329 WeakPolarHBondContact O-CB 3.34Å; L325-F329 WeakPolarHBondContact O-CD2 3.24Å; L325-F329 PolarHBondContact O-N 2.85Å
330G62.2Low62.6Low38 Ų3890.9 Ų90.939%0.39244%0.437SS..  trans98.9139.917200000115.1G326 R332G326-G330 CarbonylContact O-C 3.58Å; G326-G330 VanDerWaalsContact O-CA 3.31Å; G326-G330 WeakPolarHBondContact O-CA 3.35Å; G326-G330 PolarHBondContact O-N 2.03Å; G330-R332 PolarHBondContact O-N 3.49Å; G330-R332 VanDerWaalsContact O-N 3.15Å
331D60.5Low61.6Low90 Ų9099.3 Ų99.348%0.48147%0.468SS..G310 helixtrans-69.9-13.7-168.5-145.721.1000114.4Y333 Y334 R335D331-Y333 PolarHBondContact O-N 3.01Å; D331-Y334 PolarHBondContact O-N 3.28Å; D331-R335 PolarHBondContact O-N 2.95Å
332R54.6Low59.9Low252 Ų25299.8 Ų99.895%0.95148%0.475SS*.G310 helixtrans-69-24.3-169.9-86.3-167.1-92.2-148.1-2.5115.2G330G330-R332 PolarHBondContact O-N 3.49Å; G330-R332 VanDerWaalsContact O-N 3.15Å
333Y47.8Very low58.6Low201 Ų201105 Ų10579%0.78849%0.492SS*.G310 helixtrans-92.8-15.5-179.8-161.4-98.6000114D331D331-Y333 PolarHBondContact O-N 3.01Å
334Y49.5Very low57.3Low86 Ų86107.9 Ų107.934%0.33751%0.511SS..THydrogen-bonded Turntrans-111.2-16.3-169.3-86.5-78.8000115.5D331 E336 S337D331-Y334 PolarHBondContact O-N 3.28Å; Y334-E336 VanDerWaalsContact C-N 3.3Å; Y334-E336 PolarHBondContact O-N 2.98Å; Y334-S337 PolarHBondContact O-N 2.96Å
335R48.5Very low56Low188 Ų188110.2 Ų110.271%0.70953%0.529SS*.Hα-helixtrans-62.9-30.7-175-158.8171.481.3167.14.5114D331 S337 F338 A339D331-R335 PolarHBondContact O-N 2.95Å; R335-S337 PolarHBondContact O-N 3.17Å; R335-F338 PolarHBondContact O-N 3.26Å; R335-A339 PolarHBondContact O-N 3.45Å; R335-A339 VanDerWaalsContact O-N 3.15Å
336E47.8Very low54.6Low158 Ų158115.6 Ų115.674%0.73855%0.546SS*.Hα-helixtrans-61.5-44.7179.4-64.1-163.7143.800112.8Y334 F338 A339 T340Y334-E336 VanDerWaalsContact C-N 3.3Å; Y334-E336 PolarHBondContact O-N 2.98Å; E336-F338 PolarHBondContact O-N 3.42Å; E336-A339 PolarHBondContact O-N 3.44Å; E336-T340 PolarHBondContact O-N 3.19Å; E336-T340 VanDerWaalsContact O-N 3.09Å; E336-T340 PolarHBondContact O-OG1 3.21Å; E336-T340 VanDerWaalsContact O-OG1 3.08Å
337S48.3Very low53.5Low73 Ų73120.4 Ų120.451%0.5157%0.568SS.*Hα-helixtrans-60.5-30.1-180-93.40000113.6Y334 R335 R341Y334-S337 PolarHBondContact O-N 2.96Å; R335-S337 PolarHBondContact O-N 3.17Å; S337-R341 WeakPolarHBondContact O-CB 3.26Å; S337-R341 PolarHBondContact O-N 2.95Å
338F49.6Very low52Low78 Ų78124.3 Ų124.334%0.34258%0.584SS.*Hα-helixtrans-83.2-41.6177.6-96.3-82.4000112.4R335 E336 T340 R341 Q342R335-F338 PolarHBondContact O-N 3.26Å; E336-F338 PolarHBondContact O-N 3.42Å; F338-T340 VanDerWaalsContact C-N 3.34Å; F338-T340 PolarHBondContact O-N 3.13Å; F338-R341 PolarHBondContact O-N 2.69Å; F338-Q342 WeakPolarHBondContact O-CB 3.44Å; F338-Q342 PolarHBondContact O-N 3.34Å
339A50.5Low50.4Low61 Ų61124.4 Ų124.450%0.50459%0.585SS.*Hα-helixtrans-57.6-47.2176.400000111.5R335 E336 R341 Q342 R343R335-A339 PolarHBondContact O-N 3.45Å; R335-A339 VanDerWaalsContact O-N 3.15Å; E336-A339 PolarHBondContact O-N 3.44Å; A339-R341 PolarHBondContact O-N 2.85Å; A339-Q342 PolarHBondContact O-N 3.45Å; A339-R343 PolarHBondContact O-N 3.36Å
340T51.6Low49Very low92 Ų92120.8 Ų120.856%0.56457%0.572SS**Hα-helixtrans-65.7-39.4179.3-50.90000112E336 F338 R343 T344E336-T340 PolarHBondContact O-N 3.19Å; E336-T340 VanDerWaalsContact O-N 3.09Å; E336-T340 PolarHBondContact O-OG1 3.21Å; E336-T340 VanDerWaalsContact O-OG1 3.08Å; F338-T340 VanDerWaalsContact C-N 3.34Å; F338-T340 PolarHBondContact O-N 3.13Å; T340-R343 PolarHBondContact O-N 2.99Å; T340-T344 PolarHBondContact O-N 3.47Å; T340-T344 VanDerWaalsContact O-N 3.07Å; T340-T344 PolarHBondContact O-OG1 2.78Å
341R46Very low48.1Very low184 Ų184122.1 Ų122.169%0.69458%0.576SS**Hα-helixtrans-73.2-29.2179.8-163.8175.5-171.4-1540.7113.7S337 F338 A339 T344 S345S337-R341 WeakPolarHBondContact O-CB 3.26Å; S337-R341 PolarHBondContact O-N 2.95Å; F338-R341 PolarHBondContact O-N 2.69Å; A339-R341 PolarHBondContact O-N 2.85Å; R341-T344 WeakPolarHBondContact CA-OG1 3.4Å; R341-T344 PolarHBondContact O-OG1 3.41Å; R341-T344 VanDerWaalsContact O-OG1 3.13Å; R341-S345 PolarHBondContact O-N 3.21Å; R341-S345 VanDerWaalsContact O-N 3.17Å; R341-S345 PolarHBondContact O-OG 3.48Å
342Q42.2Very low47.2Very low109 Ų109121.9 Ų121.951%0.50958%0.575SS.*Hα-helixtrans-83.2-26176-166.9154.3-36.600112.4F338 A339 S345 R346F338-Q342 WeakPolarHBondContact O-CB 3.44Å; F338-Q342 PolarHBondContact O-N 3.34Å; A339-Q342 PolarHBondContact O-N 3.45Å; Q342-S345 PolarHBondContact O-OG 3.4Å; Q342-R346 WeakPolarHBondContact O-CB 3.38Å; Q342-R346 WeakPolarHBondContact O-CG 3.49Å; Q342-R346 PolarHBondContact O-N 3.19Å
343R45.4Very low46.7Very low195 Ų195118.6 Ų118.674%0.73656%0.562SS**Hα-helixtrans-65.6-46.9165.4-109-178.9174.4172.4-2.2111.5A339 T340 R346 L347A339-R343 PolarHBondContact O-N 3.36Å; T340-R343 PolarHBondContact O-N 2.99Å; R343-R346 PolarHBondContact O-N 2.94Å; R343-L347 WeakPolarHBondContact O-CB 3.27Å; R343-L347 WeakPolarHBondContact O-CG 3.45Å; R343-L347 PolarHBondContact O-N 3.42Å
