A0A087YP38_POEFO Loading...

Nucleolar complex associated 4 homolog

AlphaFold DB , UniProt , Accession A0A087YP38, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 526 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M34.1Very low27.9Very low253 Ų253157.8 Ų157.8100%1.24687%0.869SS**  0100.30-90.5178.4129.700109.8
2A21.3Very low27.7Very low96 Ų96161 Ų16179%0.79387%0.868SS**  trans-160.7136153.600000105.1
3P25.1Very low28.3Very low126 Ų126155.8 Ų155.882%0.81886%0.861SS**  trans-77.3133.8-164.730.2-31.9000111.4K5P3-K5 PolarHBondContact O-N 3.15Å
4A25.8Very low28.2Very low98 Ų98156.3 Ų156.381%0.8186%0.861SS**  trans-60.9116.8173.500000110.1K6A4-K6 PolarHBondContact O-N 3.2Å
5K27.9Very low28Very low202 Ų202151.9 Ų151.988%0.87885%0.854SS**  trans-63.9115.4172.4-89.7175.7174.7170.70109.3P3 R7P3-K5 PolarHBondContact O-N 3.15Å; K5-R7 PolarHBondContact O-N 3.21Å
6K34.7Very low28.1Very low203 Ų203154.3 Ų154.388%0.88385%0.852SS**  trans-46.1125.2161.8-77.6178.1172.9178.10110.2A4A4-K6 PolarHBondContact O-N 3.2Å
7R26.9Very low28.7Very low241 Ų241158.1 Ų158.191%0.90986%0.858SS**  trans-132.3103.3160.3-95.3-176.1167.7164-4.2111.1K5K5-R7 PolarHBondContact O-N 3.21Å
8N28.3Very low29.1Very low156 Ų156156.8 Ų156.883%0.83485%0.849SS**  trans-8.8111.8151.8-58.1-19.7000117.4
9V26.7Very low29.8Very low144 Ų144159.3 Ų159.387%0.87385%0.851SS**  trans-143.1127.3133.5-174.90000107.9
10S25Very low31Very low96 Ų96154.4 Ų154.467%0.67182%0.824SS**  trans-70.2134.7-172.4670000112.6K12S10-K12 PolarHBondContact O-N 3.33Å; S10-K12 VanDerWaalsContact O-N 3.15Å
11S31.2Very low32.5Very low121 Ų121151.9 Ų151.985%0.84681%0.811SS**  trans-59.1108.8165.755.40000111.4
12K25.8Very low33.9Very low196 Ų196140.9 Ų140.985%0.85276%0.756SS**  trans-109.9100.3156.5-85.7-172.6176.61790108.8S10 N14S10-K12 PolarHBondContact O-N 3.33Å; S10-K12 VanDerWaalsContact O-N 3.15Å; K12-N14 PolarHBondContact O-N 3.3Å
13A35.2Very low35.9Very low94 Ų94141.7 Ų141.778%0.77774%0.743SS**  trans-67.5110165.100000109.4
14N26.3Very low37.7Very low162 Ų162136.5 Ų136.587%0.86671%0.712SS**  trans166.8112141.9-94.9-20.6000110.3K12K12-N14 PolarHBondContact O-N 3.3Å
15A26Very low39.7Very low91 Ų91132.5 Ų132.575%0.75268%0.677SS**  trans169.9121.513000000111
16K29.7Very low41.8Very low189 Ų189123.3 Ų123.382%0.82264%0.638SS**  trans45.8120.5146.9-65.8176.8177.7177.20118.1I18K16-I18 VanDerWaalsContact C-N 3.35Å; K16-I18 PolarHBondContact O-N 3.19Å
17K37.4Very low43.5Very low219 Ų219118.6 Ų118.695%0.95262%0.619SS**  trans-43.393.8158.3-77.6175.5173.3175.90110.6
18I36.3Very low45.5Very low136 Ų136112.9 Ų112.970%0.69760%0.598SS**  trans-86.1121.1162.4-65.3168.4000104.1K16 I20K16-I18 VanDerWaalsContact C-N 3.35Å; K16-I18 PolarHBondContact O-N 3.19Å; I18-I20 VanDerWaalsContact C-N 3.33Å; I18-I20 PolarHBondContact O-N 3.21Å
19K42.5Very low47.6Very low204 Ų204105.6 Ų105.689%0.88756%0.559SS**  trans-59.5103.2163.8-133179.9-179.8-174.10104.8D21K19-D21 PolarHBondContact O-N 2.77Å
20I53.2Low49.5Very low60 Ų60100.3 Ų100.331%0.30853%0.525SS..  trans-68.5119.6-173.2-64.6154.6000107.4I18 F22 I25 F45I18-I20 VanDerWaalsContact C-N 3.33Å; I18-I20 PolarHBondContact O-N 3.21Å; I20-F22 VanDerWaalsContact C-N 3.35Å; I20-F22 HydrophobicContact CB-CD2 4.27Å; I20-F22 HydrophobicContact CB-CE2 3.87Å; I20-F22 HydrophobicContact CB-CZ 4.12Å; I20-F22 HydrophobicContact CD1-CZ 4.41Å; I20-F22 HydrophobicContact CG2-CD1 4.08Å; I20-F22 HydrophobicContact CG2-CD2 4Å; I20-F22 HydrophobicContact CG2-CE1 3.9Å; I20-F22 HydrophobicContact CG2-CE2 3.82Å; I20-F22 HydrophobicContact CG2-CG 4.13Å; I20-F22 HydrophobicContact CG2-CZ 3.77Å; I20-F22 WeakPolarHBondContact O-CD2 3.38Å; I20-F22 PolarHBondContact O-N 3.1Å; I20-F22 VanDerWaalsContact O-N 3.15Å; I20-I25 HydrophobicContact CG2-CD1 4.1Å; I20-F45 HydrophobicContact CD1-CD1 4.19Å; I20-F45 HydrophobicContact CD1-CE1 3.38Å; I20-F45 HydrophobicContact CD1-CE2 4.15Å; I20-F45 HydrophobicContact CD1-CZ 3.38Å; I20-F45 HydrophobicContact CG1-CZ 4.33Å; I20-F45 HydrophobicContact CG2-CE2 4.4Å
21D63.7Low51.7Low102 Ų102103.4 Ų103.455%0.54553%0.526SS..  trans-84.181.8176.4-177.311.1000109.2K19 E23 G24 I25K19-D21 PolarHBondContact O-N 2.77Å; D21-E23 PolarHBondContact O-N 2.98Å; D21-E23 PolarHBondContact OD1-N 3.41Å; D21-G24 PolarHBondContact O-N 2.89Å; D21-G24 PolarHBondContact OD1-N 2.9Å; D21-I25 PolarHBondContact O-N 3.48Å; D21-I25 VanDerWaalsContact O-N 3.13Å
22F62.5Low53.6Low22 Ų2299.6 Ų99.610%0.09650%0.5CS..Hα-helixtrans-60.5-34.3177.9-70.9-78.6000112I20 I25 V26 F45 C56 A57 A60I20-F22 VanDerWaalsContact C-N 3.35Å; I20-F22 HydrophobicContact CB-CD2 4.27Å; I20-F22 HydrophobicContact CB-CE2 3.87Å; I20-F22 HydrophobicContact CB-CZ 4.12Å; I20-F22 HydrophobicContact CD1-CZ 4.41Å; I20-F22 HydrophobicContact CG2-CD1 4.08Å; I20-F22 HydrophobicContact CG2-CD2 4Å; I20-F22 HydrophobicContact CG2-CE1 3.9Å; I20-F22 HydrophobicContact CG2-CE2 3.82Å; I20-F22 HydrophobicContact CG2-CG 4.13Å; I20-F22 HydrophobicContact CG2-CZ 3.77Å; I20-F22 WeakPolarHBondContact O-CD2 3.38Å; I20-F22 PolarHBondContact O-N 3.1Å; I20-F22 VanDerWaalsContact O-N 3.15Å; F22-I25 PolarHBondContact O-N 2.83Å; F22-V26 WeakPolarHBondContact O-CG2 3.31Å; F22-V26 PolarHBondContact O-N 2.69Å; F22-V26 VanDerWaalsContact O-N 3.1Å; F22-F45 HydrophobicContact CE1-CB 3.87Å; F22-F45 AromaticContact CE1-CD2 3.67Å; F22-F45 HydrophobicContact CE1-CD2 3.67Å; F22-F45 HydrophobicContact CE1-CE2 4.46Å; F22-F45 AromaticContact CE1-CG 3.78Å; F22-F45 HydrophobicContact CE1-CG 3.78Å; F22-F45 HydrophobicContact CZ-CB 4.17Å; F22-F45 HydrophobicContact CZ-CD1 4.33Å; F22-F45 HydrophobicContact CZ-CD2 4.16Å; F22-F45 AromaticContact CZ-CG 3.96Å; F22-F45 HydrophobicContact CZ-CG 3.96Å; F22-C56 HydrophobicContact CD2-CB 3.86Å; F22-C56 HydrophobicContact CE2-CB 3.91Å; F22-A57 HydrophobicContact CE1-CB 4.32Å; F22-A60 HydrophobicContact CB-CB 4.08Å; F22-A60 HydrophobicContact CD1-CB 4.44Å
23E63.3Low55.4Low114 Ų11496.7 Ų96.753%0.53348%0.484SS..Hα-helixtrans-67.9-42.1177-63.2-166.914200111.2D21 I25 V26 E27 K63D21-E23 PolarHBondContact O-N 2.98Å; D21-E23 PolarHBondContact OD1-N 3.41Å; E23-I25 VanDerWaalsContact C-N 3.31Å; E23-I25 PolarHBondContact O-N 3.21Å; E23-V26 PolarHBondContact O-N 2.85Å; E23-E27 PolarHBondContact O-N 3.28Å; E23-K63 IonicContact OE1-NZ 3.96Å; E23-K63 PolarHBondContact OE1-NZ 3.4Å
24G63.5Low56.6Low16 Ų16101.2 Ų101.217%0.16549%0.486CS..Hα-helixtrans-64.3-28.7174.100000114.5D21 R28D21-G24 PolarHBondContact O-N 2.89Å; D21-G24 PolarHBondContact OD1-N 2.9Å; G24-R28 WeakPolarHBondContact O-CB 3.31Å; G24-R28 VanDerWaalsContact O-CG 3.23Å; G24-R28 WeakPolarHBondContact O-CG 3.23Å; G24-R28 PolarHBondContact O-N 3.22Å; G24-R28 PolarHBondContact O-NE 2.99Å
25I67.5Low58.6Low14 Ų1497 Ų977%0.07246%0.461CS..Hα-helixtrans-71.7-48.6172.4-66165.1000110.2I20 D21 F22 E23 E27 R28 I29 D38 V42I20-I25 HydrophobicContact CG2-CD1 4.1Å; D21-I25 PolarHBondContact O-N 3.48Å; D21-I25 VanDerWaalsContact O-N 3.13Å; F22-I25 PolarHBondContact O-N 2.83Å; E23-I25 VanDerWaalsContact C-N 3.31Å; E23-I25 PolarHBondContact O-N 3.21Å; I25-E27 VanDerWaalsContact C-N 3.34Å; I25-E27 PolarHBondContact O-N 3.34Å; I25-R28 PolarHBondContact O-N 3.33Å; I25-R28 VanDerWaalsContact O-N 3.15Å; I25-I29 HydrophobicContact CG2-CD1 3.81Å; I25-I29 WeakPolarHBondContact O-CG1 3.28Å; I25-I29 PolarHBondContact O-N 3.32Å; I25-I29 VanDerWaalsContact O-N 3.07Å; I25-D38 HydrophobicContact CG2-CB 4.17Å; I25-V42 HydrophobicContact CG2-CG2 3.84Å
26V71.4Confident60.4Low9 Ų993.1 Ų93.16%0.05543%0.428CS..Hα-helixtrans-60.3-44179.2173.40000111.2F22 E23 R28 I29 L30 A60 K63 L64F22-V26 WeakPolarHBondContact O-CG2 3.31Å; F22-V26 PolarHBondContact O-N 2.69Å; F22-V26 VanDerWaalsContact O-N 3.1Å; E23-V26 PolarHBondContact O-N 2.85Å; V26-R28 VanDerWaalsContact C-N 3.32Å; V26-R28 PolarHBondContact O-N 3.43Å; V26-I29 PolarHBondContact O-N 3.43Å; V26-L30 HydrophobicContact CG1-CD1 3.87Å; V26-L30 HydrophobicContact CG1-CG 4.41Å; V26-L30 WeakPolarHBondContact O-CB 3.45Å; V26-L30 VanDerWaalsContact O-CG 3.3Å; V26-L30 WeakPolarHBondContact O-CG 3.33Å; V26-L30 PolarHBondContact O-N 3.48Å; V26-A60 HydrophobicContact CG2-CB 3.8Å; V26-A60 WeakPolarHBondContact CG2-O 3.48Å; V26-K63 HydrophobicContact CG1-CB 4.3Å; V26-L64 HydrophobicContact CG1-CB 4.03Å; V26-L64 HydrophobicContact CG1-CD1 4.24Å; V26-L64 HydrophobicContact CG2-CB 4.32Å
27E71.1Confident62.5Low104 Ų10489.1 Ų89.149%0.48642%0.416SS..Hα-helixtrans-62.9-36.3176.7-78.4-161.7-174.400113.3E23 I25 L30 K31E23-E27 PolarHBondContact O-N 3.28Å; I25-E27 VanDerWaalsContact C-N 3.34Å; I25-E27 PolarHBondContact O-N 3.34Å; E27-L30 PolarHBondContact O-N 2.93Å; E27-K31 WeakPolarHBondContact O-CB 3.38Å; E27-K31 VanDerWaalsContact O-CG 3.25Å; E27-K31 WeakPolarHBondContact O-CG 3.49Å; E27-K31 PolarHBondContact O-N 3.24Å; E27-K31 IonicContact OE2-NZ 3.99Å; E27-K31 PolarHBondContact OE2-NZ 3.31Å
28R69.9Low64.2Low122 Ų12280.3 Ų80.346%0.4638%0.379SS..Hα-helixtrans-67.3-42.6177.8-80.1-177.9-70.8164.2-1.8111.7G24 I25 V26 L30 K31 S32G24-R28 WeakPolarHBondContact O-CB 3.31Å; G24-R28 VanDerWaalsContact O-CG 3.23Å; G24-R28 WeakPolarHBondContact O-CG 3.23Å; G24-R28 PolarHBondContact O-N 3.22Å; G24-R28 PolarHBondContact O-NE 2.99Å; I25-R28 PolarHBondContact O-N 3.33Å; I25-R28 VanDerWaalsContact O-N 3.15Å; V26-R28 VanDerWaalsContact C-N 3.32Å; V26-R28 PolarHBondContact O-N 3.43Å; R28-L30 VanDerWaalsContact C-N 3.32Å; R28-L30 PolarHBondContact O-N 3.09Å; R28-K31 PolarHBondContact O-N 3.45Å; R28-S32 PolarHBondContact O-N 3.06Å
29I71.1Confident66Low3 Ų373.9 Ų73.92%0.01535%0.346CS..Hα-helixtrans-63-41.5175.7-61.7161.7000110.2I25 V26 K31 D38 V39 L64I25-I29 HydrophobicContact CG2-CD1 3.81Å; I25-I29 WeakPolarHBondContact O-CG1 3.28Å; I25-I29 PolarHBondContact O-N 3.32Å; I25-I29 VanDerWaalsContact O-N 3.07Å; V26-I29 PolarHBondContact O-N 3.43Å; I29-K31 PolarHBondContact O-N 3.07Å; I29-D38 HydrophobicContact CD1-CB 4.08Å; I29-D38 HydrophobicContact CG1-CB 4.02Å; I29-V39 HydrophobicContact CD1-CG2 3.87Å; I29-V39 HydrophobicContact CG2-CG2 4.14Å; I29-L64 HydrophobicContact CB-CD1 3.97Å; I29-L64 HydrophobicContact CD1-CD1 4.46Å; I29-L64 HydrophobicContact CD1-CD2 4.23Å; I29-L64 HydrophobicContact CG2-CD1 3.64Å
30L66.6Low67.5Low32 Ų3268.2 Ų68.217%0.16832%0.322CS..Hα-helixtrans-71.9-25179.4-69.5174000114.4V26 E27 R28 L64 T67 L68 R71V26-L30 HydrophobicContact CG1-CD1 3.87Å; V26-L30 HydrophobicContact CG1-CG 4.41Å; V26-L30 WeakPolarHBondContact O-CB 3.45Å; V26-L30 VanDerWaalsContact O-CG 3.3Å; V26-L30 WeakPolarHBondContact O-CG 3.33Å; V26-L30 PolarHBondContact O-N 3.48Å; E27-L30 PolarHBondContact O-N 2.93Å; R28-L30 VanDerWaalsContact C-N 3.32Å; R28-L30 PolarHBondContact O-N 3.09Å; L30-L64 HydrophobicContact CD2-CD1 4.07Å; L30-L64 HydrophobicContact CG-CD1 4.12Å; L30-T67 HydrophobicContact CD1-CG2 4.41Å; L30-T67 WeakPolarHBondContact CD1-OG1 3.48Å; L30-T67 VanDerWaalsContact CD2-OG1 3.24Å; L30-T67 WeakPolarHBondContact CD2-OG1 3.23Å; L30-L68 HydrophobicContact CD2-CD2 4.3Å; L30-L68 HydrophobicContact CD2-CG 4.32Å; L30-R71 PolarHBondContact O-NH1 3.45Å
31K72.6Confident68.6Low161 Ų16168.9 Ų68.970%0.733%0.326SS*.Hα-helixtrans-90.2-29.6179.8-74.1170.8-173.8162.80113.1E27 R28 I29E27-K31 WeakPolarHBondContact O-CB 3.38Å; E27-K31 VanDerWaalsContact O-CG 3.25Å; E27-K31 WeakPolarHBondContact O-CG 3.49Å; E27-K31 PolarHBondContact O-N 3.24Å; E27-K31 IonicContact OE2-NZ 3.99Å; E27-K31 PolarHBondContact OE2-NZ 3.31Å; R28-K31 PolarHBondContact O-N 3.45Å; I29-K31 PolarHBondContact O-N 3.07Å
32S69.6Low69.2Low41 Ų4164 Ų6429%0.28730%0.3SS..  trans-143.6118.5-174.6172.50000112.8R28 K34 H35R28-S32 PolarHBondContact O-N 3.06Å; S32-K34 PolarHBondContact O-N 3.44Å; S32-H35 PolarHBondContact O-N 3.32Å
33R63.9Low69.9Low136 Ų13663.6 Ų63.651%0.51330%0.299SS..G310 helixtrans-60.7-16.2178.2-63.5179.2177.1-168.5-10114H35 D73 D93 Y96R33-H35 PolarHBondContact O-N 3.07Å; R33-D73 IonicContact NH2-OD1 3.23Å; R33-D93 IonicContact CZ-OD1 3.05Å; R33-D93 VanDerWaalsContact CZ-OD1 3.28Å; R33-D93 IonicContact NH1-OD1 3.94Å; R33-D93 PolarHBondContact NH1-OD1 2.91Å; R33-D93 IonicContact NH2-OD1 3.37Å; R33-D93 PolarHBondContact NH2-OD1 2.93Å; R33-Y96 HydrophobicContact CB-CD2 4.37Å; R33-Y96 HydrophobicContact CB-CE2 3.91Å; R33-Y96 HydrophobicContact CG-CE2 4.1Å
34K60.9Low70.8Confident189 Ų18964.6 Ų64.682%0.82230%0.303SS*.G310 helixtrans-70.6-19.2175.9-65.8-175.8178.1-179.60113S32S32-K34 PolarHBondContact O-N 3.44Å
35H67.1Low71.5Confident74 Ų7466.3 Ų66.334%0.34331%0.306SS..G310 helixtrans-97.114.2-179.6-70.4-70.9000113.4S32 R33 N37 D38S32-H35 PolarHBondContact O-N 3.32Å; R33-H35 PolarHBondContact O-N 3.07Å; H35-N37 PolarHBondContact O-N 3.23Å; H35-N37 VanDerWaalsContact O-N 3.09Å; H35-D38 WeakPolarHBondContact CB-OD2 3.3Å; H35-D38 IonicContact CG-OD2 3.72Å; H35-D38 IonicContact ND1-OD2 3.92Å; H35-D38 PolarHBondContact ND1-OD2 2.83Å; H35-D38 VanDerWaalsContact O-CB 3.27Å; H35-D38 WeakPolarHBondContact O-CB 3.48Å; H35-D38 PolarHBondContact O-N 2.97Å
36A64.7Low72Confident8 Ų865.6 Ų65.67%0.06630%0.303CS..G310 helixtrans-62.1-18.6179.500000114.6D38 V39 Y96 F99 M100A36-D38 VanDerWaalsContact C-N 3.26Å; A36-D38 PolarHBondContact O-N 3.11Å; A36-V39 WeakPolarHBondContact O-CB 3.38Å; A36-V39 VanDerWaalsContact O-CG2 3.22Å; A36-V39 WeakPolarHBondContact O-CG2 3.4Å; A36-V39 PolarHBondContact O-N 2.89Å; A36-Y96 HydrophobicContact CB-CD2 4.32Å; A36-Y96 HydrophobicContact CB-CE2 3.61Å; A36-F99 HydrophobicContact CB-CE1 4.32Å; A36-M100 HydrophobicContact CB-SD 4.2Å
37N73.4Confident72.4Confident106 Ų10671.5 Ų71.557%0.56733%0.33SS*.G310 helixtrans-71-22.3172.5-68.7-23.9000112.6H35 V39 F40H35-N37 PolarHBondContact O-N 3.23Å; H35-N37 VanDerWaalsContact O-N 3.09Å; N37-V39 PolarHBondContact O-N 3.34Å; N37-V39 VanDerWaalsContact O-N 3.07Å; N37-F40 WeakPolarHBondContact O-CB 2.91Å; N37-F40 WeakPolarHBondContact O-CD2 3.23Å; N37-F40 PolarHBondContact O-N 3.44Å
38D72.7Confident72.9Confident33 Ų3368.3 Ų68.318%0.17632%0.319CS..G310 helixtrans-67.1-11179.1-55.9-2000111.3I25 I29 H35 A36 F40 D41I25-D38 HydrophobicContact CG2-CB 4.17Å; I29-D38 HydrophobicContact CD1-CB 4.08Å; I29-D38 HydrophobicContact CG1-CB 4.02Å; H35-D38 WeakPolarHBondContact CB-OD2 3.3Å; H35-D38 IonicContact CG-OD2 3.72Å; H35-D38 IonicContact ND1-OD2 3.92Å; H35-D38 PolarHBondContact ND1-OD2 2.83Å; H35-D38 VanDerWaalsContact O-CB 3.27Å; H35-D38 WeakPolarHBondContact O-CB 3.48Å; H35-D38 PolarHBondContact O-N 2.97Å; A36-D38 VanDerWaalsContact C-N 3.26Å; A36-D38 PolarHBondContact O-N 3.11Å; D38-F40 PolarHBondContact O-N 2.98Å; D38-D41 PolarHBondContact O-N 3.26Å
39V74.1Confident73Confident2 Ų271.8 Ų71.81%0.01234%0.341CS..Hα-helixtrans-62.3-32.3169.7179.90000111.3I29 A36 N37 D41 V42 L43 L64 F65 M100 R103I29-V39 HydrophobicContact CD1-CG2 3.87Å; I29-V39 HydrophobicContact CG2-CG2 4.14Å; A36-V39 WeakPolarHBondContact O-CB 3.38Å; A36-V39 VanDerWaalsContact O-CG2 3.22Å; A36-V39 WeakPolarHBondContact O-CG2 3.4Å; A36-V39 PolarHBondContact O-N 2.89Å; N37-V39 PolarHBondContact O-N 3.34Å; N37-V39 VanDerWaalsContact O-N 3.07Å; V39-D41 VanDerWaalsContact C-N 3.31Å; V39-D41 PolarHBondContact O-N 3.32Å; V39-V42 PolarHBondContact O-N 2.86Å; V39-L43 HydrophobicContact CG1-CD1 4.23Å; V39-L43 HydrophobicContact CG1-CG 4.33Å; V39-L43 WeakPolarHBondContact O-CG 3.02Å; V39-L43 PolarHBondContact O-N 3.09Å; V39-L64 HydrophobicContact CG2-CD2 4.02Å; V39-F65 HydrophobicContact CG1-CZ 4.25Å; V39-M100 HydrophobicContact CG2-CE 4.02Å; V39-M100 HydrophobicContact CG2-SD 4.27Å; V39-R103 HydrophobicContact CG1-CB 4.11Å; V39-R103 HydrophobicContact CG1-CG 4.36Å
40F75.3Confident73.5Confident85 Ų8578.2 Ų78.237%0.37337%0.368SS..Hα-helixtrans-63.3-38.4177.2-77.5-77.5000112.2N37 D38 V42 L43 E44 F99 R103N37-F40 WeakPolarHBondContact O-CB 2.91Å; N37-F40 WeakPolarHBondContact O-CD2 3.23Å; N37-F40 PolarHBondContact O-N 3.44Å; D38-F40 PolarHBondContact O-N 2.98Å; F40-V42 VanDerWaalsContact C-N 3.3Å; F40-V42 PolarHBondContact O-N 3.18Å; F40-L43 PolarHBondContact O-N 3.38Å; F40-E44 WeakPolarHBondContact O-CB 3.05Å; F40-E44 PolarHBondContact O-N 3.46Å; F40-F99 HydrophobicContact CE2-CE2 4.18Å; F40-F99 AromaticContact CE2-CZ 3.73Å; F40-F99 HydrophobicContact CE2-CZ 3.73Å; F40-F99 HydrophobicContact CZ-CE2 4.32Å; F40-F99 HydrophobicContact CZ-CZ 4.24Å; F40-R103 VanDerWaalsContact CZ-NH1 3.34Å
41D75.6Confident74.2Confident73 Ų7380.7 Ų80.739%0.3938%0.379SS..Hα-helixtrans-61-43.8177.1-59.8-18000109.8D38 V39 L43 E44 F45D38-D41 PolarHBondContact O-N 3.26Å; V39-D41 VanDerWaalsContact C-N 3.31Å; V39-D41 PolarHBondContact O-N 3.32Å; D41-L43 PolarHBondContact O-N 3.11Å; D41-E44 PolarHBondContact O-N 2.97Å; D41-F45 HydrophobicContact CB-CE2 4.45Å; D41-F45 WeakPolarHBondContact O-CD2 3.5Å; D41-F45 PolarHBondContact O-N 3.24Å
42V76.5Confident74.6Confident1 Ų181 Ų811%0.00638%0.381CS..Hα-helixtrans-64.6-40.5177.4-1710000111.6I25 V39 F40 F45 L46 A60 C61I25-V42 HydrophobicContact CG2-CG2 3.84Å; V39-V42 PolarHBondContact O-N 2.86Å; F40-V42 VanDerWaalsContact C-N 3.3Å; F40-V42 PolarHBondContact O-N 3.18Å; V42-F45 PolarHBondContact O-N 3.42Å; V42-L46 PolarHBondContact O-N 3.25Å; V42-L46 VanDerWaalsContact O-N 3.15Å; V42-A60 HydrophobicContact CG1-CB 4.15Å; V42-C61 WeakPolarHBondContact CG1-SG 3.46Å
43L78Confident75.2Confident13 Ų1381.1 Ų81.17%0.06838%0.378CS..Hα-helixtrans-67.2-34176.1-67.3176.3000112.6V39 F40 D41 F45 L46 C107 I110V39-L43 HydrophobicContact CG1-CD1 4.23Å; V39-L43 HydrophobicContact CG1-CG 4.33Å; V39-L43 WeakPolarHBondContact O-CG 3.02Å; V39-L43 PolarHBondContact O-N 3.09Å; F40-L43 PolarHBondContact O-N 3.38Å; D41-L43 PolarHBondContact O-N 3.11Å; L43-F45 VanDerWaalsContact C-N 3.34Å; L43-L46 HydrophobicContact CD2-CD1 3.83Å; L43-L46 WeakPolarHBondContact O-CB 3.26Å; L43-L46 PolarHBondContact O-N 3.46Å; L43-C107 HydrophobicContact CD2-CB 3.9Å; L43-I110 HydrophobicContact CD2-CD1 4.3Å
44E81.8Confident76Confident134 Ų13474.8 Ų74.863%0.62635%0.354SS*.Hα-helixtrans-65.8-39.3173.9-172.6176.8-179.300110.9F40 D41 L46 Q47 S48F40-E44 WeakPolarHBondContact O-CB 3.05Å; F40-E44 PolarHBondContact O-N 3.46Å; D41-E44 PolarHBondContact O-N 2.97Å; E44-L46 VanDerWaalsContact C-N 3.32Å; E44-L46 PolarHBondContact O-N 3.42Å; E44-Q47 PolarHBondContact O-N 3.08Å; E44-S48 PolarHBondContact O-N 3.47Å
45F78.3Confident77.1Confident52 Ų5267.6 Ų67.623%0.22832%0.324CS..Hα-helixtrans-69.3-25.9175.8-71.8-62.9000114I20 F22 D41 V42 L43 Q47 S48 A57I20-F45 HydrophobicContact CD1-CD1 4.19Å; I20-F45 HydrophobicContact CD1-CE1 3.38Å; I20-F45 HydrophobicContact CD1-CE2 4.15Å; I20-F45 HydrophobicContact CD1-CZ 3.38Å; I20-F45 HydrophobicContact CG1-CZ 4.33Å; I20-F45 HydrophobicContact CG2-CE2 4.4Å; F22-F45 HydrophobicContact CE1-CB 3.87Å; F22-F45 AromaticContact CE1-CD2 3.67Å; F22-F45 HydrophobicContact CE1-CD2 3.67Å; F22-F45 HydrophobicContact CE1-CE2 4.46Å; F22-F45 AromaticContact CE1-CG 3.78Å; F22-F45 HydrophobicContact CE1-CG 3.78Å; F22-F45 HydrophobicContact CZ-CB 4.17Å; F22-F45 HydrophobicContact CZ-CD1 4.33Å; F22-F45 HydrophobicContact CZ-CD2 4.16Å; F22-F45 AromaticContact CZ-CG 3.96Å; F22-F45 HydrophobicContact CZ-CG 3.96Å; D41-F45 HydrophobicContact CB-CE2 4.45Å; D41-F45 WeakPolarHBondContact O-CD2 3.5Å; D41-F45 PolarHBondContact O-N 3.24Å; V42-F45 PolarHBondContact O-N 3.42Å; L43-F45 VanDerWaalsContact C-N 3.34Å; F45-Q47 PolarHBondContact O-N 3.03Å; F45-S48 WeakPolarHBondContact O-CB 3.09Å; F45-S48 PolarHBondContact O-N 2.91Å; F45-A57 HydrophobicContact CB-CB 3.92Å
46L77.2Confident77.9Confident0 Ų066.9 Ų66.90%033%0.327CS..Hα-helixtrans-62.4-32.5169-70.7173.2000111.5V42 L43 E44 S48 A57 V58 I110 H114V42-L46 PolarHBondContact O-N 3.25Å; V42-L46 VanDerWaalsContact O-N 3.15Å; L43-L46 HydrophobicContact CD2-CD1 3.83Å; L43-L46 WeakPolarHBondContact O-CB 3.26Å; L43-L46 PolarHBondContact O-N 3.46Å; E44-L46 VanDerWaalsContact C-N 3.32Å; E44-L46 PolarHBondContact O-N 3.42Å; L46-S48 VanDerWaalsContact C-N 3.29Å; L46-S48 PolarHBondContact O-N 3.36Å; L46-A57 HydrophobicContact CD2-CB 3.76Å; L46-A57 HydrophobicContact CG-CB 4.05Å; L46-V58 HydrophobicContact CD2-CB 4.36Å; L46-V58 HydrophobicContact CD2-CG2 3.58Å; L46-I110 HydrophobicContact CB-CG2 3.81Å; L46-I110 HydrophobicContact CD1-CG2 4.14Å; L46-H114 PolarHBondContact O-CE1 3.08Å; L46-H114 PolarHBondContact O-NE2 2.96Å
47Q80.8Confident78.7Confident132 Ų13266.5 Ų66.562%0.61732%0.324SS*.THydrogen-bonded Turntrans-89.310.4179.2-62.1-177.3-15.300113.4E44 F45 I110E44-Q47 PolarHBondContact O-N 3.08Å; F45-Q47 PolarHBondContact O-N 3.03Å; Q47-I110 HydrophobicContact CG-CD1 4.46Å
48S80.3Confident79.2Confident37 Ų3761.5 Ų61.526%0.25930%0.297SS..  trans-70.2147.4179.2-177.20000112.1E44 F45 L46 K50 V54E44-S48 PolarHBondContact O-N 3.47Å; F45-S48 WeakPolarHBondContact O-CB 3.09Å; F45-S48 PolarHBondContact O-N 2.91Å; L46-S48 VanDerWaalsContact C-N 3.29Å; L46-S48 PolarHBondContact O-N 3.36Å; S48-K50 PolarHBondContact O-N 3.27Å; S48-K50 PolarHBondContact OG-N 3.02Å; S48-V54 WeakPolarHBondContact O-CG2 3.48Å
49E72.2Confident79.7Confident196 Ų19663.4 Ų63.492%0.91631%0.307SS*.SBendtrans-69.7-15.6173.6-64.8-179173.700113
50K81.1Confident80.1Confident137 Ų13763.6 Ų63.660%0.59631%0.309SS*.  trans-90.7110.6-177.1-71.8171.8179.8169.90111.4S48 K52 D53 V54S48-K50 PolarHBondContact O-N 3.27Å; S48-K50 PolarHBondContact OG-N 3.02Å; K50-K52 VanDerWaalsContact C-N 3.28Å; K50-K52 PolarHBondContact O-N 3.22Å; K50-K52 VanDerWaalsContact O-N 3.15Å; K50-D53 HydrophobicContact CB-CB 4.07Å; K50-D53 WeakPolarHBondContact CB-OD2 3.27Å; K50-D53 WeakPolarHBondContact CD-OD2 3.43Å; K50-D53 WeakPolarHBondContact O-CB 3.43Å; K50-D53 PolarHBondContact O-N 3.01Å; K50-V54 WeakPolarHBondContact O-CG2 3.5Å; K50-V54 PolarHBondContact O-N 3.37Å
51E81.8Confident80.5Confident84 Ų8459.6 Ų59.639%0.39329%0.291SS..Hα-helixtrans-49.8-43.3-179.7-58173.9159.800113.9D53 V54 I55 T119 V122E51-D53 VanDerWaalsContact C-N 3.34Å; E51-D53 PolarHBondContact O-N 3.48Å; E51-V54 PolarHBondContact O-N 3.39Å; E51-I55 WeakPolarHBondContact O-CG1 3.33Å; E51-I55 PolarHBondContact O-N 3.22Å; E51-T119 WeakPolarHBondContact OE1-CB 3.45Å; E51-T119 WeakPolarHBondContact OE1-CG2 3.28Å; E51-T119 PolarHBondContact OE1-OG1 3.41Å; E51-V122 HydrophobicContact CB-CG2 4.19Å; E51-V122 HydrophobicContact CG-CG2 4.47Å
52K81.3Confident80.9Confident169 Ų16956.7 Ų56.774%0.73528%0.277SS*.Hα-helixtrans-65.6-37.6179.3-65.4-171.7178.4-174.90112.8K50 V54 C56K50-K52 VanDerWaalsContact C-N 3.28Å; K50-K52 PolarHBondContact O-N 3.22Å; K50-K52 VanDerWaalsContact O-N 3.15Å; K52-V54 VanDerWaalsContact C-N 3.35Å; K52-C56 PolarHBondContact O-N 2.95Å; K52-C56 VanDerWaalsContact O-N 3.1Å; K52-C56 PolarHBondContact O-SG 3.42Å; K52-C56 VanDerWaalsContact O-SG 3.34Å
53D81.4Confident81.2Confident43 Ų4361.4 Ų61.423%0.2330%0.297CS..Hα-helixtrans-71.7-36.9179-63-16.4000109.6K50 E51 C56 A57K50-D53 HydrophobicContact CB-CB 4.07Å; K50-D53 WeakPolarHBondContact CB-OD2 3.27Å; K50-D53 WeakPolarHBondContact CD-OD2 3.43Å; K50-D53 WeakPolarHBondContact O-CB 3.43Å; K50-D53 PolarHBondContact O-N 3.01Å; E51-D53 VanDerWaalsContact C-N 3.34Å; E51-D53 PolarHBondContact O-N 3.48Å; D53-C56 PolarHBondContact O-N 3.39Å; D53-A57 VanDerWaalsContact O-CB 3.3Å; D53-A57 WeakPolarHBondContact O-CB 3.38Å; D53-A57 PolarHBondContact O-N 3Å
54V82.7Confident81.4Confident3 Ų360.8 Ų60.82%0.01829%0.294CS..Hα-helixtrans-61.6-49.3173.2178.70000110.8S48 K50 E51 K52 C56 A57 V58 V122S48-V54 WeakPolarHBondContact O-CG2 3.48Å; K50-V54 WeakPolarHBondContact O-CG2 3.5Å; K50-V54 PolarHBondContact O-N 3.37Å; E51-V54 PolarHBondContact O-N 3.39Å; K52-V54 VanDerWaalsContact C-N 3.35Å; V54-C56 PolarHBondContact O-N 3.02Å; V54-A57 CarbonylContact O-C 3.59Å; V54-A57 WeakPolarHBondContact O-CB 3.32Å; V54-A57 PolarHBondContact O-N 3.14Å; V54-A57 VanDerWaalsContact O-N 3.12Å; V54-V58 HydrophobicContact CG1-CG2 4.31Å; V54-V58 VanDerWaalsContact O-CG2 3.29Å; V54-V58 WeakPolarHBondContact O-CG2 3.49Å; V54-V58 PolarHBondContact O-N 3.35Å; V54-V122 HydrophobicContact CG1-CG1 3.91Å
55I83.7Confident81.4Confident38 Ų3854.4 Ų54.420%0.19526%0.264CS..Hα-helixtrans-59.6-45.7178.9-66.1164.3000111E51 A57 V58 D59 E121 V122E51-I55 WeakPolarHBondContact O-CG1 3.33Å; E51-I55 PolarHBondContact O-N 3.22Å; I55-A57 VanDerWaalsContact C-N 3.32Å; I55-A57 PolarHBondContact O-N 3.05Å; I55-V58 PolarHBondContact O-N 3Å; I55-D59 PolarHBondContact O-N 3.48Å; I55-E121 HydrophobicContact CD1-CB 4.14Å; I55-V122 HydrophobicContact CD1-CG2 4.47Å; I55-V122 HydrophobicContact CG1-CG2 4.28Å
56C82.4Confident81.6Confident58 Ų5852.5 Ų52.539%0.39226%0.257SS..Hα-helixtrans-62.7-37.8176-700000112.7F22 K52 D53 V54 D59 A60F22-C56 HydrophobicContact CD2-CB 3.86Å; F22-C56 HydrophobicContact CE2-CB 3.91Å; K52-C56 PolarHBondContact O-N 2.95Å; K52-C56 VanDerWaalsContact O-N 3.1Å; K52-C56 PolarHBondContact O-SG 3.42Å; K52-C56 VanDerWaalsContact O-SG 3.34Å; D53-C56 PolarHBondContact O-N 3.39Å; V54-C56 PolarHBondContact O-N 3.02Å; C56-D59 PolarHBondContact O-N 3.26Å; C56-A60 WeakPolarHBondContact O-CB 3.26Å; C56-A60 PolarHBondContact O-N 3.46Å