344T48.7Very low46.6Very low78 Ų78114.8 Ų114.848%0.47955%0.554SS.*Hα-helixtrans-67.7-36.8-179.951.30000113.1T340 R341 L347 F348T340-T344 PolarHBondContact O-N 3.47Å; T340-T344 VanDerWaalsContact O-N 3.07Å; T340-T344 PolarHBondContact O-OG1 2.78Å; R341-T344 WeakPolarHBondContact CA-OG1 3.4Å; R341-T344 PolarHBondContact O-OG1 3.41Å; R341-T344 VanDerWaalsContact O-OG1 3.13Å; T344-L347 PolarHBondContact O-N 2.85Å; T344-F348 WeakPolarHBondContact O-CB 3.48Å; T344-F348 PolarHBondContact O-N 2.84Å
345S46.2Very low46.5Very low68 Ų68114.9 Ų114.948%0.47656%0.564SS.*Hα-helixtrans-68.1-36.4174.565.60000113.2R341 Q342 S349R341-S345 PolarHBondContact O-N 3.21Å; R341-S345 VanDerWaalsContact O-N 3.17Å; R341-S345 PolarHBondContact O-OG 3.48Å; Q342-S345 PolarHBondContact O-OG 3.4Å; S345-S349 WeakPolarHBondContact O-CB 3.39Å; S345-S349 PolarHBondContact O-N 3.35Å
346R46.7Very low46.1Very low162 Ų162112.1 Ų112.161%0.61156%0.563SS**Hα-helixtrans-67.2-43.2171.8-75.7-178.3175.4-168.8-1.5111.8Q342 R343 F348 S349 I350Q342-R346 WeakPolarHBondContact O-CB 3.38Å; Q342-R346 WeakPolarHBondContact O-CG 3.49Å; Q342-R346 PolarHBondContact O-N 3.19Å; R343-R346 PolarHBondContact O-N 2.94Å; R346-F348 PolarHBondContact O-N 2.91Å; R346-S349 PolarHBondContact O-N 3.01Å; R346-I350 WeakPolarHBondContact O-CB 3.4Å; R346-I350 WeakPolarHBondContact O-CD1 3.09Å; R346-I350 WeakPolarHBondContact O-CG1 3.35Å; R346-I350 PolarHBondContact O-N 2.79Å
347L49.3Very low45.9Very low113 Ų113112.4 Ų112.459%0.59257%0.569SS**Hα-helixtrans-62-40.7175.5-76.6165.6000112.2R343 T344 I350 S351R343-L347 WeakPolarHBondContact O-CB 3.27Å; R343-L347 WeakPolarHBondContact O-CG 3.45Å; R343-L347 PolarHBondContact O-N 3.42Å; T344-L347 PolarHBondContact O-N 2.85Å; L347-I350 PolarHBondContact O-N 3.19Å; L347-S351 VanDerWaalsContact O-CB 3.29Å; L347-S351 WeakPolarHBondContact O-CB 3.12Å; L347-S351 PolarHBondContact O-N 3.33Å
348F44.1Very low45.6Very low151 Ų151111.2 Ų111.266%0.66257%0.568SS**Hα-helixtrans-65.7-41.1173.4-124.4-86.9000112.4T344 R346 I350 S351 N352T344-F348 WeakPolarHBondContact O-CB 3.48Å; T344-F348 PolarHBondContact O-N 2.84Å; R346-F348 PolarHBondContact O-N 2.91Å; F348-I350 VanDerWaalsContact C-N 3.31Å; F348-I350 PolarHBondContact O-N 3.13Å; F348-S351 PolarHBondContact O-N 2.88Å; F348-N352 PolarHBondContact O-N 3.09Å; F348-N352 PolarHBondContact O-OD1 3.25Å
349S42.4Very low45.1Very low67 Ų67113.3 Ų113.347%0.46958%0.581SS.*Hα-helixtrans-69.7-26.6176.9-176.20000113.6S345 R346 R353S345-S349 WeakPolarHBondContact O-CB 3.39Å; S345-S349 PolarHBondContact O-N 3.35Å; R346-S349 PolarHBondContact O-N 3.01Å; S349-R353 WeakPolarHBondContact O-CG 3.45Å; S349-R353 PolarHBondContact O-N 2.71Å
350I46.7Very low44.6Very low92 Ų92113.9 Ų113.947%0.47258%0.581SS.*Hα-helixtrans-80.8-43.4174.7-71164.2000109.3R346 L347 F348 N352 R353 I354R346-I350 WeakPolarHBondContact O-CB 3.4Å; R346-I350 WeakPolarHBondContact O-CD1 3.09Å; R346-I350 WeakPolarHBondContact O-CG1 3.35Å; R346-I350 PolarHBondContact O-N 2.79Å; L347-I350 PolarHBondContact O-N 3.19Å; F348-I350 VanDerWaalsContact C-N 3.31Å; F348-I350 PolarHBondContact O-N 3.13Å; I350-N352 VanDerWaalsContact C-N 3.34Å; I350-N352 PolarHBondContact O-N 2.93Å; I350-R353 PolarHBondContact O-N 2.97Å; I350-R353 VanDerWaalsContact O-N 3.12Å; I350-I354 HydrophobicContact CG2-CD1 3.6Å; I350-I354 HydrophobicContact CG2-CG1 4.32Å; I350-I354 VanDerWaalsContact O-CG1 3.31Å; I350-I354 WeakPolarHBondContact O-CG1 3.44Å; I350-I354 PolarHBondContact O-N 3.46Å
351S44.3Very low44.3Very low67 Ų67115 Ų11547%0.46959%0.59SS.*Hα-helixtrans-55.4-47.7173.8-170.30000111.7L347 F348 R353 I354 T355L347-S351 VanDerWaalsContact O-CB 3.29Å; L347-S351 WeakPolarHBondContact O-CB 3.12Å; L347-S351 PolarHBondContact O-N 3.33Å; F348-S351 PolarHBondContact O-N 2.88Å; S351-R353 VanDerWaalsContact C-N 3.35Å; S351-R353 PolarHBondContact O-N 3.39Å; S351-I354 PolarHBondContact O-N 3Å; S351-T355 PolarHBondContact O-N 3.45Å; S351-T355 VanDerWaalsContact O-N 3.11Å; S351-T355 PolarHBondContact O-OG1 3.43Å
352N41.7Very low43.9Very low85 Ų85112.8 Ų112.846%0.45559%0.587SS.*Hα-helixtrans-65.4-35.5177.2-76.824.8000112.6F348 I350 I354 T355 D356F348-N352 PolarHBondContact O-N 3.09Å; F348-N352 PolarHBondContact O-OD1 3.25Å; I350-N352 VanDerWaalsContact C-N 3.34Å; I350-N352 PolarHBondContact O-N 2.93Å; N352-I354 VanDerWaalsContact C-N 3.34Å; N352-T355 WeakPolarHBondContact CA-OG1 3.4Å; N352-T355 PolarHBondContact O-N 3.43Å; N352-T355 PolarHBondContact O-OG1 2.85Å; N352-D356 PolarHBondContact O-N 3.25Å
353R43.9Very low43.6Very low183 Ų183110.9 Ų110.969%0.69158%0.58SS**Hα-helixtrans-71.8-26.9176.2-81.2-174.9176.6-146.8-1.2113.7S349 I350 S351S349-R353 WeakPolarHBondContact O-CG 3.45Å; S349-R353 PolarHBondContact O-N 2.71Å; I350-R353 PolarHBondContact O-N 2.97Å; I350-R353 VanDerWaalsContact O-N 3.12Å; S351-R353 VanDerWaalsContact C-N 3.35Å; S351-R353 PolarHBondContact O-N 3.39Å
354I45Very low43.5Very low121 Ų121106 Ų10662%0.62157%0.572SS**Hα-helixtrans-77.9-33.6176.5-68.6168.6000110.4I350 S351 N352 D356I350-I354 HydrophobicContact CG2-CD1 3.6Å; I350-I354 HydrophobicContact CG2-CG1 4.32Å; I350-I354 VanDerWaalsContact O-CG1 3.31Å; I350-I354 WeakPolarHBondContact O-CG1 3.44Å; I350-I354 PolarHBondContact O-N 3.46Å; S351-I354 PolarHBondContact O-N 3Å; N352-I354 VanDerWaalsContact C-N 3.34Å; I354-D356 VanDerWaalsContact C-N 3.32Å