57A82.4Confident81.7Confident0 Ų054.6 Ų54.60%027%0.27CS..Hα-helixtrans-67.7-38.7175.200000112F22 F45 L46 D53 V54 I55 A60 C61F22-A57 HydrophobicContact CE1-CB 4.32Å; F45-A57 HydrophobicContact CB-CB 3.92Å; L46-A57 HydrophobicContact CD2-CB 3.76Å; L46-A57 HydrophobicContact CG-CB 4.05Å; D53-A57 VanDerWaalsContact O-CB 3.3Å; D53-A57 WeakPolarHBondContact O-CB 3.38Å; D53-A57 PolarHBondContact O-N 3Å; V54-A57 CarbonylContact O-C 3.59Å; V54-A57 WeakPolarHBondContact O-CB 3.32Å; V54-A57 PolarHBondContact O-N 3.14Å; V54-A57 VanDerWaalsContact O-N 3.12Å; I55-A57 VanDerWaalsContact C-N 3.32Å; I55-A57 PolarHBondContact O-N 3.05Å; A57-A60 WeakPolarHBondContact O-CB 3.48Å; A57-A60 PolarHBondContact O-N 3.46Å; A57-C61 WeakPolarHBondContact O-CB 3.32Å; A57-C61 PolarHBondContact O-N 3.04Å; A57-C61 PolarHBondContact O-SG 3.15Å
58V84Confident81.6Confident1 Ų148.4 Ų48.41%0.00624%0.241CC..Hα-helixtrans-60.6-45.7173.7173.10000110.5L46 V54 I55 A60 C61 C62 L111 S125 C129L46-V58 HydrophobicContact CD2-CB 4.36Å; L46-V58 HydrophobicContact CD2-CG2 3.58Å; V54-V58 HydrophobicContact CG1-CG2 4.31Å; V54-V58 VanDerWaalsContact O-CG2 3.29Å; V54-V58 WeakPolarHBondContact O-CG2 3.49Å; V54-V58 PolarHBondContact O-N 3.35Å; I55-V58 PolarHBondContact O-N 3Å; V58-A60 VanDerWaalsContact C-N 3.34Å; V58-A60 PolarHBondContact O-N 3.05Å; V58-C61 PolarHBondContact O-N 3.25Å; V58-C62 WeakPolarHBondContact O-CB 3.4Å; V58-C62 PolarHBondContact O-N 3.07Å; V58-L111 HydrophobicContact CB-CD2 4.42Å; V58-L111 HydrophobicContact CG1-CD2 3.95Å; V58-L111 HydrophobicContact CG2-CD2 3.75Å; V58-S125 WeakPolarHBondContact CG1-OG 3.24Å; V58-C129 HydrophobicContact CG1-CB 3.56Å
59D83.9Confident81.5Confident74 Ų7446.9 Ų46.940%0.39623%0.23SC..Hα-helixtrans-63.7-39.5176.3-77.9-26.3000112.3I55 C56 C62 K63I55-D59 PolarHBondContact O-N 3.48Å; C56-D59 PolarHBondContact O-N 3.26Å; D59-C62 WeakPolarHBondContact O-CB 3.22Å; D59-C62 PolarHBondContact O-N 3.15Å; D59-K63 WeakPolarHBondContact O-CG 3.46Å; D59-K63 PolarHBondContact O-N 2.95Å
60A82.1Confident81.8Confident5 Ų542.9 Ų42.94%0.04121%0.21CC..Hα-helixtrans-64.4-46175.900000111.7F22 V26 V42 C56 A57 V58 C62 K63 L64F22-A60 HydrophobicContact CB-CB 4.08Å; F22-A60 HydrophobicContact CD1-CB 4.44Å; V26-A60 HydrophobicContact CG2-CB 3.8Å; V26-A60 WeakPolarHBondContact CG2-O 3.48Å; V42-A60 HydrophobicContact CG1-CB 4.15Å; C56-A60 WeakPolarHBondContact O-CB 3.26Å; C56-A60 PolarHBondContact O-N 3.46Å; A57-A60 WeakPolarHBondContact O-CB 3.48Å; A57-A60 PolarHBondContact O-N 3.46Å; V58-A60 VanDerWaalsContact C-N 3.34Å; V58-A60 PolarHBondContact O-N 3.05Å; A60-C62 VanDerWaalsContact C-N 3.34Å; A60-K63 PolarHBondContact O-N 3.31Å; A60-L64 VanDerWaalsContact O-CB 3.31Å; A60-L64 WeakPolarHBondContact O-CB 3.41Å; A60-L64 PolarHBondContact O-N 3.13Å
61C82.9Confident81.7Confident1 Ų142.9 Ų42.91%0.00721%0.206CC..Hα-helixtrans-61.4-41.5173.6-78.50000111.9V42 A57 V58 L64 F65V42-C61 WeakPolarHBondContact CG1-SG 3.46Å; A57-C61 WeakPolarHBondContact O-CB 3.32Å; A57-C61 PolarHBondContact O-N 3.04Å; A57-C61 PolarHBondContact O-SG 3.15Å; V58-C61 PolarHBondContact O-N 3.25Å; C61-L64 PolarHBondContact O-N 3.3Å; C61-F65 HydrophobicContact CB-CD2 4.31Å; C61-F65 WeakPolarHBondContact O-CD2 3.49Å; C61-F65 PolarHBondContact O-N 3.41Å
62C83.7Confident81.1Confident12 Ų1245.2 Ų45.28%0.08122%0.215CC..Hα-helixtrans-58.1-53.8175.5-174.60000110.5V58 D59 A60 L64 C66 C129 K132V58-C62 WeakPolarHBondContact O-CB 3.4Å; V58-C62 PolarHBondContact O-N 3.07Å; D59-C62 WeakPolarHBondContact O-CB 3.22Å; D59-C62 PolarHBondContact O-N 3.15Å; A60-C62 VanDerWaalsContact C-N 3.34Å; C62-L64 PolarHBondContact O-N 3.41Å; C62-C66 WeakPolarHBondContact O-CB 3.43Å; C62-C66 PolarHBondContact O-N 3.15Å; C62-C66 PolarHBondContact O-SG 3.04Å; C62-C129 VanDerWaalsContact CB-SG 3.57Å; C62-K132 WeakPolarHBondContact SG-CD 3.4Å
63K83.8Confident80.5Confident100 Ų10038.5 Ų38.544%0.43519%0.187SC..Hα-helixtrans-58.4-46.3177.8-72.4173.8-179.2170.60111.7E23 V26 D59 A60 T67E23-K63 IonicContact OE1-NZ 3.96Å; E23-K63 PolarHBondContact OE1-NZ 3.4Å; V26-K63 HydrophobicContact CG1-CB 4.3Å; D59-K63 WeakPolarHBondContact O-CG 3.46Å; D59-K63 PolarHBondContact O-N 2.95Å; A60-K63 PolarHBondContact O-N 3.31Å; K63-T67 WeakPolarHBondContact O-CB 3.27Å; K63-T67 VanDerWaalsContact O-CG2 3.23Å; K63-T67 WeakPolarHBondContact O-CG2 3.37Å; K63-T67 PolarHBondContact O-N 3.24Å; K63-T67 PolarHBondContact O-OG1 3.46Å
64L82.5Confident80Confident1 Ų136.6 Ų36.61%0.00518%0.177CC..Hα-helixtrans-63.5-56.2-177.8179.967.2000112V26 I29 L30 V39 A60 C61 C62 T67 L68V26-L64 HydrophobicContact CG1-CB 4.03Å; V26-L64 HydrophobicContact CG1-CD1 4.24Å; V26-L64 HydrophobicContact CG2-CB 4.32Å; I29-L64 HydrophobicContact CB-CD1 3.97Å; I29-L64 HydrophobicContact CD1-CD1 4.46Å; I29-L64 HydrophobicContact CD1-CD2 4.23Å; I29-L64 HydrophobicContact CG2-CD1 3.64Å; L30-L64 HydrophobicContact CD2-CD1 4.07Å; L30-L64 HydrophobicContact CG-CD1 4.12Å; V39-L64 HydrophobicContact CG2-CD2 4.02Å; A60-L64 VanDerWaalsContact O-CB 3.31Å; A60-L64 WeakPolarHBondContact O-CB 3.41Å; A60-L64 PolarHBondContact O-N 3.13Å; C61-L64 PolarHBondContact O-N 3.3Å; C62-L64 PolarHBondContact O-N 3.41Å; L64-T67 PolarHBondContact O-N 3.19Å; L64-T67 PolarHBondContact O-OG1 3.29Å; L64-L68 HydrophobicContact CD1-CD1 4.07Å; L64-L68 HydrophobicContact CG-CD1 3.93Å; L64-L68 VanDerWaalsContact O-CG 3.25Å; L64-L68 WeakPolarHBondContact O-CG 3.5Å; L64-L68 PolarHBondContact O-N 2.95Å
65F81.7Confident79.1Confident0 Ų038.4 Ų38.40%018%0.184CC..Hα-helixtrans-76.1-32.5-173.3-70.7-64.4000112.8V39 C61 T67 L68 L69 M100 R103 Y104 C107 F133V39-F65 HydrophobicContact CG1-CZ 4.25Å; C61-F65 HydrophobicContact CB-CD2 4.31Å; C61-F65 WeakPolarHBondContact O-CD2 3.49Å; C61-F65 PolarHBondContact O-N 3.41Å; F65-T67 VanDerWaalsContact C-N 3.31Å; F65-T67 PolarHBondContact O-N 2.97Å; F65-L68 HydrophobicContact CD1-CD1 3.9Å; F65-L68 HydrophobicContact CE1-CD1 4.29Å; F65-L68 PolarHBondContact O-N 3.22Å; F65-L69 WeakPolarHBondContact O-CB 3.21Å; F65-L69 VanDerWaalsContact O-CG 3.27Å; F65-L69 WeakPolarHBondContact O-CG 3.48Å; F65-L69 PolarHBondContact O-N 3.3Å; F65-M100 HydrophobicContact CE1-CE 4.48Å; F65-R103 HydrophobicContact CZ-CB 4.34Å; F65-Y104 HydrophobicContact CB-CD2 3.77Å; F65-Y104 HydrophobicContact CB-CE2 4.04Å; F65-Y104 AromaticContact CD1-CD2 3.67Å; F65-Y104 HydrophobicContact CD1-CD2 3.67Å; F65-Y104 HydrophobicContact CD1-CG 4.31Å; F65-Y104 HydrophobicContact CD2-CD2 4.28Å; F65-Y104 HydrophobicContact CE1-CD2 4.29Å; F65-Y104 AromaticContact CG-CD2 3.66Å; F65-Y104 HydrophobicContact CG-CD2 3.66Å; F65-Y104 HydrophobicContact CG-CE2 4.38Å; F65-C107 HydrophobicContact CD2-CB 4.3Å; F65-C107 HydrophobicContact CE2-CB 3.68Å; F65-C107 HydrophobicContact CZ-CB 4.33Å; F65-F133 HydrophobicContact CB-CD1 4.5Å; F65-F133 HydrophobicContact CB-CE1 3.63Å; F65-F133 HydrophobicContact CB-CZ 3.76Å; F65-F133 HydrophobicContact CD2-CZ 4Å; F65-F133 HydrophobicContact CG-CZ 4.32Å
66C81.3Confident78.3Confident12 Ų1239.1 Ų39.18%0.08119%0.188CC..Hα-helixtrans-63-38.8171.5-670000111.6C62 K70 E136C62-C66 WeakPolarHBondContact O-CB 3.43Å; C62-C66 PolarHBondContact O-N 3.15Å; C62-C66 PolarHBondContact O-SG 3.04Å; C66-K70 WeakPolarHBondContact O-CG 3.19Å; C66-K70 PolarHBondContact O-N 3.38Å; C66-K70 VanDerWaalsContact O-N 3.1Å; C66-E136 HydrophobicContact CB-CG 4.04Å
67T80.1Confident77.4Confident44 Ų4437.3 Ų37.327%0.2718%0.179SC..Hα-helixtrans-72-35176.850.70000112.6L30 K63 L64 F65 K70 R71L30-T67 HydrophobicContact CD1-CG2 4.41Å; L30-T67 WeakPolarHBondContact CD1-OG1 3.48Å; L30-T67 VanDerWaalsContact CD2-OG1 3.24Å; L30-T67 WeakPolarHBondContact CD2-OG1 3.23Å; K63-T67 WeakPolarHBondContact O-CB 3.27Å; K63-T67 VanDerWaalsContact O-CG2 3.23Å; K63-T67 WeakPolarHBondContact O-CG2 3.37Å; K63-T67 PolarHBondContact O-N 3.24Å; K63-T67 PolarHBondContact O-OG1 3.46Å; L64-T67 PolarHBondContact O-N 3.19Å; L64-T67 PolarHBondContact O-OG1 3.29Å; F65-T67 VanDerWaalsContact C-N 3.31Å; F65-T67 PolarHBondContact O-N 2.97Å; T67-K70 PolarHBondContact O-N 3.49Å; T67-R71 WeakPolarHBondContact O-CG 3.29Å; T67-R71 PolarHBondContact O-N 3.44Å; T67-R71 VanDerWaalsContact O-N 3.09Å
68L78Confident76.4Confident2 Ų246.9 Ų46.91%0.0122%0.221CC..Hα-helixtrans-66.6-39.1173.4-70.5167000112.5L30 L64 F65 R71 K72 D73 L74 M100L30-L68 HydrophobicContact CD2-CD2 4.3Å; L30-L68 HydrophobicContact CD2-CG 4.32Å; L64-L68 HydrophobicContact CD1-CD1 4.07Å; L64-L68 HydrophobicContact CG-CD1 3.93Å; L64-L68 VanDerWaalsContact O-CG 3.25Å; L64-L68 WeakPolarHBondContact O-CG 3.5Å; L64-L68 PolarHBondContact O-N 2.95Å; F65-L68 HydrophobicContact CD1-CD1 3.9Å; F65-L68 HydrophobicContact CE1-CD1 4.29Å; F65-L68 PolarHBondContact O-N 3.22Å; L68-R71 PolarHBondContact O-N 3.12Å; L68-K72 PolarHBondContact O-N 3.08Å; L68-D73 HydrophobicContact CD2-CB 3.86Å; L68-D73 PolarHBondContact O-N 2.76Å; L68-D73 VanDerWaalsContact O-N 3.11Å; L68-L74 HydrophobicContact CB-CD1 4.46Å; L68-L74 HydrophobicContact CB-CG 4.34Å; L68-M100 HydrophobicContact CD1-CE 3.28Å; L68-M100 HydrophobicContact CD2-CE 4.45Å
69L77.8Confident75.4Confident4 Ų449.4 Ų49.42%0.02123%0.234CC..Hα-helixtrans-60.4-47.1173.1-75.6164.7000110.9F65 R71 K72 L74 Y104 E136 Q137 L142F65-L69 WeakPolarHBondContact O-CB 3.21Å; F65-L69 VanDerWaalsContact O-CG 3.27Å; F65-L69 WeakPolarHBondContact O-CG 3.48Å; F65-L69 PolarHBondContact O-N 3.3Å; L69-R71 VanDerWaalsContact C-N 3.28Å; L69-R71 PolarHBondContact O-N 3.23Å; L69-K72 PolarHBondContact O-N 3.31Å; L69-K72 VanDerWaalsContact O-N 3.07Å; L69-L74 HydrophobicContact CD2-CD1 3.43Å; L69-L74 VanDerWaalsContact CD2-CD1 3.43Å; L69-L74 HydrophobicContact CG-CD1 3.65Å; L69-Y104 HydrophobicContact CD1-CE2 4.31Å; L69-E136 HydrophobicContact CB-CB 4.18Å; L69-E136 HydrophobicContact CD1-CB 3.72Å; L69-Q137 HydrophobicContact CD1-CG 4.46Å; L69-L142 HydrophobicContact CD2-CD1 3.79Å; L69-L142 HydrophobicContact CD2-CD2 3.83Å; L69-L142 HydrophobicContact CD2-CG 4.02Å
70K79.1Confident74.4Confident113 Ų11347.2 Ų47.249%0.49122%0.223SC..Hα-helixtrans-59-36.2175.9-73.3175.1-171.8179.70113.8C66 T67 K72 E136C66-K70 WeakPolarHBondContact O-CG 3.19Å; C66-K70 PolarHBondContact O-N 3.38Å; C66-K70 VanDerWaalsContact O-N 3.1Å; T67-K70 PolarHBondContact O-N 3.49Å; K70-K72 VanDerWaalsContact C-N 3.3Å; K70-E136 WeakPolarHBondContact CE-OE1 3.24Å; K70-E136 WeakPolarHBondContact CE-OE2 3.36Å; K70-E136 IonicContact NZ-OE1 3.35Å; K70-E136 PolarHBondContact NZ-OE1 3.34Å; K70-E136 IonicContact NZ-OE2 3.2Å
71R78.6Confident73.4Confident137 Ų13748.6 Ų48.652%0.51724%0.239SC..Hα-helixtrans-80.7-8.6179-70.6178.7-178.5-175.81.8113.7L30 T67 L68 L69 D73L30-R71 PolarHBondContact O-NH1 3.45Å; T67-R71 WeakPolarHBondContact O-CG 3.29Å; T67-R71 PolarHBondContact O-N 3.44Å; T67-R71 VanDerWaalsContact O-N 3.09Å; L68-R71 PolarHBondContact O-N 3.12Å; L69-R71 VanDerWaalsContact C-N 3.28Å; L69-R71 PolarHBondContact O-N 3.23Å; R71-D73 HydrophobicContact CB-CB 4.28Å; R71-D73 VanDerWaalsContact CB-OD2 3.28Å; R71-D73 WeakPolarHBondContact CB-OD2 3.45Å; R71-D73 WeakPolarHBondContact CD-OD2 3.31Å; R71-D73 PolarHBondContact O-N 2.75Å
72K70.1Confident72.4Confident132 Ų13252.3 Ų52.357%0.57426%0.256SS*.THydrogen-bonded Turntrans55.834.4-170.3-55.3-177.8177.8-174.90112.4L68 L69 K70 L74L68-K72 PolarHBondContact O-N 3.08Å; L69-K72 PolarHBondContact O-N 3.31Å; L69-K72 VanDerWaalsContact O-N 3.07Å; K70-K72 VanDerWaalsContact C-N 3.3Å; K72-L74 PolarHBondContact O-N 2.89Å
73D68Low70.9Confident28 Ų2857.6 Ų57.615%0.1528%0.283CS..  trans-86.110.3178.5-79.7-32.8000112.5R33 L68 R71 K97R33-D73 IonicContact NH2-OD1 3.23Å; L68-D73 HydrophobicContact CD2-CB 3.86Å; L68-D73 PolarHBondContact O-N 2.76Å; L68-D73 VanDerWaalsContact O-N 3.11Å; R71-D73 HydrophobicContact CB-CB 4.28Å; R71-D73 VanDerWaalsContact CB-OD2 3.28Å; R71-D73 WeakPolarHBondContact CB-OD2 3.45Å; R71-D73 WeakPolarHBondContact CD-OD2 3.31Å; R71-D73 PolarHBondContact O-N 2.75Å; D73-K97 WeakPolarHBondContact O-CG 3.19Å
74L72.1Confident69.6Low4 Ų459.4 Ų59.42%0.02129%0.293CS..SBendtrans-107.6149.7175.2-67.9169.2000109.9L68 L69 K72 I76 M100 L142L68-L74 HydrophobicContact CB-CD1 4.46Å; L68-L74 HydrophobicContact CB-CG 4.34Å; L69-L74 HydrophobicContact CD2-CD1 3.43Å; L69-L74 VanDerWaalsContact CD2-CD1 3.43Å; L69-L74 HydrophobicContact CG-CD1 3.65Å; K72-L74 PolarHBondContact O-N 2.89Å; L74-I76 PolarHBondContact O-N 3.4Å; L74-M100 HydrophobicContact CD2-CB 3.71Å; L74-L142 HydrophobicContact CB-CD2 3.67Å; L74-L142 HydrophobicContact CD1-CD2 4.05Å
75F63.1Low68.3Low40 Ų4059.8 Ų59.818%0.17530%0.296CS..  trans-66.3129.8178.8-174.7-100.4000110.5K97 I98 R101F75-K97 HydrophobicContact CB-CB 4.01Å; F75-K97 PolarHBondContact N-O 3.17Å; F75-I98 HydrophobicContact CB-CG1 3.97Å; F75-I98 HydrophobicContact CD1-CG1 4.2Å; F75-I98 HydrophobicContact CD2-CD1 4.13Å; F75-I98 HydrophobicContact CD2-CG1 3.5Å; F75-I98 VanDerWaalsContact CD2-CG1 3.5Å; F75-I98 HydrophobicContact CE2-CD1 4.14Å; F75-I98 HydrophobicContact CE2-CG1 3.98Å; F75-I98 HydrophobicContact CG-CG1 3.62Å; F75-R101 HydrophobicContact CB-CB 4.25Å
76I67Low67Low54 Ų5465.6 Ų65.628%0.27733%0.326SS..  trans-101130.1176.3-57.7173.3000106.9L74 L142 D144L74-I76 PolarHBondContact O-N 3.4Å; I76-L142 WeakPolarHBondContact CA-O 3.13Å; I76-D144 HydrophobicContact CG2-CB 4.17Å; I76-D144 WeakPolarHBondContact CG2-OD1 3.35Å
77G63.3Low65.6Low19 Ų1973.6 Ų73.620%0.19636%0.36CS..SBendtrans113.4-175.7-18000000114.4L79 L142G77-L79 PolarHBondContact O-N 3.28Å; G77-L142 PolarHBondContact N-O 3.01Å
78K60.8Low64.4Low202 Ų20272.6 Ų72.688%0.87836%0.358SS*.SBendtrans-66.1120.1-177.4-71.1-174.8-179.2177.80110.5P80K78-P80 VanDerWaalsContact O-CD 3.23Å; K78-P80 WeakPolarHBondContact O-CD 3.49Å
79L63.2Low63.1Low54 Ų5482.2 Ų82.228%0.28340%0.403SS..  trans-72.6113.8-170.9-145.1167.1000110.4G77 I98 R101 H102 N105G77-L79 PolarHBondContact O-N 3.28Å; L79-I98 HydrophobicContact CD2-CG2 4.45Å; L79-R101 HydrophobicContact CD1-CB 4.23Å; L79-R101 HydrophobicContact CD1-CG 3.28Å; L79-R101 HydrophobicContact CG-CG 3.91Å; L79-H102 WeakPolarHBondContact CD2-CE1 3.5Å; L79-H102 WeakPolarHBondContact CD2-NE2 3.3Å; L79-N105 VanDerWaalsContact CD1-ND2 3.31Å; L79-N105 WeakPolarHBondContact CD1-ND2 3.35Å
80P62.3Low62.3Low27 Ų2785.5 Ų85.518%0.17542%0.418CS..  trans-71.2150.5174.926.6-30.2000111K78 A85 I98 H102K78-P80 VanDerWaalsContact O-CD 3.23Å; K78-P80 WeakPolarHBondContact O-CD 3.49Å; P80-A85 HydrophobicContact CG-CB 4.18Å; P80-I98 HydrophobicContact CG-CD1 3.93Å; P80-I98 HydrophobicContact CG-CG1 4.42Å; P80-I98 HydrophobicContact CG-CG2 4.33Å; P80-H102 PolarHBondContact O-NE2 3.02Å; P80-H102 VanDerWaalsContact O-NE2 3.11Å
81G62.9Low61.8Low35 Ų3582.3 Ų82.336%0.36141%0.41SS..  trans-57.6145177.300000111.5D83 E84 A85G81-D83 PolarHBondContact O-N 2.91Å; G81-D83 VanDerWaalsContact O-N 3.1Å; G81-E84 PolarHBondContact O-N 2.66Å; G81-A85 PolarHBondContact O-N 2.99Å
82E60.3Low61.3Low79 Ų7981.4 Ų81.437%0.36942%0.422SS..Hα-helixtrans-51.5-39.3-177.2-74.2-168.415000112.2E84 I86 H102 R103E82-E84 PolarHBondContact O-N 3.15Å; E82-I86 VanDerWaalsContact O-CD1 3.31Å; E82-I86 WeakPolarHBondContact O-CD1 3.46Å; E82-I86 VanDerWaalsContact O-CG1 3.23Å; E82-I86 WeakPolarHBondContact O-CG1 3.24Å; E82-I86 PolarHBondContact O-N 3.18Å; E82-H102 HydrophobicContact CG-CB 4.3Å; E82-H102 WeakPolarHBondContact CG-CD2 3.4Å; E82-H102 VanDerWaalsContact CG-NE2 3.33Å; E82-H102 WeakPolarHBondContact CG-NE2 3.42Å; E82-H102 VanDerWaalsContact OE1-CB 3.3Å; E82-H102 WeakPolarHBondContact OE1-CB 3.38Å; E82-H102 IonicContact OE1-CD2 3.75Å; E82-H102 IonicContact OE1-CG 3.02Å; E82-H102 IonicContact OE1-ND1 3.49Å; E82-R103 IonicContact OE1-CZ 3.74Å; E82-R103 IonicContact OE1-NH2 2.69Å; E82-R103 PolarHBondContact OE1-NH2 3.48Å; E82-R103 IonicContact OE2-NH2 3.69Å
83D53.8Low61.2Low123 Ų12377.4 Ų77.466%0.65841%0.406SS*.Hα-helixtrans-71.6-25.2179-70.7-34.6000114G81 K87G81-D83 PolarHBondContact O-N 2.91Å; G81-D83 VanDerWaalsContact O-N 3.1Å; D83-K87 WeakPolarHBondContact O-CD 3.21Å; D83-K87 VanDerWaalsContact O-CG 3.31Å; D83-K87 WeakPolarHBondContact O-CG 3.41Å
84E56.5Low61.4Low138 Ų13879.8 Ų79.865%0.64542%0.417SS*.Hα-helixtrans-85.9-38178.6-68.7179.6163.800111.3G81 E82 I86 K87 G88G81-E84 PolarHBondContact O-N 2.66Å; E82-E84 PolarHBondContact O-N 3.15Å; E84-I86 VanDerWaalsContact C-N 3.31Å; E84-I86 PolarHBondContact O-N 3.29Å; E84-K87 PolarHBondContact O-N 3.19Å; E84-G88 PolarHBondContact O-N 2.91Å
85A54.4Low61.5Low8 Ų883.4 Ų83.47%0.06643%0.432CS..Hα-helixtrans-65.3-32.3176.600000113.2P80 G81 K95 I98P80-A85 HydrophobicContact CG-CB 4.18Å; G81-A85 PolarHBondContact O-N 2.99Å; A85-K95 WeakPolarHBondContact O-CE 3.4Å; A85-I98 HydrophobicContact CB-CB 4.45Å; A85-I98 HydrophobicContact CB-CD1 4.08Å; A85-I98 HydrophobicContact CB-CG2 3.65Å
86I54.9Low62.2Low122 Ų12283 Ų8363%0.62643%0.43SS*.Hα-helixtrans-71.5-35.9175.4-65.3165.1000110.7E82 E84 K95E82-I86 VanDerWaalsContact O-CD1 3.31Å; E82-I86 WeakPolarHBondContact O-CD1 3.46Å; E82-I86 VanDerWaalsContact O-CG1 3.23Å; E82-I86 WeakPolarHBondContact O-CG1 3.24Å; E82-I86 PolarHBondContact O-N 3.18Å; E84-I86 VanDerWaalsContact C-N 3.31Å; E84-I86 PolarHBondContact O-N 3.29Å; I86-K95 PolarHBondContact O-NZ 3.22Å
87K50.5Low62.7Low181 Ų18182.7 Ų82.779%0.78743%0.426SS*.Hα-helixtrans-87.6-23-176.7-69.3177-173.8170.90114.5D83 E84D83-K87 WeakPolarHBondContact O-CD 3.21Å; D83-K87 VanDerWaalsContact O-CG 3.31Å; D83-K87 WeakPolarHBondContact O-CG 3.41Å; E84-K87 PolarHBondContact O-N 3.19Å
88G55.7Low63.4Low23 Ų2381.9 Ų81.924%0.23742%0.418CS..SBendtrans-70.6156.9-179.500000114.6E84 H90 K95E84-G88 PolarHBondContact O-N 2.91Å; G88-H90 PolarHBondContact O-N 3.45Å; G88-K95 WeakPolarHBondContact O-CE 3.42Å; G88-K95 PolarHBondContact O-NZ 3.42Å
89E51.8Low64.3Low203 Ų20375 Ų7595%0.94939%0.388SS*.  trans-72.561.4168.8-66.8-170.2166.500110.7
90H60.3Low65.1Low73 Ų7372.5 Ų72.534%0.33838%0.375SS..  trans-102.8143.4175.9-62.8-6.8000109.6G88 E94 K95G88-H90 PolarHBondContact O-N 3.45Å; H90-E94 HydrophobicContact CB-CB 4.1Å; H90-K95 HydrophobicContact CB-CG 3.98Å; H90-K95 VanDerWaalsContact O-CE 3.28Å; H90-K95 WeakPolarHBondContact O-CE 3.36Å
91S68.8Low65.9Low47 Ų4772.7 Ų72.733%0.32937%0.372SS..  trans-60.9154.6176.266.60000110.7D93 E94 K95S91-D93 PolarHBondContact O-N 3.28Å; S91-D93 VanDerWaalsContact O-N 3.11Å; S91-E94 WeakPolarHBondContact CB-OE2 3.33Å; S91-E94 PolarHBondContact N-OE2 3.4Å; S91-E94 PolarHBondContact O-N 3.07Å; S91-E94 VanDerWaalsContact O-N 3.09Å; S91-E94 VanDerWaalsContact OG-CG 3.27Å; S91-E94 WeakPolarHBondContact OG-CG 3.37Å; S91-E94 PolarHBondContact OG-N 3.2Å; S91-E94 PolarHBondContact OG-OE2 3.35Å; S91-K95 PolarHBondContact O-N 2.98Å
92P67.1Low66.8Low117 Ų11772.5 Ų72.576%0.7636%0.362SS*.Hα-helixtrans-55.9-29.7177-24.333.3000113.4Y96P92-Y96 PolarHBondContact O-N 3.14Å
93D69Low67.9Low48 Ų4870.1 Ų70.126%0.25735%0.349SS..Hα-helixtrans-71.2-43.4176.6-165.960.7000111.8R33 S91 Y96 K97R33-D93 IonicContact CZ-OD1 3.05Å; R33-D93 VanDerWaalsContact CZ-OD1 3.28Å; R33-D93 IonicContact NH1-OD1 3.94Å; R33-D93 PolarHBondContact NH1-OD1 2.91Å; R33-D93 IonicContact NH2-OD1 3.37Å; R33-D93 PolarHBondContact NH2-OD1 2.93Å; S91-D93 PolarHBondContact O-N 3.28Å; S91-D93 VanDerWaalsContact O-N 3.11Å; D93-Y96 PolarHBondContact O-N 3.46Å; D93-K97 WeakPolarHBondContact O-CG 3.25Å; D93-K97 PolarHBondContact O-N 2.99Å; D93-K97 WeakPolarHBondContact OD2-CE 3.45Å; D93-K97 IonicContact OD2-NZ 3.6Å; D93-K97 PolarHBondContact OD2-NZ 3.43Å
94E71.9Confident69.4Low79 Ų7964.3 Ų64.337%0.36932%0.318SS..Hα-helixtrans-66.1-40.4175.1-73.7160.3163.900112H90 S91 Y96 K97 I98H90-E94 HydrophobicContact CB-CB 4.1Å; S91-E94 WeakPolarHBondContact CB-OE2 3.33Å; S91-E94 PolarHBondContact N-OE2 3.4Å; S91-E94 PolarHBondContact O-N 3.07Å; S91-E94 VanDerWaalsContact O-N 3.09Å; S91-E94 VanDerWaalsContact OG-CG 3.27Å; S91-E94 WeakPolarHBondContact OG-CG 3.37Å; S91-E94 PolarHBondContact OG-N 3.2Å; S91-E94 PolarHBondContact OG-OE2 3.35Å; E94-Y96 VanDerWaalsContact C-N 3.29Å; E94-Y96 PolarHBondContact O-N 2.97Å; E94-K97 PolarHBondContact O-N 3.18Å; E94-I98 VanDerWaalsContact O-CG1 3.26Å; E94-I98 WeakPolarHBondContact O-CG1 3.41Å; E94-I98 PolarHBondContact O-N 3.48Å
95K74.6Confident70.7Confident80 Ų8060.2 Ų60.235%0.34830%0.301SS..Hα-helixtrans-60.4-40.2175.8-69.7-172.7179-170.70111.8A85 I86 G88 H90 S91 F99A85-K95 WeakPolarHBondContact O-CE 3.4Å; I86-K95 PolarHBondContact O-NZ 3.22Å; G88-K95 WeakPolarHBondContact O-CE 3.42Å; G88-K95 PolarHBondContact O-NZ 3.42Å; H90-K95 HydrophobicContact CB-CG 3.98Å; H90-K95 VanDerWaalsContact O-CE 3.28Å; H90-K95 WeakPolarHBondContact O-CE 3.36Å; S91-K95 PolarHBondContact O-N 2.98Å; K95-F99 WeakPolarHBondContact O-CB 3.31Å; K95-F99 PolarHBondContact O-N 3Å
96Y77.6Confident72.1Confident30 Ų3062 Ų6212%0.11831%0.309CS..Hα-helixtrans-63.6-47.4173.3176.4-88.6000111.9R33 A36 P92 D93 E94 I98 F99 M100R33-Y96 HydrophobicContact CB-CD2 4.37Å; R33-Y96 HydrophobicContact CB-CE2 3.91Å; R33-Y96 HydrophobicContact CG-CE2 4.1Å; A36-Y96 HydrophobicContact CB-CD2 4.32Å; A36-Y96 HydrophobicContact CB-CE2 3.61Å; P92-Y96 PolarHBondContact O-N 3.14Å; D93-Y96 PolarHBondContact O-N 3.46Å; E94-Y96 VanDerWaalsContact C-N 3.29Å; E94-Y96 PolarHBondContact O-N 2.97Å; Y96-I98 PolarHBondContact O-N 3.47Å; Y96-F99 WeakPolarHBondContact O-CB 3.49Å; Y96-F99 PolarHBondContact O-N 3.33Å; Y96-M100 HydrophobicContact CD1-CG 4.14Å; Y96-M100 HydrophobicContact CE1-CG 3.69Å; Y96-M100 HydrophobicContact CE2-CG 4.26Å; Y96-M100 WeakPolarHBondContact O-CG 3.36Å; Y96-M100 PolarHBondContact O-N 3.19Å
97K77.1Confident73.6Confident48 Ų4856.2 Ų56.221%0.20928%0.279CS..Hα-helixtrans-60.9-41.2179.2-75.2175.1172159.40112.5D73 F75 D93 E94 R101D73-K97 WeakPolarHBondContact O-CG 3.19Å; F75-K97 HydrophobicContact CB-CB 4.01Å; F75-K97 PolarHBondContact N-O 3.17Å; D93-K97 WeakPolarHBondContact O-CG 3.25Å; D93-K97 PolarHBondContact O-N 2.99Å; D93-K97 WeakPolarHBondContact OD2-CE 3.45Å; D93-K97 IonicContact OD2-NZ 3.6Å; D93-K97 PolarHBondContact OD2-NZ 3.43Å; E94-K97 PolarHBondContact O-N 3.18Å; K97-R101 WeakPolarHBondContact O-CB 3.29Å; K97-R101 PolarHBondContact O-N 3.47Å
98I77.9Confident75.3Confident3 Ų348.3 Ų48.32%0.01525%0.246CC..Hα-helixtrans-66.9-44.8176.5-66162.4000110.3F75 L79 P80 A85 E94 Y96 M100 R101 H102F75-I98 HydrophobicContact CB-CG1 3.97Å; F75-I98 HydrophobicContact CD1-CG1 4.2Å; F75-I98 HydrophobicContact CD2-CD1 4.13Å; F75-I98 HydrophobicContact CD2-CG1 3.5Å; F75-I98 VanDerWaalsContact CD2-CG1 3.5Å; F75-I98 HydrophobicContact CE2-CD1 4.14Å; F75-I98 HydrophobicContact CE2-CG1 3.98Å; F75-I98 HydrophobicContact CG-CG1 3.62Å; L79-I98 HydrophobicContact CD2-CG2 4.45Å; P80-I98 HydrophobicContact CG-CD1 3.93Å; P80-I98 HydrophobicContact CG-CG1 4.42Å; P80-I98 HydrophobicContact CG-CG2 4.33Å; A85-I98 HydrophobicContact CB-CB 4.45Å; A85-I98 HydrophobicContact CB-CD1 4.08Å; A85-I98 HydrophobicContact CB-CG2 3.65Å; E94-I98 VanDerWaalsContact O-CG1 3.26Å; E94-I98 WeakPolarHBondContact O-CG1 3.41Å; E94-I98 PolarHBondContact O-N 3.48Å; Y96-I98 PolarHBondContact O-N 3.47Å; I98-M100 PolarHBondContact O-N 3.42Å; I98-R101 WeakPolarHBondContact O-CB 3.44Å; I98-R101 PolarHBondContact O-N 3.03Å; I98-H102 PolarHBondContact O-CD2 2.84Å; I98-H102 PolarHBondContact O-N 2.82Å
99F80.3Confident76.9Confident58 Ų5852.7 Ų52.725%0.25426%0.261SS..Hα-helixtrans-57.8-49.1176.1173.9-98000111.8A36 F40 K95 Y96 R101 H102 R103A36-F99 HydrophobicContact CB-CE1 4.32Å; F40-F99 HydrophobicContact CE2-CE2 4.18Å; F40-F99 AromaticContact CE2-CZ 3.73Å; F40-F99 HydrophobicContact CE2-CZ 3.73Å; F40-F99 HydrophobicContact CZ-CE2 4.32Å; F40-F99 HydrophobicContact CZ-CZ 4.24Å; K95-F99 WeakPolarHBondContact O-CB 3.31Å; K95-F99 PolarHBondContact O-N 3Å; Y96-F99 WeakPolarHBondContact O-CB 3.49Å; Y96-F99 PolarHBondContact O-N 3.33Å; F99-R101 VanDerWaalsContact C-N 3.28Å; F99-R101 PolarHBondContact O-N 2.87Å; F99-H102 PolarHBondContact O-N 3.25Å; F99-R103 HydrophobicContact CD1-CG 4.41Å; F99-R103 HydrophobicContact CE1-CG 3.96Å; F99-R103 HydrophobicContact CE2-CG 4.33Å; F99-R103 HydrophobicContact CZ-CG 3.92Å; F99-R103 WeakPolarHBondContact O-CG 2.68Å; F99-R103 PolarHBondContact O-N 3.38Å; F99-R103 VanDerWaalsContact O-N 3.08Å
100M79.2Confident78.5Confident0 Ų043.9 Ų43.90%022%0.22CC..Hα-helixtrans-64.8-32178.8-67.9-59.9-72.100112.4A36 V39 F65 L68 L74 Y96 I98 R103 Y104A36-M100 HydrophobicContact CB-SD 4.2Å; V39-M100 HydrophobicContact CG2-CE 4.02Å; V39-M100 HydrophobicContact CG2-SD 4.27Å; F65-M100 HydrophobicContact CE1-CE 4.48Å; L68-M100 HydrophobicContact CD1-CE 3.28Å; L68-M100 HydrophobicContact CD2-CE 4.45Å; L74-M100 HydrophobicContact CD2-CB 3.71Å; Y96-M100 HydrophobicContact CD1-CG 4.14Å; Y96-M100 HydrophobicContact CE1-CG 3.69Å; Y96-M100 HydrophobicContact CE2-CG 4.26Å; Y96-M100 WeakPolarHBondContact O-CG 3.36Å; Y96-M100 PolarHBondContact O-N 3.19Å; I98-M100 PolarHBondContact O-N 3.42Å; M100-R103 PolarHBondContact O-N 3.26Å; M100-Y104 WeakPolarHBondContact O-CB 3.37Å; M100-Y104 PolarHBondContact O-N 3.48Å
101R80.1Confident79.7Confident32 Ų3240.4 Ų40.412%0.12120%0.204CC..Hα-helixtrans-66.7-42.1174.3-172.274.4174.9126.90.9112.4F75 L79 K97 I98 F99 Y104 N105 L142F75-R101 HydrophobicContact CB-CB 4.25Å; L79-R101 HydrophobicContact CD1-CB 4.23Å; L79-R101 HydrophobicContact CD1-CG 3.28Å; L79-R101 HydrophobicContact CG-CG 3.91Å; K97-R101 WeakPolarHBondContact O-CB 3.29Å; K97-R101 PolarHBondContact O-N 3.47Å; I98-R101 WeakPolarHBondContact O-CB 3.44Å; I98-R101 PolarHBondContact O-N 3.03Å; F99-R101 VanDerWaalsContact C-N 3.28Å; F99-R101 PolarHBondContact O-N 2.87Å; R101-Y104 VanDerWaalsContact NH1-CE1 3.28Å; R101-Y104 WeakPolarHBondContact O-CB 3.47Å; R101-Y104 PolarHBondContact O-N 3.23Å; R101-N105 PolarHBondContact O-N 2.97Å; R101-L142 VanDerWaalsContact NH1-CD1 3.3Å