355T47.7Very low43.2Very low88 Ų88105.8 Ų105.854%0.5458%0.578SS.*Hα-helixtrans-70.9-24.3172.850.50000113.9S351 N352S351-T355 PolarHBondContact O-N 3.45Å; S351-T355 VanDerWaalsContact O-N 3.11Å; S351-T355 PolarHBondContact O-OG1 3.43Å; N352-T355 WeakPolarHBondContact CA-OG1 3.4Å; N352-T355 PolarHBondContact O-N 3.43Å; N352-T355 PolarHBondContact O-OG1 2.85Å
356D39.2Very low42.8Very low130 Ų130108 Ų10870%0.69558%0.582SS**THydrogen-bonded Turntrans-85.4-2.7-176.7-71.1-15.8000114.4N352 I354N352-D356 PolarHBondContact O-N 3.25Å; I354-D356 VanDerWaalsContact C-N 3.32Å
357L43.7Very low42.5Very low163 Ų163106.6 Ų106.685%0.85359%0.586SS**THydrogen-bonded Turntrans-119.98-176.7-88.9168.8000115.3
358G43.9Very low42.3Very low48 Ų48105.7 Ų105.750%0.49560%0.595SS.*SBendtrans-176.2124.8173.300000114.5
359M37.3Very low42.1Very low123 Ų123101.8 Ų101.861%0.60660%0.597SS**  trans74.6120165-50.8-62.2-119.900117.3L363M359-L363 HydrophobicContact CE-CD2 3.35Å; M359-L363 HydrophobicContact SD-CD2 4.1Å
360S41.5Very low41.6Very low73 Ų73101.8 Ų101.851%0.5161%0.608SS.*  trans-51.1141.6162.4168.50000110.9H362 L363S360-H362 PolarHBondContact O-N 2.99Å; S360-H362 WeakPolarHBondContact OG-CB 3.46Å; S360-H362 PolarHBondContact OG-N 3.43Å; S360-L363 PolarHBondContact O-N 3.27Å
361P45.3Very low40.8Very low116 Ų116101.1 Ų101.175%0.75362%0.623SS**Hα-helixtrans-52.4-22.3173.8-26.334.5000114.1
362H36.9Very low40.2Very low136 Ų136106.3 Ų106.363%0.6364%0.64SS**Hα-helixtrans-70.7-26178.6-158.7-74.9000113.9S360S360-H362 PolarHBondContact O-N 2.99Å; S360-H362 WeakPolarHBondContact OG-CB 3.46Å; S360-H362 PolarHBondContact OG-N 3.43Å
363L36.5Very low39.5Very low69 Ų69109.2 Ų109.236%0.36166%0.655SS.*Hα-helixtrans-85.5-34.3-179.8-130.285.2000112.8M359 S360 A365 M366 L367M359-L363 HydrophobicContact CE-CD2 3.35Å; M359-L363 HydrophobicContact SD-CD2 4.1Å; S360-L363 PolarHBondContact O-N 3.27Å; L363-A365 PolarHBondContact O-N 3.48Å; L363-M366 HydrophobicContact CD1-CE 3.85Å; L363-M366 HydrophobicContact CG-CE 4.4Å; L363-M366 PolarHBondContact O-N 2.89Å; L363-M366 VanDerWaalsContact O-N 3.12Å; L363-L367 PolarHBondContact O-N 3.41Å
364T43.7Very low38.8Very low94 Ų94108.3 Ų108.358%0.57766%0.663SS**Hα-helixtrans-61.8-33.2174.5-48.70000111.6A368T364-A368 PolarHBondContact O-N 3.4Å
365A41.9Very low37.9Very low72 Ų72107.6 Ų107.660%0.59568%0.675SS**Hα-helixtrans-68.1-36.9173.500000113.2L363L363-A365 PolarHBondContact O-N 3.48Å
366M37.3Very low36.8Very low116 Ų116113.1 Ų113.157%0.57170%0.695SS**Hα-helixtrans-75.5-36.4178.5-65.3-157.9-53.300112.9L363 A368 G369L363-M366 HydrophobicContact CD1-CE 3.85Å; L363-M366 HydrophobicContact CG-CE 4.4Å; L363-M366 PolarHBondContact O-N 2.89Å; L363-M366 VanDerWaalsContact O-N 3.12Å; M366-A368 VanDerWaalsContact C-N 3.28Å; M366-A368 PolarHBondContact O-N 2.83Å; M366-G369 PolarHBondContact O-N 2.91Å
367L41Very low36.1Very low131 Ų131110.6 Ų110.669%0.68670%0.699SS**Hα-helixtrans-71.5-21.9178.8-72.1169000113.3L363 G369L363-L367 PolarHBondContact O-N 3.41Å; L367-G369 VanDerWaalsContact C-N 3.25Å; L367-G369 PolarHBondContact O-N 2.88Å
368A43.4Very low35.2Very low94 Ų94108.4 Ų108.478%0.77770%0.697SS**THydrogen-bonded Turntrans-75.6-8.4173.200000114.1T364 M366T364-A368 PolarHBondContact O-N 3.4Å; M366-A368 VanDerWaalsContact C-N 3.28Å; M366-A368 PolarHBondContact O-N 2.83Å
369G40.1Very low34.3Very low70 Ų70110.7 Ų110.772%0.72271%0.706SS**SBendtrans-116.3-1.2-173.700000116.5M366 L367M366-G369 PolarHBondContact O-N 2.91Å; L367-G369 VanDerWaalsContact C-N 3.25Å; L367-G369 PolarHBondContact O-N 2.88Å
370G32Very low33.9Very low67 Ų67111.6 Ų111.669%0.69172%0.718SS**  trans-118.975.7-167.800000114.9
371G31.4Very low33.2Very low77 Ų77111.9 Ų111.979%0.79473%0.733SS**  trans-98.253-173.100000117.4
372H30.7Very low32.3Very low176 Ų176113.9 Ų113.982%0.81574%0.737SS**  trans-163.4118.2160.6-134.534.2000114.1
373L26.3Very low32Very low147 Ų147114.2 Ų114.277%0.7775%0.749SS**  166.1120.7127.6-88.7165.7000113.2
374L29.1Very low31.5Very low164 Ų164113.9 Ų113.986%0.85976%0.762SS**  trans17.1121.7147.7-55.5172.6000121.3
375A26.7Very low30.7Very low106 Ų106119.9 Ų119.988%0.87678%0.781SS**  -168.8155.312400000112.4
376Q24.6Very low29.9Very low204 Ų204121.8 Ų121.895%0.95379%0.79SS**  trans-96.3155.9-176.8-62.9162.9-54.400112.3
377G25.3Very low29.3Very low76 Ų76125.6 Ų125.678%0.78480%0.804SS**  trans177.260.4175.600000119.1
378S24Very low28.7Very low117 Ų117124.9 Ų124.982%0.81881%0.805SS**  trans22.4112.9152178.80000122.3
379S25.3Very low28Very low97 Ų97128.8 Ų128.868%0.67881%0.807SS**  60.1112.5127.9-158.70000122.1
380T27.9Very low27.3Very low141 Ų141133 Ų13387%0.86581%0.813SS**  171148.6102.233.40000112.4
381G28.4Very low27.1Very low80 Ų80135.4 Ų135.483%0.82582%0.819SS**  trans98.792.7151.800000118.5
382D25.9Very low26.9Very low157 Ų157135.4 Ų135.484%0.8482%0.819SS**  trans-61.3139.4164.5-98.4-51.7000113.4
383T31Very low26.9Very low143 Ų143133.3 Ų133.388%0.87782%0.819SS**  -157.2113.311648.60000108.8