102H81.8Confident80.6Confident30 Ų3039.1 Ų39.114%0.13919%0.193CC..Hα-helixtrans-62-43.1172.8-80.9-67.6000111.9L79 P80 E82 I98 F99 Y104 N105 N106L79-H102 WeakPolarHBondContact CD2-CE1 3.5Å; L79-H102 WeakPolarHBondContact CD2-NE2 3.3Å; P80-H102 PolarHBondContact O-NE2 3.02Å; P80-H102 VanDerWaalsContact O-NE2 3.11Å; E82-H102 HydrophobicContact CG-CB 4.3Å; E82-H102 WeakPolarHBondContact CG-CD2 3.4Å; E82-H102 VanDerWaalsContact CG-NE2 3.33Å; E82-H102 WeakPolarHBondContact CG-NE2 3.42Å; E82-H102 VanDerWaalsContact OE1-CB 3.3Å; E82-H102 WeakPolarHBondContact OE1-CB 3.38Å; E82-H102 IonicContact OE1-CD2 3.75Å; E82-H102 IonicContact OE1-CG 3.02Å; E82-H102 IonicContact OE1-ND1 3.49Å; I98-H102 PolarHBondContact O-CD2 2.84Å; I98-H102 PolarHBondContact O-N 2.82Å; F99-H102 PolarHBondContact O-N 3.25Å; H102-Y104 VanDerWaalsContact C-N 3.3Å; H102-Y104 PolarHBondContact O-N 3.12Å; H102-N105 PolarHBondContact O-N 3.4Å; H102-N106 VanDerWaalsContact O-CG 3.26Å; H102-N106 PolarHBondContact O-N 2.92Å; H102-N106 PolarHBondContact O-ND2 2.96Å
103R83.7Confident81.6Confident30 Ų3039.9 Ų39.911%0.11319%0.187CC..Hα-helixtrans-63.9-36.2175.8-61.8-55.3109.2-177.44.9112.5V39 F40 F65 E82 F99 M100 N106 C107V39-R103 HydrophobicContact CG1-CB 4.11Å; V39-R103 HydrophobicContact CG1-CG 4.36Å; F40-R103 VanDerWaalsContact CZ-NH1 3.34Å; F65-R103 HydrophobicContact CZ-CB 4.34Å; E82-R103 IonicContact OE1-CZ 3.74Å; E82-R103 IonicContact OE1-NH2 2.69Å; E82-R103 PolarHBondContact OE1-NH2 3.48Å; E82-R103 IonicContact OE2-NH2 3.69Å; F99-R103 HydrophobicContact CD1-CG 4.41Å; F99-R103 HydrophobicContact CE1-CG 3.96Å; F99-R103 HydrophobicContact CE2-CG 4.33Å; F99-R103 HydrophobicContact CZ-CG 3.92Å; F99-R103 WeakPolarHBondContact O-CG 2.68Å; F99-R103 PolarHBondContact O-N 3.38Å; F99-R103 VanDerWaalsContact O-N 3.08Å; M100-R103 PolarHBondContact O-N 3.26Å; R103-N106 VanDerWaalsContact CZ-ND2 3.32Å; R103-N106 PolarHBondContact NH1-ND2 3.42Å; R103-N106 PolarHBondContact O-N 3.3Å; R103-C107 WeakPolarHBondContact O-CB 3.5Å; R103-C107 PolarHBondContact O-N 2.89Å
104Y83.6Confident82.4Confident1 Ų138.6 Ų38.60%0.00418%0.179CC..Hα-helixtrans-61.9-46.8172.6174.7-92000112F65 L69 M100 R101 H102 N106 C107 V108 F133 Q137F65-Y104 HydrophobicContact CB-CD2 3.77Å; F65-Y104 HydrophobicContact CB-CE2 4.04Å; F65-Y104 AromaticContact CD1-CD2 3.67Å; F65-Y104 HydrophobicContact CD1-CD2 3.67Å; F65-Y104 HydrophobicContact CD1-CG 4.31Å; F65-Y104 HydrophobicContact CD2-CD2 4.28Å; F65-Y104 HydrophobicContact CE1-CD2 4.29Å; F65-Y104 AromaticContact CG-CD2 3.66Å; F65-Y104 HydrophobicContact CG-CD2 3.66Å; F65-Y104 HydrophobicContact CG-CE2 4.38Å; L69-Y104 HydrophobicContact CD1-CE2 4.31Å; M100-Y104 WeakPolarHBondContact O-CB 3.37Å; M100-Y104 PolarHBondContact O-N 3.48Å; R101-Y104 VanDerWaalsContact NH1-CE1 3.28Å; R101-Y104 WeakPolarHBondContact O-CB 3.47Å; R101-Y104 PolarHBondContact O-N 3.23Å; H102-Y104 VanDerWaalsContact C-N 3.3Å; H102-Y104 PolarHBondContact O-N 3.12Å; Y104-N106 VanDerWaalsContact C-N 3.34Å; Y104-N106 PolarHBondContact O-N 3.1Å; Y104-C107 WeakPolarHBondContact O-CB 3.49Å; Y104-C107 PolarHBondContact O-N 3.34Å; Y104-C107 VanDerWaalsContact O-N 3.14Å; Y104-V108 HydrophobicContact CD1-CG2 4.22Å; Y104-V108 HydrophobicContact CE1-CG2 3.68Å; Y104-V108 HydrophobicContact CE2-CG2 4.31Å; Y104-V108 WeakPolarHBondContact O-CG2 3.13Å; Y104-V108 PolarHBondContact O-N 3.46Å; Y104-F133 HydrophobicContact CE2-CD1 4.25Å; Y104-F133 AromaticContact CE2-CD2 3.82Å; Y104-F133 HydrophobicContact CE2-CD2 3.82Å; Y104-F133 HydrophobicContact CE2-CE1 4.42Å; Y104-F133 HydrophobicContact CE2-CE2 4.01Å; Y104-F133 AromaticContact CE2-CG 3.96Å; Y104-F133 HydrophobicContact CE2-CG 3.96Å; Y104-F133 HydrophobicContact CE2-CZ 4.32Å; Y104-F133 WeakPolarHBondContact OH-CB 3.36Å; Y104-Q137 VanDerWaalsContact CZ-NE2 3.35Å; Y104-Q137 PolarHBondContact OH-NE2 3.09Å
105N84.8Confident83Confident52 Ų5234.9 Ų34.928%0.27816%0.161SC..Hα-helixtrans-62.4-41.7177.2-71.6-5.2000111.5L79 R101 H102 C107 V108 E109L79-N105 VanDerWaalsContact CD1-ND2 3.31Å; L79-N105 WeakPolarHBondContact CD1-ND2 3.35Å; R101-N105 PolarHBondContact O-N 2.97Å; H102-N105 PolarHBondContact O-N 3.4Å; N105-C107 VanDerWaalsContact C-N 3.3Å; N105-C107 PolarHBondContact O-N 3.35Å; N105-V108 WeakPolarHBondContact O-CB 3.25Å; N105-V108 PolarHBondContact O-N 3.39Å; N105-E109 WeakPolarHBondContact O-CG 3.36Å; N105-E109 PolarHBondContact O-N 3.31Å
106N84.3Confident83.4Confident45 Ų4534.3 Ų34.324%0.24116%0.16CC..Hα-helixtrans-60.4-40.4173.7-65.8-23.3000111.8H102 R103 Y104 E109 I110H102-N106 VanDerWaalsContact O-CG 3.26Å; H102-N106 PolarHBondContact O-N 2.92Å; H102-N106 PolarHBondContact O-ND2 2.96Å; R103-N106 VanDerWaalsContact CZ-ND2 3.32Å; R103-N106 PolarHBondContact NH1-ND2 3.42Å; R103-N106 PolarHBondContact O-N 3.3Å; Y104-N106 VanDerWaalsContact C-N 3.34Å; Y104-N106 PolarHBondContact O-N 3.1Å; N106-E109 PolarHBondContact O-N 2.57Å; N106-I110 WeakPolarHBondContact O-CD1 3.4Å; N106-I110 VanDerWaalsContact O-CG1 3.26Å; N106-I110 WeakPolarHBondContact O-CG1 3.39Å; N106-I110 PolarHBondContact O-N 3.1Å
107C86.3Confident83.7Confident0 Ų035.8 Ų35.80%017%0.168CC..Hα-helixtrans-62.3-44.2175-175.70000111.4L43 F65 R103 Y104 N105 I110 L111L43-C107 HydrophobicContact CD2-CB 3.9Å; F65-C107 HydrophobicContact CD2-CB 4.3Å; F65-C107 HydrophobicContact CE2-CB 3.68Å; F65-C107 HydrophobicContact CZ-CB 4.33Å; R103-C107 WeakPolarHBondContact O-CB 3.5Å; R103-C107 PolarHBondContact O-N 2.89Å; Y104-C107 WeakPolarHBondContact O-CB 3.49Å; Y104-C107 PolarHBondContact O-N 3.34Å; Y104-C107 VanDerWaalsContact O-N 3.14Å; N105-C107 VanDerWaalsContact C-N 3.3Å; N105-C107 PolarHBondContact O-N 3.35Å; C107-I110 PolarHBondContact O-N 3.42Å; C107-L111 WeakPolarHBondContact O-CB 3.34Å; C107-L111 WeakPolarHBondContact O-CG 3.41Å; C107-L111 PolarHBondContact O-N 3.15Å
108V86.3Confident83.9Confident16 Ų1642.7 Ų42.710%0.09720%0.201CC..Hα-helixtrans-60.8-45.4175.71700000111.2Y104 N105 I110 L111 L112 L130 F133 L157Y104-V108 HydrophobicContact CD1-CG2 4.22Å; Y104-V108 HydrophobicContact CE1-CG2 3.68Å; Y104-V108 HydrophobicContact CE2-CG2 4.31Å; Y104-V108 WeakPolarHBondContact O-CG2 3.13Å; Y104-V108 PolarHBondContact O-N 3.46Å; N105-V108 WeakPolarHBondContact O-CB 3.25Å; N105-V108 PolarHBondContact O-N 3.39Å; V108-I110 PolarHBondContact O-N 3.35Å; V108-L111 PolarHBondContact O-N 3.38Å; V108-L112 HydrophobicContact CG1-CD1 3.93Å; V108-L112 HydrophobicContact CG1-CG 4.34Å; V108-L112 VanDerWaalsContact O-CG 3.24Å; V108-L112 WeakPolarHBondContact O-CG 3.41Å; V108-L112 PolarHBondContact O-N 2.73Å; V108-L130 HydrophobicContact CG1-CD2 4.14Å; V108-F133 HydrophobicContact CG2-CD2 4.15Å; V108-L157 HydrophobicContact CG1-CD1 3.44Å; V108-L157 VanDerWaalsContact CG1-CD1 3.44Å; V108-L157 HydrophobicContact CG2-CD1 4.27Å
109E87.8Confident84.2Confident115 Ų11543.9 Ų43.954%0.53721%0.208SC..Hα-helixtrans-58.6-47.9177.2-73.2176.7-176.500111.6N105 N106 L111 L112 E113N105-E109 WeakPolarHBondContact O-CG 3.36Å; N105-E109 PolarHBondContact O-N 3.31Å; N106-E109 PolarHBondContact O-N 2.57Å; E109-L111 PolarHBondContact O-N 2.96Å; E109-L112 PolarHBondContact O-N 2.97Å; E109-E113 WeakPolarHBondContact O-CG 3.16Å; E109-E113 PolarHBondContact O-N 2.85Å
110I85.6Confident84.4Confident17 Ų1744.4 Ų44.49%0.08721%0.211CC..Hα-helixtrans-62.5-42.2177.5-66.3164.8000111.3L43 L46 Q47 N106 C107 V108 L112 E113 H114L43-I110 HydrophobicContact CD2-CD1 4.3Å; L46-I110 HydrophobicContact CB-CG2 3.81Å; L46-I110 HydrophobicContact CD1-CG2 4.14Å; Q47-I110 HydrophobicContact CG-CD1 4.46Å; N106-I110 WeakPolarHBondContact O-CD1 3.4Å; N106-I110 VanDerWaalsContact O-CG1 3.26Å; N106-I110 WeakPolarHBondContact O-CG1 3.39Å; N106-I110 PolarHBondContact O-N 3.1Å; C107-I110 PolarHBondContact O-N 3.42Å; V108-I110 PolarHBondContact O-N 3.35Å; I110-L112 VanDerWaalsContact C-N 3.31Å; I110-L112 PolarHBondContact O-N 3.26Å; I110-E113 WeakPolarHBondContact O-CB 3.17Å; I110-E113 PolarHBondContact O-N 3.47Å; I110-H114 VanDerWaalsContact CG2-NE2 3.32Å; I110-H114 WeakPolarHBondContact CG2-NE2 3.42Å; I110-H114 PolarHBondContact O-CD2 3.42Å; I110-H114 PolarHBondContact O-N 3.04Å
111L86.7Confident84.7Confident0 Ų050.3 Ų50.30%024%0.239CC..Hα-helixtrans-63.9-35.8176.3-71.7171000112.4V58 C107 V108 E109 H114 L115 A126 C129 L130 F133V58-L111 HydrophobicContact CB-CD2 4.42Å; V58-L111 HydrophobicContact CG1-CD2 3.95Å; V58-L111 HydrophobicContact CG2-CD2 3.75Å; C107-L111 WeakPolarHBondContact O-CB 3.34Å; C107-L111 WeakPolarHBondContact O-CG 3.41Å; C107-L111 PolarHBondContact O-N 3.15Å; V108-L111 PolarHBondContact O-N 3.38Å; E109-L111 PolarHBondContact O-N 2.96Å; L111-H114 PolarHBondContact O-N 3.18Å; L111-L115 PolarHBondContact O-N 2.74Å; L111-A126 HydrophobicContact CD2-CB 4.09Å; L111-C129 HydrophobicContact CD1-CB 4.34Å; L111-C129 HydrophobicContact CD2-CB 4.5Å; L111-L130 HydrophobicContact CB-CD1 4.07Å; L111-L130 HydrophobicContact CB-CD2 3.8Å; L111-L130 HydrophobicContact CB-CG 3.9Å; L111-L130 HydrophobicContact CD1-CD2 4.09Å; L111-L130 HydrophobicContact CD1-CG 4.3Å; L111-F133 HydrophobicContact CD1-CD2 4.18Å; L111-F133 HydrophobicContact CD1-CE2 3.6Å; L111-F133 HydrophobicContact CD1-CZ 4.46Å
112L87.1Confident85Confident21 Ų2148.8 Ų48.811%0.1123%0.233CC..Hα-helixtrans-68.4-36.9174.7-68.8169.3000111.6V108 E109 I110 H114 L115 L130 A160 V161V108-L112 HydrophobicContact CG1-CD1 3.93Å; V108-L112 HydrophobicContact CG1-CG 4.34Å; V108-L112 VanDerWaalsContact O-CG 3.24Å; V108-L112 WeakPolarHBondContact O-CG 3.41Å; V108-L112 PolarHBondContact O-N 2.73Å; E109-L112 PolarHBondContact O-N 2.97Å; I110-L112 VanDerWaalsContact C-N 3.31Å; I110-L112 PolarHBondContact O-N 3.26Å; L112-H114 VanDerWaalsContact C-N 3.34Å; L112-L115 HydrophobicContact CD2-CD1 4.05Å; L112-L115 WeakPolarHBondContact O-CB 3.46Å; L112-L115 PolarHBondContact O-N 3.2Å; L112-L130 HydrophobicContact CD2-CD1 3.84Å; L112-L130 HydrophobicContact CD2-CD2 4.44Å; L112-L130 HydrophobicContact CG-CD1 4.37Å; L112-L130 HydrophobicContact CG-CD2 4.48Å; L112-A160 HydrophobicContact CD1-CB 3.82Å; L112-A160 HydrophobicContact CD2-CB 4.19Å; L112-V161 HydrophobicContact CD2-CG2 4.09Å
113E87.6Confident85.3Confident133 Ų13348.3 Ų48.362%0.62123%0.231SC*.Hα-helixtrans-62.8-40.4171.8-70178.9175.200111.4E109 I110 L115 H116E109-E113 WeakPolarHBondContact O-CG 3.16Å; E109-E113 PolarHBondContact O-N 2.85Å; I110-E113 WeakPolarHBondContact O-CB 3.17Å; I110-E113 PolarHBondContact O-N 3.47Å; E113-L115 PolarHBondContact O-N 2.89Å; E113-H116 WeakPolarHBondContact O-CB 3.38Å; E113-H116 PolarHBondContact O-N 3.33Å
114H86.4Confident85.5Confident21 Ų2149.8 Ų49.810%0.09724%0.239CC..Hα-helixtrans-64.3-18.3176.8-70.6-47.2000114.7L46 I110 L111 L112 H116 H117 V122 A126L46-H114 PolarHBondContact O-CE1 3.08Å; L46-H114 PolarHBondContact O-NE2 2.96Å; I110-H114 VanDerWaalsContact CG2-NE2 3.32Å; I110-H114 WeakPolarHBondContact CG2-NE2 3.42Å; I110-H114 PolarHBondContact O-CD2 3.42Å; I110-H114 PolarHBondContact O-N 3.04Å; L111-H114 PolarHBondContact O-N 3.18Å; L112-H114 VanDerWaalsContact C-N 3.34Å; H114-H116 PolarHBondContact O-N 3.29Å; H114-H117 WeakPolarHBondContact O-CB 3.34Å; H114-H117 PolarHBondContact O-N 2.67Å; H114-V122 HydrophobicContact CB-CG1 4.22Å; H114-A126 HydrophobicContact CB-CB 3.98Å
115L83.7Confident85.7Confident0 Ų050.6 Ų50.60%025%0.245CC..THydrogen-bonded Turntrans-63.8-19170.8-61.9177.3000112.4L111 L112 E113 K123 A126 L127 L130 N164 L175L111-L115 PolarHBondContact O-N 2.74Å; L112-L115 HydrophobicContact CD2-CD1 4.05Å; L112-L115 WeakPolarHBondContact O-CB 3.46Å; L112-L115 PolarHBondContact O-N 3.2Å; E113-L115 PolarHBondContact O-N 2.89Å; L115-K123 WeakPolarHBondContact O-CD 3.33Å; L115-K123 WeakPolarHBondContact O-CE 3.49Å; L115-A126 HydrophobicContact CD2-CB 4.27Å; L115-L127 HydrophobicContact CD2-CB 4Å; L115-L130 HydrophobicContact CD1-CD1 3.96Å; L115-L130 HydrophobicContact CD2-CD1 4.4Å; L115-L130 HydrophobicContact CG-CD1 4.29Å; L115-N164 HydrophobicContact CB-CB 4.36Å; L115-N164 HydrophobicContact CD1-CB 3.75Å; L115-L175 HydrophobicContact CD2-CD2 4.32Å
116H84.3Confident85.9Confident69 Ų6948.1 Ų48.132%0.31923%0.232SC..THydrogen-bonded Turntrans-97.45.7175.5-65.384.9000113.8E113 H114 N164 L170E113-H116 WeakPolarHBondContact O-CB 3.38Å; E113-H116 PolarHBondContact O-N 3.33Å; H114-H116 PolarHBondContact O-N 3.29Å; H116-N164 PolarHBondContact CE1-OD1 3.38Å; H116-L170 HydrophobicContact CB-CD1 4.22Å