384G26.3Very low26.9Very low62 Ų62134.3 Ų134.364%0.63983%0.825SS**  trans-87.4163.8-17600000115
385F25.8Very low27Very low220 Ų220132.5 Ų132.597%0.96582%0.821SS**  trans-154.6121.6141.6-112-76.4000108.6
386S25.4Very low27.1Very low113 Ų113135.4 Ų135.479%0.7982%0.818SS**  trans-89.7136.6-178.9-166.10000110.4
387F25Very low27.2Very low196 Ų196133.2 Ų133.286%0.8681%0.812SS**  trans-117.7106.7173.4-160.9-90.4000109.7
388T28.4Very low27.3Very low115 Ų115137 Ų13771%0.70681%0.813SS**  trans-68.2127.8175.341.80000110.7
389Q28.7Very low27.5Very low176 Ų176140.6 Ų140.682%0.82282%0.817SS**  trans-94.4101.4177.3-179.4-179.321.200109.5
390D25.1Very low27.5Very low160 Ų160143.4 Ų143.486%0.85683%0.825SS**  trans-108.2128.9166.3-94.7-37.9000110.9
391S27.7Very low27.7Very low116 Ų116142.7 Ų142.781%0.81182%0.823SS**  trans-94.4128.6172.1-69.40000109.5
392G27.2Very low27.6Very low77 Ų77143.9 Ų143.979%0.79482%0.818SS**  trans-143.897.2174.400000110.5
393T30.3Very low27.7Very low132 Ų132142 Ų14281%0.8181%0.813SS**  trans-68.5143.1163.345.80000109.6
394D27.1Very low27.4Very low168 Ų168142.1 Ų142.190%0.89881%0.808SS**  trans-150.3153.6147.6-111.6-35.4000115.1
395V31.7Very low27.4Very low127 Ų127144.1 Ų144.177%0.7781%0.812SS**  trans-105.2155.5-170.8169.90000110.4
396M28.2Very low27.4Very low166 Ų166138.9 Ų138.982%0.81880%0.803SS**  trans-52.8144.2176.8-56.1179.3-68.700113.2
397L26.1Very low27.5Very low159 Ų159139.4 Ų139.483%0.83281%0.806SS**  -169.3175104.9-102.3166.2000114.6
398L28.2Very low27.6Very low154 Ų154139.9 Ų139.981%0.80681%0.808SS**  trans-63.8147.3-175.7-71.6148.7000114.2
399E27.6Very low28.3Very low193 Ų193139.6 Ų139.690%0.90281%0.809SS**  trans-134.3137.1148.2-74.1-165.3133.500111.8
400N26.2Very low28.2Very low156 Ų156136.3 Ų136.383%0.83481%0.805SS**  trans-91.1153.6159.2-93.3-17000108.2
401P31.9Very low28.2Very low126 Ų126136.4 Ų136.482%0.81880%0.8SS**  trans-85.5139.6-172.733.5-34.5000113.4
402S26.1Very low28.1Very low105 Ų105137.9 Ų137.973%0.73480%0.799SS**  trans-148103.6159.558.50000112.1
403T26.9Very low28Very low119 Ų119138.2 Ų138.273%0.7380%0.802SS**  trans38.7117139.849.20000121.4
404D25.5Very low27.8Very low145 Ų145139.5 Ų139.578%0.77581%0.805SS**  85.5135.8123.6-61.7-18.8000124.2
405S27.1Very low29Very low104 Ų104136.3 Ų136.373%0.72779%0.793SS**  trans83.492.9143.966.30000121.1
406S25.1Very low28.7Very low109 Ų109136.1 Ų136.176%0.76280%0.797SS**  40.9119.9125.461.10000121.5
407S27.1Very low28.6Very low124 Ų124131.4 Ų131.487%0.86779%0.791SS**  -175158.9114.437.80000114.9
408F28.4Very low28.5Very low206 Ų206133.3 Ų133.390%0.90479%0.793SS**  trans-70.7-178.9-168.8-91.5-70.7000116.1
409P42.7Very low28.4Very low109 Ų109136.7 Ų136.771%0.70880%0.795SS**  trans-125.2-148.9-134.547-31000114.5
410S25.7Very low28.3Very low107 Ų107137.3 Ų137.375%0.74879%0.789SS**  trans89.8153.817587.70000114.7
411Q26.5Very low28.2Very low162 Ų162134.1 Ų134.176%0.75778%0.779SS**  cis-159161.9-8-133.7-179.93200110.5
412N25.3Very low28Very low148 Ų148133.3 Ų133.379%0.79178%0.776SS**  trans20.2134.1150.4-64.7-16.6000122.1
413G25.2Very low28Very low83 Ų83135.2 Ų135.286%0.85678%0.783SS**  trans175.877.2160.900000117.3
414N25.2Very low28Very low160 Ų160135.5 Ų135.586%0.85678%0.784SS**  trans-88.7174.6159.9-137.22.5000108.4
415P51.6Low28.1Very low100 Ų100136.6 Ų136.665%0.64978%0.783SS**  cis-138.9-165.7-13.438.4-17.9000114.7
416S26.7Very low28.2Very low123 Ų123139.4 Ų139.486%0.8679%0.785SS**  trans99.5140.914283.50000121
417G25.2Very low28.2Very low67 Ų67142 Ų14269%0.69179%0.79SS**  trans158.480.6159.900000120.2
418K25.2Very low28.4Very low200 Ų200145.3 Ų145.387%0.8779%0.791SS**  trans58.9124.3138.1-72.5167.9-177.1168.90120.4
419R25.5Very low28.7Very low225 Ų225141.6 Ų141.685%0.84979%0.785SS**  72.5142.194.1-117.2-177.6-167.1-166.24.6113.2
420R26Very low28.1Very low205 Ų205145.5 Ų145.577%0.77479%0.794SS**  cis-174.1160.627.4-168.6-165.9-177.6173.1-1.5111.1
421S24.5Very low28.2Very low89 Ų89148.6 Ų148.662%0.62280%0.797SS**  trans57.3127.2150.7460000120.5
422S27.8Very low28.4Very low109 Ų109145.7 Ų145.776%0.76279%0.794SS**  cis97.7111.432.872.90000115.3
423V24.9Very low28.5Very low145 Ų145147.9 Ų147.988%0.87980%0.796SS**  trans-152.4149156.31760000109.7
424T27.3Very low28.9Very low125 Ų125146.9 Ų146.977%0.76778%0.78SS**  trans-133.9165.4171.753.70000108.5
425F26.7Very low29.3Very low168 Ų168146.3 Ų146.374%0.73777%0.772SS**  cis-152-165.715-158.2-138.2000111
426E29Very low28.4Very low164 Ų164147.7 Ų147.777%0.76678%0.775SS**  trans30.5109.1154.9-87.2166171.600121.5
427D26.3Very low28.8Very low164 Ų164145.6 Ų145.688%0.87776%0.76SS**  -161.2103.2127-154.3-2.3000110.3
428Q31.4Very low29.3Very low192 Ų192145.5 Ų145.590%0.89775%0.748SS**  trans-161.679.1179.4-128.1-162.474.600114.3
429V33.9Very low29.9Very low128 Ų128139.8 Ų139.878%0.77673%0.734SS**SBendtrans-136.5-22.7167.2-175.10000115
430E30.1Very low30.6Very low191 Ų191132 Ų13289%0.89372%0.718SS**SBendtrans-97.3-8.9-167.9-69.8-151.9133.100118.4
431H28.8Very low31Very low173 Ų173128.9 Ų128.980%0.80171%0.712SS**G310 helixtrans-83.8-12.5-173.8-102.1-41.9000116.6K433H431-K433 PolarHBondContact O-N 2.84Å
432S30Very low32Very low100 Ų100129.1 Ų129.170%0.69971%0.709SS**G310 helixtrans-73.21.3-168.6-42.50000116.4
433K28.2Very low32.4Very low194 Ų194129.8 Ų129.884%0.84370%0.7SS**G310 helixtrans-108-7.4-172.9-134.9173.5-173.5175.90115.3H431H431-K433 PolarHBondContact O-N 2.84Å
434A31.9Very low33.2Very low63 Ų63125.9 Ų125.952%0.52168%0.683SS.*SBendtrans-96-21.8-17700000114.4S437A434-S437 PolarHBondContact O-OG 2.97Å
435E34.1Very low33.9Very low147 Ų147126.5 Ų126.569%0.68768%0.677SS**Hα-helixtrans-85.4-22.2-175.3-64.5-172.613000114.3S437 S438 S439E435-S437 PolarHBondContact O-N 3.33Å; E435-S438 PolarHBondContact O-OG 3.09Å; E435-S438 VanDerWaalsContact O-OG 3.07Å; E435-S439 PolarHBondContact O-N 3.3Å
436N32.2Very low34.9Very low130 Ų130122.7 Ų122.770%0.69567%0.667SS**Hα-helixtrans-74.3-23.4-179.1-82.3-11.1000113.9
437S35.1Very low35.6Very low79 Ų79119.5 Ų119.555%0.55265%0.652SS**Hα-helixtrans-79-36.1178.651.90000112.8A434 E435 Q441A434-S437 PolarHBondContact O-OG 2.97Å; E435-S437 PolarHBondContact O-N 3.33Å; S437-Q441 PolarHBondContact O-N 3.42Å
438S37Very low36.7Very low64 Ų64119.5 Ų119.545%0.44865%0.645SS.*Hα-helixtrans-70.9-39.7178.358.60000112.3E435 A440 Q441 V442E435-S438 PolarHBondContact O-OG 3.09Å; E435-S438 VanDerWaalsContact O-OG 3.07Å; S438-A440 PolarHBondContact O-N 3.33Å; S438-Q441 PolarHBondContact O-N 2.7Å; S438-V442 WeakPolarHBondContact O-CG2 3.28Å; S438-V442 PolarHBondContact O-N 2.72Å
439S37.4Very low37.6Very low81 Ų81114.3 Ų114.357%0.56663%0.629SS**Hα-helixtrans-55-50.6174.3175.60000112.5E435 Q441 V442 H443E435-S439 PolarHBondContact O-N 3.3Å; S439-Q441 VanDerWaalsContact C-N 3.33Å; S439-Q441 PolarHBondContact O-N 2.67Å; S439-V442 PolarHBondContact O-N 2.85Å; S439-H443 PolarHBondContact O-N 3.03Å; S439-H443 VanDerWaalsContact O-N 3.13Å
440A39.4Very low38.4Very low62 Ų62113.7 Ų113.751%0.51262%0.621SS.*Hα-helixtrans-63.5-37.4179.400000112.8S438 H443 A444S438-A440 PolarHBondContact O-N 3.33Å; A440-H443 PolarHBondContact O-N 3.45Å; A440-A444 PolarHBondContact O-N 3.08Å; A440-A444 VanDerWaalsContact O-N 3.16Å
441Q35.6Very low39.3Very low139 Ų139109.6 Ų109.665%0.6561%0.605SS**Hα-helixtrans-69.1-41.3-179.9-166.2166.51.700112.1S437 S438 S439 A444 E445S437-Q441 PolarHBondContact O-N 3.42Å; S438-Q441 PolarHBondContact O-N 2.7Å; S439-Q441 VanDerWaalsContact C-N 3.33Å; S439-Q441 PolarHBondContact O-N 2.67Å; Q441-A444 PolarHBondContact O-N 3.27Å; Q441-E445 PolarHBondContact O-N 2.89Å; Q441-E445 VanDerWaalsContact O-N 3.15Å
442V43.9Very low40.8Very low93 Ų93104.7 Ų104.756%0.56459%0.59SS**Hα-helixtrans-64.9-40.7175.2172.80000111.5S438 S439 A444 E445 V446S438-V442 WeakPolarHBondContact O-CG2 3.28Å; S438-V442 PolarHBondContact O-N 2.72Å; S439-V442 PolarHBondContact O-N 2.85Å; V442-A444 PolarHBondContact O-N 3.34Å; V442-E445 PolarHBondContact O-N 2.91Å; V442-V446 WeakPolarHBondContact O-CG2 3.31Å; V442-V446 PolarHBondContact O-N 2.97Å; V442-V446 VanDerWaalsContact O-N 3.09Å
443H36.6Very low42.2Very low124 Ų124106.7 Ų106.757%0.57459%0.587SS**Hα-helixtrans-65.1-39178.8-163-87000112.5S439 A440 H447S439-H443 PolarHBondContact O-N 3.03Å; S439-H443 VanDerWaalsContact O-N 3.13Å; A440-H443 PolarHBondContact O-N 3.45Å; H443-H447 AromaticContact CE1-CD2 3.45Å; H443-H447 PolarHBondContact CE1-CD2 3.3Å; H443-H447 VanDerWaalsContact CE1-CD2 3.45Å; H443-H447 AromaticContact CE1-NE2 3.4Å; H443-H447 PolarHBondContact CE1-NE2 3.29Å; H443-H447 AromaticContact ND1-CD2 3.64Å; H443-H447 PolarHBondContact O-N 2.92Å
444A41.9Very low43.9Very low62 Ų62100 Ų10051%0.51257%0.567SS.*Hα-helixtrans-65.9-38175.900000112.7A440 Q441 V442 K448A440-A444 PolarHBondContact O-N 3.08Å; A440-A444 VanDerWaalsContact O-N 3.16Å; Q441-A444 PolarHBondContact O-N 3.27Å; V442-A444 PolarHBondContact O-N 3.34Å; A444-K448 WeakPolarHBondContact O-CB 3.45Å; A444-K448 PolarHBondContact O-N 3.03Å; A444-K448 VanDerWaalsContact O-N 3.12Å
445E42.4Very low45.1Very low138 Ų13899.8 Ų99.865%0.64556%0.562SS**Hα-helixtrans-72.2-34.6-179.9-167.3155.1-154.900112.5Q441 V442 K448 S449Q441-E445 PolarHBondContact O-N 2.89Å; Q441-E445 VanDerWaalsContact O-N 3.15Å; V442-E445 PolarHBondContact O-N 2.91Å; E445-K448 PolarHBondContact O-N 3.23Å; E445-S449 PolarHBondContact O-N 2.93Å; E445-S449 VanDerWaalsContact O-N 3.09Å
446V47.6Very low46.4Very low88 Ų8896.5 Ų96.553%0.53356%0.555SS.*Hα-helixtrans-64.5-45.2172.1171.30000111.7V442 K448 S449 L450V442-V446 WeakPolarHBondContact O-CG2 3.31Å; V442-V446 PolarHBondContact O-N 2.97Å; V442-V446 VanDerWaalsContact O-N 3.09Å; V446-K448 PolarHBondContact O-N 3.35Å; V446-S449 WeakPolarHBondContact O-CB 3.48Å; V446-S449 PolarHBondContact O-N 3.18Å; V446-L450 PolarHBondContact O-N 3.47Å
447H44.9Very low48Very low97 Ų9795 Ų9545%0.44955%0.546SS..Hα-helixtrans-59.7-46.1175.7-96-88.3000112.1H443 S449 L450 D451H443-H447 AromaticContact CE1-CD2 3.45Å; H443-H447 PolarHBondContact CE1-CD2 3.3Å; H443-H447 VanDerWaalsContact CE1-CD2 3.45Å; H443-H447 AromaticContact CE1-NE2 3.4Å; H443-H447 PolarHBondContact CE1-NE2 3.29Å; H443-H447 AromaticContact ND1-CD2 3.64Å; H443-H447 PolarHBondContact O-N 2.92Å; H447-S449 VanDerWaalsContact C-N 3.25Å; H447-S449 PolarHBondContact O-N 3.33Å; H447-L450 WeakPolarHBondContact O-CB 3.35Å; H447-L450 PolarHBondContact O-N 3.29Å; H447-D451 PolarHBondContact O-N 2.86Å