117H83.9Confident86.1Confident61 Ų6146 Ų4628%0.28222%0.22SC..  trans-62160.3-179.8-162.8-92.8000112H114 T119 V122 K123H114-H117 WeakPolarHBondContact O-CB 3.34Å; H114-H117 PolarHBondContact O-N 2.67Å; H117-T119 PolarHBondContact CE1-OG1 2.83Å; H117-T119 VanDerWaalsContact CE1-OG1 3.25Å; H117-T119 PolarHBondContact ND1-N 2.99Å; H117-T119 VanDerWaalsContact ND1-N 3.19Å; H117-T119 PolarHBondContact ND1-OG1 2.94Å; H117-V122 HydrophobicContact CB-CG1 4.28Å; H117-K123 WeakPolarHBondContact O-CE 3.39Å; H117-K123 PolarHBondContact O-NZ 2.97Å
118E79.9Confident86.2Confident192 Ų19247.1 Ų47.190%0.89723%0.228SC*.SBendtrans-71.4-39.4179.4-61.9-170.9166.100111.6
119T84.9Confident86.2Confident29 Ų2946.5 Ų46.518%0.17822%0.224CC..  trans-81.6128.3-175.1-33.40000113.4E51 H117 E121 V122 K123E51-T119 WeakPolarHBondContact OE1-CB 3.45Å; E51-T119 WeakPolarHBondContact OE1-CG2 3.28Å; E51-T119 PolarHBondContact OE1-OG1 3.41Å; H117-T119 PolarHBondContact CE1-OG1 2.83Å; H117-T119 VanDerWaalsContact CE1-OG1 3.25Å; H117-T119 PolarHBondContact ND1-N 2.99Å; H117-T119 VanDerWaalsContact ND1-N 3.19Å; H117-T119 PolarHBondContact ND1-OG1 2.94Å; T119-E121 PolarHBondContact O-N 3.45Å; T119-V122 PolarHBondContact O-N 3.47Å; T119-K123 PolarHBondContact O-N 2.91Å
120H85.3Confident86.3Confident68 Ų6841 Ų4132%0.31520%0.199SC..Hα-helixtrans-62.6-40.6179.5-177.7-88.2000113.4V122 K123 E124 L174H120-V122 VanDerWaalsContact C-N 3.29Å; H120-V122 PolarHBondContact O-N 2.87Å; H120-K123 WeakPolarHBondContact O-CB 3.32Å; H120-K123 PolarHBondContact O-N 3.38Å; H120-K123 VanDerWaalsContact O-N 3.14Å; H120-E124 IonicContact CE1-OE2 2.76Å; H120-E124 IonicContact ND1-OE2 2.76Å; H120-E124 PolarHBondContact O-N 3.44Å; H120-L174 WeakPolarHBondContact NE2-CB 3.3Å
121E85.9Confident86.4Confident124 Ų12440.4 Ų40.458%0.57920%0.195SC*.Hα-helixtrans-59.2-39.6-177.7-62.2-177.3177.300112.4I55 T119 S125I55-E121 HydrophobicContact CD1-CB 4.14Å; T119-E121 PolarHBondContact O-N 3.45Å; E121-S125 WeakPolarHBondContact O-CB 3.34Å; E121-S125 PolarHBondContact O-N 3.19Å
122V86.1Confident86.3Confident1 Ų145.4 Ų45.41%0.00622%0.217CC..Hα-helixtrans-68.2-43.3177.3179.20000110.7E51 V54 I55 H114 H117 T119 H120 E124 S125 A126E51-V122 HydrophobicContact CB-CG2 4.19Å; E51-V122 HydrophobicContact CG-CG2 4.47Å; V54-V122 HydrophobicContact CG1-CG1 3.91Å; I55-V122 HydrophobicContact CD1-CG2 4.47Å; I55-V122 HydrophobicContact CG1-CG2 4.28Å; H114-V122 HydrophobicContact CB-CG1 4.22Å; H117-V122 HydrophobicContact CB-CG1 4.28Å; T119-V122 PolarHBondContact O-N 3.47Å; H120-V122 VanDerWaalsContact C-N 3.29Å; H120-V122 PolarHBondContact O-N 2.87Å; V122-E124 VanDerWaalsContact C-N 3.34Å; V122-E124 PolarHBondContact O-N 3.47Å; V122-S125 PolarHBondContact O-N 3.24Å; V122-A126 WeakPolarHBondContact O-CB 3.38Å; V122-A126 PolarHBondContact O-N 2.9Å
123K88.3Confident86.2Confident20 Ų2044.4 Ų44.49%0.08721%0.212CC..Hα-helixtrans-59.8-45.1176.3-64.3-174.4-176.5-172.70111.9L115 H117 T119 H120 A126 L127 N172 L175L115-K123 WeakPolarHBondContact O-CD 3.33Å; L115-K123 WeakPolarHBondContact O-CE 3.49Å; H117-K123 WeakPolarHBondContact O-CE 3.39Å; H117-K123 PolarHBondContact O-NZ 2.97Å; T119-K123 PolarHBondContact O-N 2.91Å; H120-K123 WeakPolarHBondContact O-CB 3.32Å; H120-K123 PolarHBondContact O-N 3.38Å; H120-K123 VanDerWaalsContact O-N 3.14Å; K123-A126 PolarHBondContact O-N 3.29Å; K123-L127 WeakPolarHBondContact O-CB 3.31Å; K123-L127 PolarHBondContact O-N 3.48Å; K123-N172 PolarHBondContact NZ-OD1 2.93Å; K123-L175 HydrophobicContact CB-CD1 4.05Å
124E87.9Confident86Confident60 Ų6038 Ų3828%0.2818%0.182SC..Hα-helixtrans-63.8-47.7-179.6176.3171.9-176.300111.5H120 V122 A126 L127 C128 R178H120-E124 IonicContact CE1-OE2 2.76Å; H120-E124 IonicContact ND1-OE2 2.76Å; H120-E124 PolarHBondContact O-N 3.44Å; V122-E124 VanDerWaalsContact C-N 3.34Å; V122-E124 PolarHBondContact O-N 3.47Å; E124-A126 PolarHBondContact O-N 3.34Å; E124-L127 PolarHBondContact O-N 2.9Å; E124-C128 WeakPolarHBondContact O-CB 3.49Å; E124-C128 PolarHBondContact O-N 3.46Å; E124-C128 PolarHBondContact O-SG 2.76Å; E124-R178 HydrophobicContact CG-CG 4.17Å; E124-R178 VanDerWaalsContact OE1-CD 3.32Å; E124-R178 WeakPolarHBondContact OE1-CD 3.29Å; E124-R178 IonicContact OE1-CZ 3.99Å; E124-R178 IonicContact OE1-NE 3.13Å; E124-R178 PolarHBondContact OE1-NE 3.04Å
125S86.6Confident86Confident19 Ų1938.4 Ų38.413%0.13319%0.189CC..Hα-helixtrans-60.4-45.3176.8-177.10000111.6V58 E121 V122 L127 C128 C129V58-S125 WeakPolarHBondContact CG1-OG 3.24Å; E121-S125 WeakPolarHBondContact O-CB 3.34Å; E121-S125 PolarHBondContact O-N 3.19Å; V122-S125 PolarHBondContact O-N 3.24Å; S125-L127 PolarHBondContact O-N 3.29Å; S125-C128 PolarHBondContact O-N 3.48Å; S125-C129 WeakPolarHBondContact O-CB 3.33Å; S125-C129 PolarHBondContact O-N 3.42Å
126A89.2Confident85.8Confident0 Ų039.6 Ų39.60%020%0.195CC..Hα-helixtrans-61.5-44.6176.900000112.3L111 H114 L115 V122 K123 E124 C129 L130L111-A126 HydrophobicContact CD2-CB 4.09Å; H114-A126 HydrophobicContact CB-CB 3.98Å; L115-A126 HydrophobicContact CD2-CB 4.27Å; V122-A126 WeakPolarHBondContact O-CB 3.38Å; V122-A126 PolarHBondContact O-N 2.9Å; K123-A126 PolarHBondContact O-N 3.29Å; E124-A126 PolarHBondContact O-N 3.34Å; A126-C129 PolarHBondContact O-N 3.5Å; A126-L130 VanDerWaalsContact O-CG 3.31Å; A126-L130 WeakPolarHBondContact O-CG 3.37Å; A126-L130 PolarHBondContact O-N 3.48Å
127L89.1Confident85.5Confident0 Ų037.6 Ų37.60%019%0.185CC..Hα-helixtrans-60.4-47.3176.1179.866000111.5L115 K123 E124 S125 C129 L130 M131 V161 I165 L175 F179L115-L127 HydrophobicContact CD2-CB 4Å; K123-L127 WeakPolarHBondContact O-CB 3.31Å; K123-L127 PolarHBondContact O-N 3.48Å; E124-L127 PolarHBondContact O-N 2.9Å; S125-L127 PolarHBondContact O-N 3.29Å; L127-C129 VanDerWaalsContact C-N 3.29Å; L127-C129 PolarHBondContact O-N 3.22Å; L127-L130 PolarHBondContact O-N 3.11Å; L127-M131 HydrophobicContact CD1-CG 4.33Å; L127-M131 WeakPolarHBondContact O-CG 3.32Å; L127-M131 PolarHBondContact O-N 3.07Å; L127-V161 HydrophobicContact CD1-CG1 3.66Å; L127-I165 HydrophobicContact CD1-CD1 4.03Å; L127-L175 HydrophobicContact CB-CD1 4.03Å; L127-L175 HydrophobicContact CD2-CD1 3.55Å; L127-L175 HydrophobicContact CD2-CG 4Å; L127-L175 HydrophobicContact CG-CD1 4.37Å; L127-F179 HydrophobicContact CD1-CD2 4Å; L127-F179 HydrophobicContact CD1-CE2 4.46Å; L127-F179 HydrophobicContact CD2-CB 4.18Å; L127-F179 HydrophobicContact CD2-CD2 4.2Å
128C88.4Confident84.9Confident24 Ų2434.9 Ų34.916%0.16217%0.173CC..Hα-helixtrans-62.5-38.2179.1-68.50000111.7E124 S125 K132E124-C128 WeakPolarHBondContact O-CB 3.49Å; E124-C128 PolarHBondContact O-N 3.46Å; E124-C128 PolarHBondContact O-SG 2.76Å; S125-C128 PolarHBondContact O-N 3.48Å; C128-K132 VanDerWaalsContact O-CG 3.28Å; C128-K132 WeakPolarHBondContact O-CG 3.31Å; C128-K132 PolarHBondContact O-N 2.93Å
129C86.7Confident84.7Confident3 Ų330.5 Ų30.52%0.0216%0.156CC..Hα-helixtrans-64.5-47.1174.9-172.30000111.8V58 C62 L111 S125 A126 L127 M131 K132 F133V58-C129 HydrophobicContact CG1-CB 3.56Å; C62-C129 VanDerWaalsContact CB-SG 3.57Å; L111-C129 HydrophobicContact CD1-CB 4.34Å; L111-C129 HydrophobicContact CD2-CB 4.5Å; S125-C129 WeakPolarHBondContact O-CB 3.33Å; S125-C129 PolarHBondContact O-N 3.42Å; A126-C129 PolarHBondContact O-N 3.5Å; L127-C129 VanDerWaalsContact C-N 3.29Å; L127-C129 PolarHBondContact O-N 3.22Å; C129-M131 VanDerWaalsContact C-N 3.33Å; C129-M131 PolarHBondContact O-N 3.17Å; C129-K132 PolarHBondContact O-N 3.17Å; C129-F133 WeakPolarHBondContact O-CG 3.27Å; C129-F133 PolarHBondContact O-N 2.79Å
130L88.1Confident84Confident0 Ų031.5 Ų31.50%016%0.158CC..Hα-helixtrans-61.2-39.4177.3-72.1166.2000112.3V108 L111 L112 L115 A126 L127 F133 A134 L157 V161V108-L130 HydrophobicContact CG1-CD2 4.14Å; L111-L130 HydrophobicContact CB-CD1 4.07Å; L111-L130 HydrophobicContact CB-CD2 3.8Å; L111-L130 HydrophobicContact CB-CG 3.9Å; L111-L130 HydrophobicContact CD1-CD2 4.09Å; L111-L130 HydrophobicContact CD1-CG 4.3Å; L112-L130 HydrophobicContact CD2-CD1 3.84Å; L112-L130 HydrophobicContact CD2-CD2 4.44Å; L112-L130 HydrophobicContact CG-CD1 4.37Å; L112-L130 HydrophobicContact CG-CD2 4.48Å; L115-L130 HydrophobicContact CD1-CD1 3.96Å; L115-L130 HydrophobicContact CD2-CD1 4.4Å; L115-L130 HydrophobicContact CG-CD1 4.29Å; A126-L130 VanDerWaalsContact O-CG 3.31Å; A126-L130 WeakPolarHBondContact O-CG 3.37Å; A126-L130 PolarHBondContact O-N 3.48Å; L127-L130 PolarHBondContact O-N 3.11Å; L130-F133 WeakPolarHBondContact O-CB 3.44Å; L130-F133 PolarHBondContact O-N 3.35Å; L130-A134 PolarHBondContact O-N 3.01Å; L130-L157 HydrophobicContact CD2-CD1 4.03Å; L130-V161 HydrophobicContact CB-CG2 4Å; L130-V161 HydrophobicContact CD1-CG2 4.06Å; L130-V161 HydrophobicContact CG-CG2 4.5Å
131M88Confident83.2Confident3 Ų330.6 Ų30.62%0.01516%0.158CC..Hα-helixtrans-70.4-37.1176.5-66.4-51.1-66.500112.6L127 C129 F133 A134 A135 F179 F182 I188 M239L127-M131 HydrophobicContact CD1-CG 4.33Å; L127-M131 WeakPolarHBondContact O-CG 3.32Å; L127-M131 PolarHBondContact O-N 3.07Å; C129-M131 VanDerWaalsContact C-N 3.33Å; C129-M131 PolarHBondContact O-N 3.17Å; M131-F133 VanDerWaalsContact C-N 3.33Å; M131-A134 PolarHBondContact O-N 3.15Å; M131-A135 PolarHBondContact O-N 3.2Å; M131-F179 HydrophobicContact CE-CE2 4.11Å; M131-F179 HydrophobicContact SD-CE2 3.8Å; M131-F182 HydrophobicContact CB-CD1 4.11Å; M131-F182 HydrophobicContact CB-CD2 4.49Å; M131-F182 HydrophobicContact CB-CE1 3.76Å; M131-F182 HydrophobicContact CB-CE2 4.2Å; M131-F182 HydrophobicContact CB-CG 4.47Å; M131-F182 HydrophobicContact CB-CZ 3.82Å; M131-F182 HydrophobicContact CE-CB 3.87Å; M131-F182 HydrophobicContact CE-CD1 4.18Å; M131-F182 HydrophobicContact CE-CD2 4.44Å; M131-F182 HydrophobicContact CE-CG 3.92Å; M131-F182 HydrophobicContact CG-CD1 4.21Å; M131-F182 HydrophobicContact CG-CD2 3.82Å; M131-F182 HydrophobicContact CG-CE1 4.14Å; M131-F182 HydrophobicContact CG-CE2 3.76Å; M131-F182 HydrophobicContact CG-CG 4.06Å; M131-F182 HydrophobicContact CG-CZ 3.93Å; M131-I188 HydrophobicContact CE-CD1 3.64Å; M131-M239 HydrophobicContact CE-CE 4.13Å; M131-M239 WeakPolarHBondContact O-CE 3.45Å
132K85.4Confident82.2Confident105 Ų10525.3 Ų25.346%0.45713%0.134SC..Hα-helixtrans-62.8-41.4170.7-74.8170.9-176.5172.20111.3C62 C128 C129 A135 E136C62-K132 WeakPolarHBondContact SG-CD 3.4Å; C128-K132 VanDerWaalsContact O-CG 3.28Å; C128-K132 WeakPolarHBondContact O-CG 3.31Å; C128-K132 PolarHBondContact O-N 2.93Å; C129-K132 PolarHBondContact O-N 3.17Å; K132-A135 PolarHBondContact O-N 2.97Å; K132-E136 VanDerWaalsContact O-CG 3.3Å; K132-E136 WeakPolarHBondContact O-CG 3.42Å; K132-E136 PolarHBondContact O-N 2.91Å
133F84.8Confident81Confident0 Ų030.6 Ų30.60%016%0.159CC..Hα-helixtrans-59.5-47.4172.8-77.5-6.2000111.8F65 Y104 V108 L111 C129 L130 M131 A135 E136 Q137 L157F65-F133 HydrophobicContact CB-CD1 4.5Å; F65-F133 HydrophobicContact CB-CE1 3.63Å; F65-F133 HydrophobicContact CB-CZ 3.76Å; F65-F133 HydrophobicContact CD2-CZ 4Å; F65-F133 HydrophobicContact CG-CZ 4.32Å; Y104-F133 HydrophobicContact CE2-CD1 4.25Å; Y104-F133 AromaticContact CE2-CD2 3.82Å; Y104-F133 HydrophobicContact CE2-CD2 3.82Å; Y104-F133 HydrophobicContact CE2-CE1 4.42Å; Y104-F133 HydrophobicContact CE2-CE2 4.01Å; Y104-F133 AromaticContact CE2-CG 3.96Å; Y104-F133 HydrophobicContact CE2-CG 3.96Å; Y104-F133 HydrophobicContact CE2-CZ 4.32Å; Y104-F133 WeakPolarHBondContact OH-CB 3.36Å; V108-F133 HydrophobicContact CG2-CD2 4.15Å; L111-F133 HydrophobicContact CD1-CD2 4.18Å; L111-F133 HydrophobicContact CD1-CE2 3.6Å; L111-F133 HydrophobicContact CD1-CZ 4.46Å; C129-F133 WeakPolarHBondContact O-CG 3.27Å; C129-F133 PolarHBondContact O-N 2.79Å; L130-F133 WeakPolarHBondContact O-CB 3.44Å; L130-F133 PolarHBondContact O-N 3.35Å; M131-F133 VanDerWaalsContact C-N 3.33Å; F133-A135 VanDerWaalsContact C-N 3.26Å; F133-A135 PolarHBondContact O-N 2.91Å; F133-E136 PolarHBondContact O-N 2.89Å; F133-Q137 WeakPolarHBondContact O-CB 3.28Å; F133-Q137 VanDerWaalsContact O-CG 3.25Å; F133-Q137 WeakPolarHBondContact O-CG 3.42Å; F133-Q137 PolarHBondContact O-N 3.31Å; F133-L157 HydrophobicContact CB-CD2 4.12Å
134A84.1Confident79.2Confident0 Ų034.9 Ų34.90%018%0.183CC..Hα-helixtrans-56.6-41.7174.600000111.8L130 M131 E136 Q137 G138 P154 L157 I158 M239L130-A134 PolarHBondContact O-N 3.01Å; M131-A134 PolarHBondContact O-N 3.15Å; A134-E136 PolarHBondContact O-N 3.49Å; A134-Q137 PolarHBondContact O-N 3.02Å; A134-G138 PolarHBondContact O-N 3.43Å; A134-P154 HydrophobicContact CB-CB 4.46Å; A134-P154 HydrophobicContact CB-CG 3.77Å; A134-P154 WeakPolarHBondContact O-CG 3.48Å; A134-L157 HydrophobicContact CB-CD2 3.88Å; A134-I158 HydrophobicContact CB-CD1 4.25Å; A134-I158 HydrophobicContact CB-CG1 4.13Å; A134-M239 HydrophobicContact CB-CE 3.85Å