448K48.2Very low49.5Very low165 Ų16594 Ų9472%0.71754%0.542SS*.Hα-helixtrans-62.1-32179-163.9173.1-174.5176.20113.1A444 E445 V446 S452A444-K448 WeakPolarHBondContact O-CB 3.45Å; A444-K448 PolarHBondContact O-N 3.03Å; A444-K448 VanDerWaalsContact O-N 3.12Å; E445-K448 PolarHBondContact O-N 3.23Å; V446-K448 PolarHBondContact O-N 3.35Å; K448-S452 WeakPolarHBondContact O-CB 3.5Å; K448-S452 PolarHBondContact O-N 3.14Å
449S49.6Very low50.9Low82 Ų8297.6 Ų97.657%0.57355%0.55SS*.Hα-helixtrans-69.8-40.3172.5-169.50000112.2E445 V446 H447 S452 F453E445-S449 PolarHBondContact O-N 2.93Å; E445-S449 VanDerWaalsContact O-N 3.09Å; V446-S449 WeakPolarHBondContact O-CB 3.48Å; V446-S449 PolarHBondContact O-N 3.18Å; H447-S449 VanDerWaalsContact C-N 3.25Å; H447-S449 PolarHBondContact O-N 3.33Å; S449-S452 PolarHBondContact O-N 3.31Å; S449-F453 PolarHBondContact O-N 3.49Å
450L50.9Low52.3Low115 Ų11596.2 Ų96.260%0.60254%0.544SS*.Hα-helixtrans-65.2-44.5178.2-143.781000112.1V446 H447 F453 A454V446-L450 PolarHBondContact O-N 3.47Å; H447-L450 WeakPolarHBondContact O-CB 3.35Å; H447-L450 PolarHBondContact O-N 3.29Å; L450-F453 PolarHBondContact O-N 3.28Å; L450-A454 PolarHBondContact O-N 3.3Å
451D50.2Low53.7Low105 Ų10598.6 Ų98.656%0.56155%0.547SS*.Hα-helixtrans-66.8-37.4177.9-67.4-28000111.9H447 A454 S455H447-D451 PolarHBondContact O-N 2.86Å; D451-A454 PolarHBondContact O-N 3.11Å; D451-S455 WeakPolarHBondContact O-CB 3.1Å; D451-S455 PolarHBondContact O-N 3.41Å
452S60.1Low55.3Low70 Ų7096.6 Ų96.649%0.4954%0.537SS..Hα-helixtrans-61.4-44.1172.3-176.90000111.5K448 S449 S455 C456K448-S452 WeakPolarHBondContact O-CB 3.5Å; K448-S452 PolarHBondContact O-N 3.14Å; S449-S452 PolarHBondContact O-N 3.31Å; S452-S455 PolarHBondContact O-N 2.74Å; S452-C456 PolarHBondContact O-N 2.88Å; S452-C456 PolarHBondContact O-SG 3.02Å
453F58Low56.4Low143 Ų14395.1 Ų95.163%0.62753%0.531SS*.Hα-helixtrans-64.4-44.5176.2-177.5-97.8000112.1S449 L450 C456 L457S449-F453 PolarHBondContact O-N 3.49Å; L450-F453 PolarHBondContact O-N 3.28Å; F453-C456 PolarHBondContact O-N 3.05Å; F453-L457 WeakPolarHBondContact O-CB 3.38Å; F453-L457 PolarHBondContact O-N 3.45Å
454A64.9Low57.9Low52 Ų5294.9 Ų94.943%0.4353%0.534SS..Hα-helixtrans-61.6-42.5175.800000112.1L450 D451 L457 A458L450-A454 PolarHBondContact O-N 3.3Å; D451-A454 PolarHBondContact O-N 3.11Å; A454-L457 PolarHBondContact O-N 2.93Å; A454-A458 WeakPolarHBondContact O-CB 3.46Å; A454-A458 PolarHBondContact O-N 2.04Å
455S57.2Low59Low60 Ų6094.3 Ų94.342%0.4253%0.53SS..Hα-helixtrans-63.7-40.7175.7-169.30000112.5D451 S452 A458 K459D451-S455 WeakPolarHBondContact O-CB 3.1Å; D451-S455 PolarHBondContact O-N 3.41Å; S452-S455 PolarHBondContact O-N 2.74Å; S455-A458 PolarHBondContact O-N 3.04Å; S455-K459 WeakPolarHBondContact O-CG 3.03Å; S455-K459 PolarHBondContact O-N 3.08Å
456C61.8Low60Low78 Ų7893 Ų9353%0.52752%0.522SS..Hα-helixtrans-65.3-40.1174.8-67.70000112.2S452 F453 A460S452-C456 PolarHBondContact O-N 2.88Å; S452-C456 PolarHBondContact O-SG 3.02Å; F453-C456 PolarHBondContact O-N 3.05Å; C456-A460 WeakPolarHBondContact O-CB 3.31Å; C456-A460 PolarHBondContact O-N 3.27Å
457L64.8Low60.7Low97 Ų9794.4 Ų94.451%0.50853%0.526SS..Hα-helixtrans-65.4-45176.8-16974.6000111.4F453 A454 A460 I461F453-L457 WeakPolarHBondContact O-CB 3.38Å; F453-L457 PolarHBondContact O-N 3.45Å; A454-L457 PolarHBondContact O-N 2.93Å; L457-A460 PolarHBondContact O-N 3.21Å; L457-I461 HydrophobicContact CG-CD1 4.18Å; L457-I461 WeakPolarHBondContact O-CG1 3.28Å; L457-I461 PolarHBondContact O-N 2.97Å
458A67.9Low61.5Low58 Ų5892.6 Ų92.648%0.47953%0.528SS..Hα-helixtrans-60.1-46.7176.900000111.8A454 S455 A460 I461 E462A454-A458 WeakPolarHBondContact O-CB 3.46Å; A454-A458 PolarHBondContact O-N 2.04Å; S455-A458 PolarHBondContact O-N 3.04Å; A458-A460 VanDerWaalsContact C-N 3.32Å; A458-A460 PolarHBondContact O-N 3.14Å; A458-I461 PolarHBondContact O-N 3.44Å; A458-E462 WeakPolarHBondContact O-CB 3.26Å; A458-E462 PolarHBondContact O-N 3.36Å
459K65.6Low61.7Low140 Ų14090.2 Ų90.261%0.60952%0.522SS*.Hα-helixtrans-63-35.1176.3-74.7179.5178.7178.10113.2S455 S463S455-K459 WeakPolarHBondContact O-CG 3.03Å; S455-K459 PolarHBondContact O-N 3.08Å; K459-S463 WeakPolarHBondContact O-CB 3.23Å; K459-S463 PolarHBondContact O-N 3.09Å; K459-S463 PolarHBondContact O-OG 3.18Å
460A65.7Low61.6Low53 Ų5393.1 Ų93.144%0.43853%0.525SS..Hα-helixtrans-64.7-46.4174.300000111.3C456 L457 A458 S463 D464C456-A460 WeakPolarHBondContact O-CB 3.31Å; C456-A460 PolarHBondContact O-N 3.27Å; L457-A460 PolarHBondContact O-N 3.21Å; A458-A460 VanDerWaalsContact C-N 3.32Å; A458-A460 PolarHBondContact O-N 3.14Å; A460-S463 PolarHBondContact O-N 3.28Å; A460-S463 PolarHBondContact O-OG 3.49Å; A460-D464 PolarHBondContact O-N 3Å; A460-D464 VanDerWaalsContact O-N 3.07Å