135A84.6Confident77.6Confident29 Ų2935.7 Ų35.724%0.2419%0.189CC..Hα-helixtrans-65.6-44.5-177.200000110.8M131 K132 F133 G138 L139 M239M131-A135 PolarHBondContact O-N 3.2Å; K132-A135 PolarHBondContact O-N 2.97Å; F133-A135 VanDerWaalsContact C-N 3.26Å; F133-A135 PolarHBondContact O-N 2.91Å; A135-G138 PolarHBondContact O-N 3.39Å; A135-L139 PolarHBondContact O-N 3.4Å; A135-L139 VanDerWaalsContact O-N 3.17Å; A135-M239 HydrophobicContact CB-CE 3.61Å; A135-M239 HydrophobicContact CB-CG 4.35Å
136E79.4Confident75.6Confident25 Ų2541.5 Ų41.512%0.11722%0.218CC..Hα-helixtrans-69.3-35.8177.8-62.7-68.1171.900112C66 L69 K70 K132 F133 A134 G138 L139 H140C66-E136 HydrophobicContact CB-CG 4.04Å; L69-E136 HydrophobicContact CB-CB 4.18Å; L69-E136 HydrophobicContact CD1-CB 3.72Å; K70-E136 WeakPolarHBondContact CE-OE1 3.24Å; K70-E136 WeakPolarHBondContact CE-OE2 3.36Å; K70-E136 IonicContact NZ-OE1 3.35Å; K70-E136 PolarHBondContact NZ-OE1 3.34Å; K70-E136 IonicContact NZ-OE2 3.2Å; K132-E136 VanDerWaalsContact O-CG 3.3Å; K132-E136 WeakPolarHBondContact O-CG 3.42Å; K132-E136 PolarHBondContact O-N 2.91Å; F133-E136 PolarHBondContact O-N 2.89Å; A134-E136 PolarHBondContact O-N 3.49Å; E136-G138 VanDerWaalsContact C-N 3.31Å; E136-G138 PolarHBondContact O-N 3.36Å; E136-L139 PolarHBondContact O-N 3.45Å; E136-H140 WeakPolarHBondContact O-CB 3.35Å; E136-H140 PolarHBondContact O-N 3.47Å
137Q78.6Confident73.6Confident27 Ų2749.7 Ų49.713%0.12625%0.249CC..Hα-helixtrans-64.8-34.7171.8-70.8-166-8.100112.6L69 Y104 F133 A134 H140 P141 L142 P154L69-Q137 HydrophobicContact CD1-CG 4.46Å; Y104-Q137 VanDerWaalsContact CZ-NE2 3.35Å; Y104-Q137 PolarHBondContact OH-NE2 3.09Å; F133-Q137 WeakPolarHBondContact O-CB 3.28Å; F133-Q137 VanDerWaalsContact O-CG 3.25Å; F133-Q137 WeakPolarHBondContact O-CG 3.42Å; F133-Q137 PolarHBondContact O-N 3.31Å; A134-Q137 PolarHBondContact O-N 3.02Å; Q137-H140 CarbonylContact O-C 3.46Å; Q137-H140 VanDerWaalsContact O-C 3.24Å; Q137-P141 WeakPolarHBondContact O-CA 3.33Å; Q137-L142 HydrophobicContact CB-CD1 4.36Å; Q137-L142 HydrophobicContact CG-CD1 3.55Å; Q137-P154 HydrophobicContact CB-CB 4.04Å; Q137-P154 HydrophobicContact CB-CG 4.49Å
138G72.8Confident71.4Confident3 Ų355.7 Ų55.73%0.03129%0.291CS..Hα-helixtrans-66.2-36.917500000112.9A134 A135 E136A134-G138 PolarHBondContact O-N 3.43Å; A135-G138 PolarHBondContact O-N 3.39Å; E136-G138 VanDerWaalsContact C-N 3.31Å; E136-G138 PolarHBondContact O-N 3.36Å
139L74.1Confident69.3Low101 Ų10161.3 Ų61.353%0.52932%0.315SS..Hα-helixtrans-78.2-33175.3-67.1172.9000113A135 E136A135-L139 PolarHBondContact O-N 3.4Å; A135-L139 VanDerWaalsContact O-N 3.17Å; E136-L139 PolarHBondContact O-N 3.45Å
140H71.4Confident67.4Low50 Ų5069.1 Ų69.123%0.23135%0.345CS..SBendtrans-129.484.9-176.3-59.9-45.2000110.1E136 Q137E136-H140 WeakPolarHBondContact O-CB 3.35Å; E136-H140 PolarHBondContact O-N 3.47Å; Q137-H140 CarbonylContact O-C 3.46Å; Q137-H140 VanDerWaalsContact O-C 3.24Å
141P68.3Low65.7Low48 Ų4871.2 Ų71.231%0.31235%0.354SS..  trans-61.4138.7-176.1-23.735.4000111.7Q137 S152Q137-P141 WeakPolarHBondContact O-CA 3.33Å; P141-S152 VanDerWaalsContact CG-CB 3.41Å; P141-S152 VanDerWaalsContact CG-OG 3.23Å; P141-S152 WeakPolarHBondContact CG-OG 3.41Å
142L63.8Low64.3Low14 Ų1472.9 Ų72.97%0.07337%0.366CS..SBendtrans-992.4179.2-67.2146.3000112.5L69 L74 I76 G77 R101 Q137L69-L142 HydrophobicContact CD2-CD1 3.79Å; L69-L142 HydrophobicContact CD2-CD2 3.83Å; L69-L142 HydrophobicContact CD2-CG 4.02Å; L74-L142 HydrophobicContact CB-CD2 3.67Å; L74-L142 HydrophobicContact CD1-CD2 4.05Å; I76-L142 WeakPolarHBondContact CA-O 3.13Å; G77-L142 PolarHBondContact N-O 3.01Å; R101-L142 VanDerWaalsContact NH1-CD1 3.3Å; Q137-L142 HydrophobicContact CB-CD1 4.36Å; Q137-L142 HydrophobicContact CG-CD1 3.55Å
143E61.7Low63.5Low111 Ų11168.8 Ų68.852%0.51935%0.348SS..SBendtrans-110.3129.2172.6-64.3-173.6160.100108.5L145E143-L145 HydrophobicContact CB-CD1 4.35Å; E143-L145 HydrophobicContact CB-CG 4.49Å; E143-L145 PolarHBondContact O-N 3.34Å
144D50.6Low63.2Low110 Ų11069.2 Ų69.259%0.58835%0.352SS*.  trans-7287.7164.6-95.9-24.6000107.1I76 D146I76-D144 HydrophobicContact CG2-CB 4.17Å; I76-D144 WeakPolarHBondContact CG2-OD1 3.35Å; D144-D146 PolarHBondContact O-N 2.91Å
145L53.8Low63Low78 Ų7875 Ų7541%0.40837%0.373SS..  trans-78.697.8163.5-76.1139.7000105.7E143 W147E143-L145 HydrophobicContact CB-CD1 4.35Å; E143-L145 HydrophobicContact CB-CG 4.49Å; E143-L145 PolarHBondContact O-N 3.34Å; L145-W147 PolarHBondContact O-N 3.49Å
146D44.2Very low62.9Low141 Ų14180.5 Ų80.575%0.75439%0.394SS*.SBendtrans-55.98178.3-81.2-35.4000115.2D144D144-D146 PolarHBondContact O-N 2.91Å
147W48.7Very low63.1Low172 Ų17279.9 Ų79.965%0.65239%0.391SS*.SBendtrans-138.9117.1-177.7-59.978.2000108.1L145 E149 Y150L145-W147 PolarHBondContact O-N 3.49Å; W147-E149 PolarHBondContact O-N 3.3Å; W147-Y150 HydrophobicContact CB-CD2 4.33Å; W147-Y150 PolarHBondContact O-N 2.93Å
148S43Very low63.4Low126 Ų12678.6 Ų78.688%0.88139%0.385SS*.THydrogen-bonded Turntrans-56.716.9170.949.80000115.1
149E42.9Very low64.1Low141 Ų14183 Ų8366%0.65941%0.405SS*.THydrogen-bonded Turntrans-122.9-5.1-168.2-64.3-172.3155.300113.1W147W147-E149 PolarHBondContact O-N 3.3Å
150Y47.1Very low64.7Low167 Ų16779.5 Ų79.566%0.65539%0.391SS*.SBendtrans-116.2126.9178.7-74.3-81.6000113W147 S152W147-Y150 HydrophobicContact CB-CD2 4.33Å; W147-Y150 PolarHBondContact O-N 2.93Å; Y150-S152 PolarHBondContact O-N 2.96Å
151F52.4Low65.5Low44 Ų4477.2 Ų77.219%0.19338%0.381CS..  trans-54.1114.4179.9-178.9-103.8000112.8F153 Y191 W249F151-F153 HydrophobicContact CD1-CB 3.48Å; F151-F153 VanDerWaalsContact CD1-CB 3.48Å; F151-F153 HydrophobicContact CD1-CG 4.44Å; F151-F153 HydrophobicContact CE1-CB 2.94Å; F151-F153 HydrophobicContact CE1-CD1 4.3Å; F151-F153 AromaticContact CE1-CD2 3.85Å; F151-F153 HydrophobicContact CE1-CD2 3.85Å; F151-F153 AromaticContact CE1-CG 3.49Å; F151-F153 HydrophobicContact CE1-CG 3.49Å; F151-F153 VanDerWaalsContact CE1-CG 3.49Å; F151-F153 HydrophobicContact CZ-CB 3.6Å; F151-F153 AromaticContact CZ-CD2 3.79Å; F151-F153 HydrophobicContact CZ-CD2 3.79Å; F151-F153 AromaticContact CZ-CG 3.94Å; F151-F153 HydrophobicContact CZ-CG 3.94Å; F151-F153 PolarHBondContact O-N 3.27Å; F151-Y191 HydrophobicContact CD1-CE2 4.24Å; F151-Y191 AromaticContact CD1-CZ 3.92Å; F151-Y191 WeakPolarHBondContact CD1-OH 3.47Å; F151-Y191 HydrophobicContact CE1-CD2 4.37Å; F151-Y191 AromaticContact CE1-CE2 3.21Å; F151-Y191 HydrophobicContact CE1-CE2 3.21Å; F151-Y191 AromaticContact CE1-CZ 3.32Å; F151-Y191 WeakPolarHBondContact CE1-OH 3.17Å; F151-Y191 AromaticContact CZ-CE2 3.69Å; F151-Y191 HydrophobicContact CZ-CE2 3.69Å; F151-W249 AromaticContact CD2-NE1 3.61Å; F151-W249 AromaticContact CE2-CD1 3.97Å; F151-W249 HydrophobicContact CE2-CD2 4.46Å; F151-W249 AromaticContact CE2-CE2 3.47Å; F151-W249 VanDerWaalsContact CE2-CE2 3.47Å; F151-W249 AromaticContact CE2-CZ2 3.63Å; F151-W249 HydrophobicContact CE2-CZ2 3.63Å; F151-W249 AromaticContact CE2-NE1 3.1Å; F151-W249 HydrophobicContact CZ-CZ2 4.15Å; F151-W249 AromaticContact CZ-NE1 3.53Å
152S59.3Low66.4Low38 Ų3875 Ų7527%0.26637%0.366SS..  trans-88.991.8175.355.70000110.8P141 Y150P141-S152 VanDerWaalsContact CG-CB 3.41Å; P141-S152 VanDerWaalsContact CG-OG 3.23Å; P141-S152 WeakPolarHBondContact CG-OG 3.41Å; Y150-S152 PolarHBondContact O-N 2.96Å
153F68.7Low67.5Low19 Ų1979.1 Ų79.18%0.08339%0.385CS..  trans-125.4141.7173.9179-90.3000109.7F151 R155 I158 D187 I188 Y191 V240F151-F153 HydrophobicContact CD1-CB 3.48Å; F151-F153 VanDerWaalsContact CD1-CB 3.48Å; F151-F153 HydrophobicContact CD1-CG 4.44Å; F151-F153 HydrophobicContact CE1-CB 2.94Å; F151-F153 HydrophobicContact CE1-CD1 4.3Å; F151-F153 AromaticContact CE1-CD2 3.85Å; F151-F153 HydrophobicContact CE1-CD2 3.85Å; F151-F153 AromaticContact CE1-CG 3.49Å; F151-F153 HydrophobicContact CE1-CG 3.49Å; F151-F153 VanDerWaalsContact CE1-CG 3.49Å; F151-F153 HydrophobicContact CZ-CB 3.6Å; F151-F153 AromaticContact CZ-CD2 3.79Å; F151-F153 HydrophobicContact CZ-CD2 3.79Å; F151-F153 AromaticContact CZ-CG 3.94Å; F151-F153 HydrophobicContact CZ-CG 3.94Å; F151-F153 PolarHBondContact O-N 3.27Å; F153-R155 HydrophobicContact CD1-CG 3.72Å; F153-R155 HydrophobicContact CE1-CG 4.49Å; F153-R155 PolarHBondContact O-N 3.12Å; F153-I158 HydrophobicContact CD1-CD1 4.34Å; F153-I158 HydrophobicContact CE1-CD1 3.41Å; F153-I158 VanDerWaalsContact CE1-CD1 3.41Å; F153-I158 HydrophobicContact CE1-CG1 4.49Å; F153-I158 HydrophobicContact CE2-CD1 3.98Å; F153-I158 HydrophobicContact CZ-CD1 3.19Å; F153-D187 HydrophobicContact CE2-CB 4.11Å; F153-I188 HydrophobicContact CE2-CG1 4.46Å; F153-I188 HydrophobicContact CZ-CG1 4.39Å; F153-Y191 AromaticContact CD1-CD2 3.64Å; F153-Y191 HydrophobicContact CD1-CD2 3.64Å; F153-Y191 AromaticContact CD1-CE2 3.93Å; F153-Y191 HydrophobicContact CD1-CE2 3.93Å; F153-Y191 HydrophobicContact CD1-CG 4.04Å; F153-Y191 HydrophobicContact CD2-CD2 4.23Å; F153-Y191 HydrophobicContact CD2-CE2 4.25Å; F153-Y191 HydrophobicContact CE1-CD1 4.46Å; F153-Y191 AromaticContact CE1-CD2 3.28Å; F153-Y191 HydrophobicContact CE1-CD2 3.28Å; F153-Y191 HydrophobicContact CE1-CE2 4.04Å; F153-Y191 AromaticContact CE1-CG 3.56Å; F153-Y191 HydrophobicContact CE1-CG 3.56Å; F153-Y191 AromaticContact CE2-CD2 3.94Å; F153-Y191 HydrophobicContact CE2-CD2 3.94Å; F153-Y191 HydrophobicContact CE2-CE2 4.37Å; F153-Y191 HydrophobicContact CG-CD2 4.09Å; F153-Y191 HydrophobicContact CG-CE2 4.03Å; F153-Y191 AromaticContact CZ-CD2 3.45Å; F153-Y191 HydrophobicContact CZ-CD2 3.45Å; F153-Y191 VanDerWaalsContact CZ-CD2 3.45Å; F153-Y191 HydrophobicContact CZ-CE2 4.26Å; F153-Y191 HydrophobicContact CZ-CG 4.07Å; F153-V240 HydrophobicContact CD2-CG2 4.41Å
154P77.3Confident68.6Low10 Ų1075.3 Ų75.37%0.06537%0.368CS..  trans-74.966.8-175.835.3-40.7000111A134 Q137 E156 L157 I158A134-P154 HydrophobicContact CB-CB 4.46Å; A134-P154 HydrophobicContact CB-CG 3.77Å; A134-P154 WeakPolarHBondContact O-CG 3.48Å; Q137-P154 HydrophobicContact CB-CB 4.04Å; Q137-P154 HydrophobicContact CB-CG 4.49Å; P154-E156 VanDerWaalsContact C-N 3.34Å; P154-E156 PolarHBondContact O-N 3.41Å; P154-L157 HydrophobicContact CB-CB 4.23Å; P154-L157 PolarHBondContact O-N 2.89Å; P154-I158 HydrophobicContact CG-CD1 3.96Å; P154-I158 HydrophobicContact CG-CG1 4.42Å; P154-I158 PolarHBondContact O-N 3.38Å; P154-I158 VanDerWaalsContact O-N 3.07Å
155R79.6Confident70.3Confident120 Ų12070.1 Ų70.145%0.45334%0.34SS..Hα-helixtrans-59.8-45.3-177.9-70.6-176.8179.2173.23.1111F153 Q159 Y191 F195F153-R155 HydrophobicContact CD1-CG 3.72Å; F153-R155 HydrophobicContact CE1-CG 4.49Å; F153-R155 PolarHBondContact O-N 3.12Å; R155-Q159 WeakPolarHBondContact O-CB 3.39Å; R155-Q159 PolarHBondContact O-N 2.98Å; R155-Y191 HydrophobicContact CG-CD1 4.45Å; R155-Y191 HydrophobicContact CG-CE1 4.46Å; R155-Y191 VanDerWaalsContact NE-CE1 3.3Å; R155-Y191 PolarHBondContact NH2-OH 3.1Å; R155-F195 HydrophobicContact CB-CZ 3.91Å; R155-F195 HydrophobicContact CG-CZ 4.22Å; R155-F195 WeakPolarHBondContact O-CZ 3.48Å
156E83Confident71.8Confident145 Ų14566.6 Ų66.668%0.67832%0.322SS*.Hα-helixtrans-63.2-45.5-177.8-59-172.3159.200111.9P154 Q159 A160P154-E156 VanDerWaalsContact C-N 3.34Å; P154-E156 PolarHBondContact O-N 3.41Å; E156-Q159 PolarHBondContact O-N 3.39Å; E156-A160 WeakPolarHBondContact O-CB 3.34Å; E156-A160 PolarHBondContact O-N 2.83Å
157L83.8Confident73.6Confident12 Ų1260.2 Ų60.26%0.06329%0.288CS..Hα-helixtrans-65-48.5179.5-176.763.3000111.2V108 L130 F133 A134 P154 Q159 A160 V161V108-L157 HydrophobicContact CG1-CD1 3.44Å; V108-L157 VanDerWaalsContact CG1-CD1 3.44Å; V108-L157 HydrophobicContact CG2-CD1 4.27Å; L130-L157 HydrophobicContact CD2-CD1 4.03Å; F133-L157 HydrophobicContact CB-CD2 4.12Å; A134-L157 HydrophobicContact CB-CD2 3.88Å; P154-L157 HydrophobicContact CB-CB 4.23Å; P154-L157 PolarHBondContact O-N 2.89Å; L157-Q159 VanDerWaalsContact C-N 3.34Å; L157-Q159 PolarHBondContact O-N 3.39Å; L157-A160 WeakPolarHBondContact O-CB 3.24Å; L157-A160 PolarHBondContact O-N 3.17Å; L157-V161 WeakPolarHBondContact O-CG2 3.23Å; L157-V161 PolarHBondContact O-N 2.71Å
158I85.5Confident75Confident0 Ų057.3 Ų57.30%028%0.282CS..Hα-helixtrans-66.8-38.5179.8-68.2171.1000110.6A134 F153 P154 A160 V161 V162 V192 F195A134-I158 HydrophobicContact CB-CD1 4.25Å; A134-I158 HydrophobicContact CB-CG1 4.13Å; F153-I158 HydrophobicContact CD1-CD1 4.34Å; F153-I158 HydrophobicContact CE1-CD1 3.41Å; F153-I158 VanDerWaalsContact CE1-CD1 3.41Å; F153-I158 HydrophobicContact CE1-CG1 4.49Å; F153-I158 HydrophobicContact CE2-CD1 3.98Å; F153-I158 HydrophobicContact CZ-CD1 3.19Å; P154-I158 HydrophobicContact CG-CD1 3.96Å; P154-I158 HydrophobicContact CG-CG1 4.42Å; P154-I158 PolarHBondContact O-N 3.38Å; P154-I158 VanDerWaalsContact O-N 3.07Å; I158-A160 VanDerWaalsContact C-N 3.32Å; I158-A160 PolarHBondContact O-N 2.84Å; I158-V161 PolarHBondContact O-N 2.94Å; I158-V162 HydrophobicContact CG2-CG2 4.34Å; I158-V162 WeakPolarHBondContact O-CB 3.3Å; I158-V162 VanDerWaalsContact O-CG2 3.29Å; I158-V162 WeakPolarHBondContact O-CG2 3.46Å; I158-V162 PolarHBondContact O-N 3.46Å; I158-V192 HydrophobicContact CG2-CG2 4.13Å; I158-F195 HydrophobicContact CB-CE2 4.18Å; I158-F195 HydrophobicContact CG2-CD2 4.08Å; I158-F195 HydrophobicContact CG2-CE2 3.85Å