461I69.6Low61.4Low111 Ų11195.9 Ų95.957%0.56953%0.534SS*.Hα-helixtrans-62.9-42.5177.1-65.5164.1000111L457 A458 S463 D464 A465L457-I461 HydrophobicContact CG-CD1 4.18Å; L457-I461 WeakPolarHBondContact O-CG1 3.28Å; L457-I461 PolarHBondContact O-N 2.97Å; A458-I461 PolarHBondContact O-N 3.44Å; I461-S463 VanDerWaalsContact C-N 3.34Å; I461-S463 PolarHBondContact O-N 3.41Å; I461-D464 PolarHBondContact O-N 2.98Å; I461-A465 WeakPolarHBondContact O-CB 3.32Å; I461-A465 PolarHBondContact O-N 3.45Å
462E70.1Confident61.1Low97 Ų9798.8 Ų98.845%0.45354%0.544SS..Hα-helixtrans-63.4-38.1176.4-164.6-164.4149.500112.1A458 K466A458-E462 WeakPolarHBondContact O-CB 3.26Å; A458-E462 PolarHBondContact O-N 3.36Å; E462-K466 HydrophobicContact CG-CD 4.47Å; E462-K466 WeakPolarHBondContact O-CB 3.42Å; E462-K466 WeakPolarHBondContact O-CG 3.43Å; E462-K466 PolarHBondContact O-N 2.94Å; E462-K466 WeakPolarHBondContact OE1-CE 3.35Å; E462-K466 IonicContact OE1-NZ 2.74Å; E462-K466 PolarHBondContact OE1-NZ 2.99Å
463S65.7Low60.1Low62 Ų6299.3 Ų99.343%0.43455%0.548SS..Hα-helixtrans-67.8-36.6176.572.90000113K459 A460 I461 K466 L467K459-S463 WeakPolarHBondContact O-CB 3.23Å; K459-S463 PolarHBondContact O-N 3.09Å; K459-S463 PolarHBondContact O-OG 3.18Å; A460-S463 PolarHBondContact O-N 3.28Å; A460-S463 PolarHBondContact O-OG 3.49Å; I461-S463 VanDerWaalsContact C-N 3.34Å; I461-S463 PolarHBondContact O-N 3.41Å; S463-K466 PolarHBondContact O-N 3.05Å; S463-L467 WeakPolarHBondContact O-CG 3.37Å; S463-L467 PolarHBondContact O-N 3.05Å
464D67.8Low59.1Low119 Ų11999.3 Ų99.364%0.63655%0.554SS**Hα-helixtrans-71-40.5177.6-149.748.1000110.6A460 I461 L467 A468A460-D464 PolarHBondContact O-N 3Å; A460-D464 VanDerWaalsContact O-N 3.07Å; I461-D464 PolarHBondContact O-N 2.98Å; D464-L467 PolarHBondContact O-N 3.45Å; D464-A468 PolarHBondContact O-N 3.42Å
465A65.6Low57.6Low51 Ų51102 Ų10242%0.42157%0.57SS.*Hα-helixtrans-63.7-40.1172.800000112.6I461 A468 L469I461-A465 WeakPolarHBondContact O-CB 3.32Å; I461-A465 PolarHBondContact O-N 3.45Å; A465-A468 PolarHBondContact O-N 3.33Å; A465-L469 WeakPolarHBondContact O-CG 3.39Å; A465-L469 PolarHBondContact O-N 2.95Å
466K63.4Low56.6Low110 Ų110104.8 Ų104.848%0.47859%0.586SS.*Hα-helixtrans-64.9-40.1174.2-79.3172.4174.1171.90111.9E462 S463 L469 F470E462-K466 HydrophobicContact CG-CD 4.47Å; E462-K466 WeakPolarHBondContact O-CB 3.42Å; E462-K466 WeakPolarHBondContact O-CG 3.43Å; E462-K466 PolarHBondContact O-N 2.94Å; E462-K466 WeakPolarHBondContact OE1-CE 3.35Å; E462-K466 IonicContact OE1-NZ 2.74Å; E462-K466 PolarHBondContact OE1-NZ 2.99Å; S463-K466 PolarHBondContact O-N 3.05Å; K466-L469 PolarHBondContact O-N 2.94Å; K466-F470 WeakPolarHBondContact O-CD2 3.36Å; K466-F470 PolarHBondContact O-N 2.79Å
467L62.4Low55.2Low118 Ų118110.5 Ų110.562%0.61861%0.605SS**Hα-helixtrans-61.9-44.6174.3-76.2167.7000112S463 D464 L469 F470 E471S463-L467 WeakPolarHBondContact O-CG 3.37Å; S463-L467 PolarHBondContact O-N 3.05Å; D464-L467 PolarHBondContact O-N 3.45Å; L467-L469 VanDerWaalsContact C-N 3.33Å; L467-L469 PolarHBondContact O-N 2.79Å; L467-F470 PolarHBondContact O-N 3.12Å; L467-E471 PolarHBondContact O-N 3.29Å
468A60.9Low53.5Low59 Ų59109.7 Ų109.749%0.48862%0.62SS.*Hα-helixtrans-62.4-36.9176.800000113.1D464 A465D464-A468 PolarHBondContact O-N 3.42Å; A465-A468 PolarHBondContact O-N 3.33Å
469L54Low51.6Low114 Ų114111 Ų11160%0.59764%0.64SS**Hα-helixtrans-73.3-34.9176.8-73.2167000112.9A465 K466 L467 Q472 S473A465-L469 WeakPolarHBondContact O-CG 3.39Å; A465-L469 PolarHBondContact O-N 2.95Å; K466-L469 PolarHBondContact O-N 2.94Å; L467-L469 VanDerWaalsContact C-N 3.33Å; L467-L469 PolarHBondContact O-N 2.79Å; L469-Q472 PolarHBondContact O-N 2.84Å; L469-S473 PolarHBondContact O-N 2.92Å
470F47.6Very low49.8Very low144 Ų144107.9 Ų107.963%0.63265%0.647SS**Hα-helixtrans-72.4-25.6174.4-92.8-79.2000113.5K466 L467 Q472 S473K466-F470 WeakPolarHBondContact O-CD2 3.36Å; K466-F470 PolarHBondContact O-N 2.79Å; L467-F470 PolarHBondContact O-N 3.12Å; F470-Q472 PolarHBondContact O-N 3.37Å; F470-S473 PolarHBondContact O-OG 2.83Å
471E46.3Very low48Very low172 Ų172112.9 Ų112.980%0.80467%0.666SS**Hα-helixtrans-71.1-21.9172.5-140.5174.6-156.500112.2L467L467-E471 PolarHBondContact O-N 3.29Å
472Q43.2Very low46.1Very low166 Ų166116 Ų11678%0.77668%0.675SS**Hα-helixtrans-88.2-17.6177.6-109.2177.4-900114.8L469 F470L469-Q472 PolarHBondContact O-N 2.84Å; F470-Q472 PolarHBondContact O-N 3.37Å
473S39.9Very low44.2Very low82 Ų82116.3 Ų116.357%0.57368%0.684SS**Hα-helixtrans-94.9-5.6-179.658.50000114.6L469 F470L469-S473 PolarHBondContact O-N 2.92Å; F470-S473 PolarHBondContact O-OG 2.83Å
474L36.9Very low42.6Very low143 Ų143119.1 Ų119.175%0.74970%0.698SS**  trans-109.661.5178.3-83.2160000112.2
475S32.3Very low40.8Very low108 Ų108125.5 Ų125.576%0.75571%0.713SS**  trans-139.1104.3163.2-171.50000111.6
476P37.2Very low39Very low119 Ų119126.9 Ų126.977%0.77373%0.732SS**  trans-107.7155.3152.4-0.621.6000111.5
477Q32.1Very low37.4Very low198 Ų198126.3 Ų126.393%0.92575%0.748SS**  trans-76.5155.3-177.5-57.8164.13.700112.4
478G29.4Very low36.2Very low79 Ų79126.6 Ų126.681%0.81476%0.757SS**  trans98.7105.4143.600000119.5
479G28.2Very low34.9Very low87 Ų87133.3 Ų133.390%0.89778%0.775SS**  trans62.8122.813000000122.7
480G27.8Very low33.9Very low73 Ų73133.5 Ų133.575%0.75378%0.783SS**  trans112.3112.3134.500000120.2
481L28.1Very low32.9Very low159 Ų159138.2 Ų138.283%0.83280%0.797SS**  trans55.9131.4142.8-93.683000124.5
482F29.6Very low32.1Very low177 Ų177139.1 Ų139.178%0.77680%0.801SS**  trans78.4109.9136.7-96-119.9000124.6
483V30.7Very low31.7Very low103 Ų103136.7 Ų136.762%0.62480%0.799SS**  73.9101.1115.9172.50000122.5
484T31.9Very low31.2Very low121 Ų121140.7 Ų140.774%0.74281%0.814SS**  trans63.3135.7133.472.30000125.8
485R29.8Very low30.8Very low253 Ų253137.2 Ų137.296%0.95581%0.813SS**  trans89.6121.9134.1-114.7178.3178.9164.8-0.9119.8
486G26.9Very low30.5Very low79 Ų79141.9 Ų141.981%0.81482%0.823SS**  trans160.9111.8163.300000113.3
487A30.3Very low30.1Very low98 Ų98147.1 Ų147.181%0.8183%0.827SS**  trans-96.2-177.6170.100000109.2
488P36.7Very low30Very low125 Ų125144.8 Ų144.881%0.81282%0.821SS**  cis-141.3-173.1942.4-21.4000116.9
489K34.3Very low29.8Very low199 Ų199150.8 Ų150.887%0.86582%0.819SS**PPolyproline II helixtrans-78.1139.9-179.3-162.9-175.2-163.8179.40113
490P31.9Very low29.9Very low118 Ų118154.7 Ų154.777%0.76682%0.818SS**PPolyproline II helixtrans-96.3158.2162.533.5-28.7000113.1
491R27.9Very low29.9Very low244 Ų244159.2 Ų159.292%0.92182%0.819SS**PPolyproline II helixtrans-95.9157.7171.6-62.1171.9177.8163.3-2.5109.6
492H28.4Very low29.9Very low191 Ų191155.6 Ų155.688%0.88481%0.807SS**  trans-127.5138.4163-112.9-14.2000110.8
493P36.3Very low30Very low115 Ų115154.5 Ų154.575%0.74781%0.808SS**  trans-96.8-177.1175.639.6-34.5000112.8
494D27.7Very low29.9Very low165 Ų165156.3 Ų156.388%0.88282%0.815SS**  trans-65.6142.2-171.9-65.9-74.3000117.1
495G28.7Very low29.9Very low71 Ų71158.6 Ų158.673%0.73282%0.817SS**  71.2106121.700000120.3
496Q27.6Very low29.9Very low206 Ų206150.3 Ų150.396%0.96381%0.81SS**  trans-150.5155135.5-118.91643.200113.4
497R27.5Very low29.9Very low228 Ų228153.3 Ų153.386%0.8681%0.806SS**  trans-105.4172.9-173.3-157.6-176.6-162.4-138.57.6108.7
498L29.6Very low29.9Very low149 Ų149154.7 Ų154.778%0.7880%0.804SS**  trans87.9144.8174-55.3166.3000114
499R25.4Very low29.6Very low206 Ų206157 Ų15778%0.77780%0.802SS**  cis-165.2155.2-11.9174.3178.6-166.5162.3-0.6108.2
500L30.8Very low29.4Very low168 Ų168152.7 Ų152.788%0.8879%0.788SS**  trans-79.9129.8169.8-102.981.3000111
501E28.6Very low29.4Very low168 Ų168153.3 Ų153.379%0.78579%0.785SS**  trans-148.5128.9150.2-87.1169.8143.300103.6
502S27.6Very low29.6Very low83 Ų83150.3 Ų150.358%0.5877%0.773SS**  cis113.1123.522.565.20000109.9
503I31.5Very low29.8Very low154 Ų154149 Ų14979%0.7977%0.768SS**  trans75.1143157.4-56.6155.8000112.8
504D29.5Very low29.6Very low142 Ų142152.1 Ų152.176%0.75977%0.772SS**  cis-145.1-173.77.7-137.3-21.2000114.6
505E30.4Very low30.1Very low168 Ų168153 Ų15379%0.78577%0.771SS**  trans-50.1164.1172.3-61.4-171.1155.800118.4
506G30.2Very low30.3Very low80 Ų80158.5 Ų158.583%0.82578%0.778SS**  trans-164.7102.1166.700000112.5
507I28.1Very low30.4Very low141 Ų141157.5 Ų157.572%0.72377%0.773SS**  trans-92.1135-173.4-80.8171.8000112.5
508V29.7Very low30.8Very low128 Ų128154 Ų15478%0.77677%0.766SS**  trans40.8125.8150.4177.40000120.2
509K29.2Very low31.2Very low174 Ų174153.6 Ų153.676%0.75776%0.759SS**  -149.7124.1127.2-122.2176.2169.1-105.30112.1D511K509-D511 IonicContact NZ-OD2 3.76Å; K509-D511 PolarHBondContact NZ-OD2 3.14Å
510D32Very low31.7Very low108 Ų108152 Ų15258%0.57876%0.757SS**  trans-91.1135.8160.2-177.124.7000105.8R512D510-R512 IonicContact OD2-NH2 3.45Å; D510-R512 PolarHBondContact OD2-NH2 3.04Å
511D31.5Very low32.2Very low130 Ų130151.3 Ų151.370%0.69575%0.754SS**  trans-151.2135.4164.3-85.5-49.2000106.7K509K509-D511 IonicContact NZ-OD2 3.76Å; K509-D511 PolarHBondContact NZ-OD2 3.14Å
512R31.4Very low33.1Very low181 Ų181154.8 Ų154.868%0.68378%0.775SS**  trans-136.4153.6-164.1-162.1-170.6-58-168.15108.7D510D510-R512 IonicContact OD2-NH2 3.45Å; D510-R512 PolarHBondContact OD2-NH2 3.04Å
513E31.9Very low33.3Very low164 Ų164158.4 Ų158.477%0.76679%0.785SS**  trans74.3153.4169.6-72148.3-140.500117.4
514E34Very low33.4Very low180 Ų180158.6 Ų158.684%0.84178%0.784SS**  trans98.4120.5-166.9-65.7178.1-169.100114
515E36.3Very low33.7Very low184 Ų184159.5 Ų159.586%0.8679%0.786SS**  cis-155.1156.3-6-129.2173.7177.400110
516E32.8Very low33.8Very low186 Ų186159 Ų15987%0.86979%0.786SS**  trans-87.1167.7175-96.6-176.2135.300112.5
517E31Very low34.1Very low185 Ų185163.9 Ų163.986%0.86478%0.783SS**  trans6399.6163.9-63.5-163.1136.400120.4
518E35.7Very low34.5Very low154 Ų154165.5 Ų165.572%0.7279%0.787SS**  176.7145.7116.9-92.4-157.2140.300108.2
519K38.3Very low34.8Very low142 Ų142168.1 Ų168.162%0.61779%0.788SS**  cis-159.1136.912.3-131.2161.9-179.5132.70109.7
520K35.3Very low35.2Very low173 Ų173167.7 Ų167.775%0.75279%0.791SS**  trans44.2124.5135.1-71.5-174175.6176.70121.9
521L42.2Very low35.5Very low153 Ų153172.7 Ų172.780%0.80181%0.808SS**  trans61.2103.2137.9-77.4126.1000118.3
522I45.8Very low35.9Very low240 Ų240176.5 Ų176.5100%1.23182%0.819SS**  -155.5089.6-91157.2000109

Retrieved 522 of 522 residues in 200.2 ms (Link to these results)

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