159Q87.3Confident76.5Confident95 Ų9555.8 Ų55.844%0.44427%0.271SS..Hα-helixtrans-60.8-42173.6-176.71793.200111.5R155 E156 L157 V162 H163 F195R155-Q159 WeakPolarHBondContact O-CB 3.39Å; R155-Q159 PolarHBondContact O-N 2.98Å; E156-Q159 PolarHBondContact O-N 3.39Å; L157-Q159 VanDerWaalsContact C-N 3.34Å; L157-Q159 PolarHBondContact O-N 3.39Å; Q159-V162 PolarHBondContact O-N 3.38Å; Q159-H163 WeakPolarHBondContact O-CB 3.4Å; Q159-H163 PolarHBondContact O-N 3.49Å; Q159-F195 HydrophobicContact CB-CD1 3.99Å; Q159-F195 HydrophobicContact CB-CD2 4.16Å; Q159-F195 HydrophobicContact CB-CE1 3.99Å; Q159-F195 HydrophobicContact CB-CE2 4.15Å; Q159-F195 HydrophobicContact CB-CG 4.09Å; Q159-F195 HydrophobicContact CB-CZ 4.08Å; Q159-F195 HydrophobicContact CG-CD1 3.97Å; Q159-F195 HydrophobicContact CG-CE1 4.32Å; Q159-F195 HydrophobicContact CG-CG 4.22Å
160A86.3Confident78.3Confident29 Ų2951.9 Ų51.924%0.2426%0.255CS..Hα-helixtrans-64.6-44175.500000111.6L112 E156 L157 I158 V162 H163 N164L112-A160 HydrophobicContact CD1-CB 3.82Å; L112-A160 HydrophobicContact CD2-CB 4.19Å; E156-A160 WeakPolarHBondContact O-CB 3.34Å; E156-A160 PolarHBondContact O-N 2.83Å; L157-A160 WeakPolarHBondContact O-CB 3.24Å; L157-A160 PolarHBondContact O-N 3.17Å; I158-A160 VanDerWaalsContact C-N 3.32Å; I158-A160 PolarHBondContact O-N 2.84Å; A160-V162 PolarHBondContact O-N 2.9Å; A160-H163 PolarHBondContact O-N 3.44Å; A160-N164 PolarHBondContact O-N 3.01Å; A160-N164 PolarHBondContact O-ND2 2.74Å
161V87.4Confident79.9Confident1 Ų148.9 Ų48.91%0.00625%0.25CC..Hα-helixtrans-57.6-51.2174.7171.50000110.5L112 L127 L130 L157 I158 H163 N164 I165 F179L112-V161 HydrophobicContact CD2-CG2 4.09Å; L127-V161 HydrophobicContact CD1-CG1 3.66Å; L130-V161 HydrophobicContact CB-CG2 4Å; L130-V161 HydrophobicContact CD1-CG2 4.06Å; L130-V161 HydrophobicContact CG-CG2 4.5Å; L157-V161 WeakPolarHBondContact O-CG2 3.23Å; L157-V161 PolarHBondContact O-N 2.71Å; I158-V161 PolarHBondContact O-N 2.94Å; V161-H163 VanDerWaalsContact C-N 3.29Å; V161-H163 PolarHBondContact O-N 3.04Å; V161-N164 PolarHBondContact O-N 2.66Å; V161-I165 HydrophobicContact CG1-CD1 3.65Å; V161-I165 HydrophobicContact CG1-CG1 4.32Å; V161-I165 VanDerWaalsContact O-CG1 3.32Å; V161-I165 WeakPolarHBondContact O-CG1 3.45Å; V161-I165 PolarHBondContact O-N 3.28Å; V161-F179 HydrophobicContact CG1-CE2 4.23Å
162V87.3Confident81.3Confident1 Ų147 Ų471%0.00624%0.241CC..Hα-helixtrans-60-39.7178.1173.20000111.2I158 Q159 A160 N164 I165 L166 V192 F195 I196I158-V162 HydrophobicContact CG2-CG2 4.34Å; I158-V162 WeakPolarHBondContact O-CB 3.3Å; I158-V162 VanDerWaalsContact O-CG2 3.29Å; I158-V162 WeakPolarHBondContact O-CG2 3.46Å; I158-V162 PolarHBondContact O-N 3.46Å; Q159-V162 PolarHBondContact O-N 3.38Å; A160-V162 PolarHBondContact O-N 2.9Å; V162-N164 PolarHBondContact O-N 3.14Å; V162-I165 PolarHBondContact O-N 3.31Å; V162-L166 HydrophobicContact CG1-CD1 3.77Å; V162-L166 HydrophobicContact CG1-CG 4.27Å; V162-L166 WeakPolarHBondContact O-CB 3.39Å; V162-L166 VanDerWaalsContact O-CG 3.24Å; V162-L166 WeakPolarHBondContact O-CG 3.47Å; V162-L166 PolarHBondContact O-N 2.95Å; V162-V192 HydrophobicContact CG2-CG1 4.21Å; V162-V192 HydrophobicContact CG2-CG2 3.92Å; V162-F195 HydrophobicContact CG1-CB 4.34Å; V162-I196 HydrophobicContact CG1-CG1 4.31Å
163H87.7Confident82.4Confident101 Ų10147.2 Ų47.247%0.46824%0.243SC..Hα-helixtrans-61.8-42.1177.3-173.474.1000112.9Q159 A160 V161 L166 N199Q159-H163 WeakPolarHBondContact O-CB 3.4Å; Q159-H163 PolarHBondContact O-N 3.49Å; A160-H163 PolarHBondContact O-N 3.44Å; V161-H163 VanDerWaalsContact C-N 3.29Å; V161-H163 PolarHBondContact O-N 3.04Å; H163-L166 CarbonylContact O-C 3.24Å; H163-L166 PolarHBondContact O-N 3.47Å; H163-N199 PolarHBondContact ND1-ND2 2.97Å
164N85.4Confident83.2Confident31 Ų3151.8 Ų51.817%0.16627%0.268CS..Hα-helixtrans-75.6-33.8179.7-71.5-75.9000112.3L115 H116 A160 V161 V162 L166L115-N164 HydrophobicContact CB-CB 4.36Å; L115-N164 HydrophobicContact CD1-CB 3.75Å; H116-N164 PolarHBondContact CE1-OD1 3.38Å; A160-N164 PolarHBondContact O-N 3.01Å; A160-N164 PolarHBondContact O-ND2 2.74Å; V161-N164 PolarHBondContact O-N 2.66Å; V162-N164 PolarHBondContact O-N 3.14Å; N164-L166 VanDerWaalsContact C-N 3.32Å
165I86.1Confident83.5Confident1 Ų151.4 Ų51.41%0.00527%0.266CS..Hα-helixtrans-63-42.5171.6-67.8170.7000110.1L127 V161 V162 S167 N172 L175 I176 F179L127-I165 HydrophobicContact CD1-CD1 4.03Å; V161-I165 HydrophobicContact CG1-CD1 3.65Å; V161-I165 HydrophobicContact CG1-CG1 4.32Å; V161-I165 VanDerWaalsContact O-CG1 3.32Å; V161-I165 WeakPolarHBondContact O-CG1 3.45Å; V161-I165 PolarHBondContact O-N 3.28Å; V162-I165 PolarHBondContact O-N 3.31Å; I165-S167 PolarHBondContact O-N 3.39Å; I165-N172 PolarHBondContact O-ND2 3.32Å; I165-L175 HydrophobicContact CG1-CD2 4.04Å; I165-I176 HydrophobicContact CG2-CD1 4.25Å; I165-I176 HydrophobicContact CG2-CG1 3.54Å; I165-F179 HydrophobicContact CD1-CB 4.43Å; I165-F179 HydrophobicContact CD1-CD1 4.36Å; I165-F179 HydrophobicContact CD1-CD2 3.9Å; I165-F179 HydrophobicContact CD1-CE2 4.2Å; I165-F179 HydrophobicContact CD1-CG 3.97Å
166L84.3Confident83.8Confident4 Ų445.7 Ų45.72%0.02124%0.244CC..THydrogen-bonded Turntrans-81.149.9176.9-61.3179.8000112.3V162 H163 N164 I196 Y215 N218 V219 L222V162-L166 HydrophobicContact CG1-CD1 3.77Å; V162-L166 HydrophobicContact CG1-CG 4.27Å; V162-L166 WeakPolarHBondContact O-CB 3.39Å; V162-L166 VanDerWaalsContact O-CG 3.24Å; V162-L166 WeakPolarHBondContact O-CG 3.47Å; V162-L166 PolarHBondContact O-N 2.95Å; H163-L166 CarbonylContact O-C 3.24Å; H163-L166 PolarHBondContact O-N 3.47Å; N164-L166 VanDerWaalsContact C-N 3.32Å; L166-I196 HydrophobicContact CD1-CG1 4.3Å; L166-Y215 HydrophobicContact CB-CE2 3.97Å; L166-Y215 VanDerWaalsContact O-CD2 3.29Å; L166-Y215 WeakPolarHBondContact O-CD2 3.48Å; L166-Y215 VanDerWaalsContact O-CE2 3.31Å; L166-Y215 WeakPolarHBondContact O-CE2 3.05Å; L166-N218 HydrophobicContact CD2-CB 4.37Å; L166-V219 HydrophobicContact CD1-CG2 4.18Å; L166-V219 HydrophobicContact CD2-CB 4.35Å; L166-V219 HydrophobicContact CD2-CG2 3.73Å; L166-V219 HydrophobicContact CG-CG2 4.41Å; L166-L222 HydrophobicContact CD1-CD2 4.42Å; L166-L222 HydrophobicContact CD2-CB 4.43Å; L166-L222 HydrophobicContact CD2-CD2 3.8Å; L166-L222 HydrophobicContact CG-CD2 4.25Å
167S81.8Confident84Confident7 Ų742 Ų425%0.04923%0.234CC..  trans-67.2154178.287.20000111.8I165 L170 N172 N218I165-S167 PolarHBondContact O-N 3.39Å; S167-L170 PolarHBondContact OG-N 3Å; S167-L170 VanDerWaalsContact OG-N 3.15Å; S167-L170 PolarHBondContact OG-O 3.12Å; S167-N172 PolarHBondContact OG-ND2 3.4Å; S167-N218 PolarHBondContact O-ND2 3Å; S167-N218 VanDerWaalsContact O-ND2 3.17Å
168Q79.3Confident84.1Confident112 Ų11245.2 Ų45.252%0.52325%0.245SC..SBendtrans-87.7-20.4178.8-63.817825.500113.4Y215Q168-Y215 HydrophobicContact CG-CD2 4.13Å; Q168-Y215 HydrophobicContact CG-CG 4.46Å
169S74.4Confident84.1Confident93 Ų9345.2 Ų45.265%0.6525%0.245SC*.SBendtrans-108.6-30.7-169.649.30000113.9
170L80Confident84.1Confident60 Ų6043.5 Ų43.531%0.31424%0.237SC..SBendtrans-111.4136.4-173.4-60.5173.6000111H116 S167 N172 N218H116-L170 HydrophobicContact CB-CD1 4.22Å; S167-L170 PolarHBondContact OG-N 3Å; S167-L170 VanDerWaalsContact OG-N 3.15Å; S167-L170 PolarHBondContact OG-O 3.12Å; L170-N172 PolarHBondContact O-N 2.96Å; L170-N218 PolarHBondContact O-ND2 2.87Å
171D80.6Confident84.1Confident103 Ų10346.7 Ų46.755%0.55125%0.247SC*.  trans-73.5117.5166.1-177.1-3000108.8S173D171-S173 VanDerWaalsContact OD1-CB 3.25Å; D171-S173 WeakPolarHBondContact OD1-CB 3.16Å; D171-S173 PolarHBondContact OD1-N 2.85Å; D171-S173 PolarHBondContact OD1-OG 3.34Å
172N81.7Confident83.9Confident4 Ų448.3 Ų48.32%0.02125%0.254CS..  trans-111.322.8-177.6-76.4-30.4000111.8K123 I165 S167 L170 L174 L175 I176 N218K123-N172 PolarHBondContact NZ-OD1 2.93Å; I165-N172 PolarHBondContact O-ND2 3.32Å; S167-N172 PolarHBondContact OG-ND2 3.4Å; L170-N172 PolarHBondContact O-N 2.96Å; N172-L174 VanDerWaalsContact C-N 3.31Å; N172-L174 PolarHBondContact O-N 3.34Å; N172-L175 HydrophobicContact CB-CB 4.34Å; N172-L175 WeakPolarHBondContact O-CB 3.22Å; N172-L175 PolarHBondContact O-N 3.34Å; N172-L175 VanDerWaalsContact O-N 3.07Å; N172-I176 HydrophobicContact CB-CD1 4.49Å; N172-I176 VanDerWaalsContact O-CG1 3.27Å; N172-I176 WeakPolarHBondContact O-CG1 3.15Å; N172-I176 PolarHBondContact O-N 3.49Å; N172-N218 PolarHBondContact N-OD1 3.01Å; N172-N218 VanDerWaalsContact N-OD1 3.11Å
173S82.6Confident83.7Confident43 Ų4348.6 Ų48.630%0.30126%0.256SS..Hα-helixtrans-50.2-43.7-179.448.80000114.5D171 I176 S177D171-S173 VanDerWaalsContact OD1-CB 3.25Å; D171-S173 WeakPolarHBondContact OD1-CB 3.16Å; D171-S173 PolarHBondContact OD1-N 2.85Å; D171-S173 PolarHBondContact OD1-OG 3.34Å; S173-I176 PolarHBondContact O-N 3.45Å; S173-S177 PolarHBondContact O-N 2.88Å
174L85Confident83.5Confident116 Ų11649.5 Ų49.561%0.60726%0.26SS*.Hα-helixtrans-66.1-43177.1-63.1176.1000112.5H120 N172 I176 S177 R178H120-L174 WeakPolarHBondContact NE2-CB 3.3Å; N172-L174 VanDerWaalsContact C-N 3.31Å; N172-L174 PolarHBondContact O-N 3.34Å; L174-I176 VanDerWaalsContact C-N 3.3Å; L174-I176 PolarHBondContact O-N 2.83Å; L174-S177 WeakPolarHBondContact O-CB 3.4Å; L174-S177 PolarHBondContact O-N 3.48Å; L174-S177 VanDerWaalsContact O-N 3.14Å; L174-R178 PolarHBondContact O-N 2.91Å
175L84.1Confident83.4Confident2 Ų249.4 Ų49.41%0.0126%0.259CS..Hα-helixtrans-64.7-37.8177.4-171.167.8000111.1L115 K123 L127 I165 N172 S177 R178 F179L115-L175 HydrophobicContact CD2-CD2 4.32Å; K123-L175 HydrophobicContact CB-CD1 4.05Å; L127-L175 HydrophobicContact CB-CD1 4.03Å; L127-L175 HydrophobicContact CD2-CD1 3.55Å; L127-L175 HydrophobicContact CD2-CG 4Å; L127-L175 HydrophobicContact CG-CD1 4.37Å; I165-L175 HydrophobicContact CG1-CD2 4.04Å; N172-L175 HydrophobicContact CB-CB 4.34Å; N172-L175 WeakPolarHBondContact O-CB 3.22Å; N172-L175 PolarHBondContact O-N 3.34Å; N172-L175 VanDerWaalsContact O-N 3.07Å; L175-S177 VanDerWaalsContact C-N 3.32Å; L175-R178 PolarHBondContact O-N 2.84Å; L175-F179 WeakPolarHBondContact O-CB 3.36Å; L175-F179 PolarHBondContact O-N 2.82Å
176I86.7Confident83.1Confident0 Ų049.6 Ų49.60%026%0.26CS..Hα-helixtrans-64.5-37.4174.4-67.7163.6000110.9I165 N172 S173 L174 F179 Q180 N218 T221 L222I165-I176 HydrophobicContact CG2-CD1 4.25Å; I165-I176 HydrophobicContact CG2-CG1 3.54Å; N172-I176 HydrophobicContact CB-CD1 4.49Å; N172-I176 VanDerWaalsContact O-CG1 3.27Å; N172-I176 WeakPolarHBondContact O-CG1 3.15Å; N172-I176 PolarHBondContact O-N 3.49Å; S173-I176 PolarHBondContact O-N 3.45Å; L174-I176 VanDerWaalsContact C-N 3.3Å; L174-I176 PolarHBondContact O-N 2.83Å; I176-F179 PolarHBondContact O-N 2.72Å; I176-Q180 PolarHBondContact O-N 3.07Å; I176-N218 HydrophobicContact CD1-CB 4.19Å; I176-N218 WeakPolarHBondContact CD1-O 3.27Å; I176-T221 HydrophobicContact CB-CG2 4.47Å; I176-T221 HydrophobicContact CD1-CG2 4.46Å; I176-T221 HydrophobicContact CG2-CG2 3.95Å; I176-L222 HydrophobicContact CD1-CB 4.47Å; I176-L222 HydrophobicContact CG2-CB 4.1Å; I176-L222 HydrophobicContact CG2-CD1 3.89Å
177S86.2Confident83Confident67 Ų6749.4 Ų49.447%0.46926%0.259SS..Hα-helixtrans-64.1-39.8173.6-169.90000111.9S173 L174 L175 F179 Q180S173-S177 PolarHBondContact O-N 2.88Å; L174-S177 WeakPolarHBondContact O-CB 3.4Å; L174-S177 PolarHBondContact O-N 3.48Å; L174-S177 VanDerWaalsContact O-N 3.14Å; L175-S177 VanDerWaalsContact C-N 3.32Å; S177-F179 VanDerWaalsContact C-N 3.34Å; S177-Q180 WeakPolarHBondContact O-CB 3.15Å; S177-Q180 PolarHBondContact O-N 3.5Å
178R85.9Confident83.2Confident79 Ų7949.1 Ų49.130%0.29826%0.257SS..Hα-helixtrans-67.5-37.6173.2-166.972.4179.4130.329.1111.6E124 L174 L175 Q180 E181E124-R178 HydrophobicContact CG-CG 4.17Å; E124-R178 VanDerWaalsContact OE1-CD 3.32Å; E124-R178 WeakPolarHBondContact OE1-CD 3.29Å; E124-R178 IonicContact OE1-CZ 3.99Å; E124-R178 IonicContact OE1-NE 3.13Å; E124-R178 PolarHBondContact OE1-NE 3.04Å; L174-R178 PolarHBondContact O-N 2.91Å; L175-R178 PolarHBondContact O-N 2.84Å; R178-Q180 PolarHBondContact O-N 3.32Å; R178-E181 IonicContact CZ-OE1 3.28Å; R178-E181 IonicContact CZ-OE2 3.6Å; R178-E181 IonicContact NH1-OE1 2.66Å; R178-E181 PolarHBondContact NH1-OE1 3.34Å; R178-E181 IonicContact NH1-OE2 3.54Å; R178-E181 PolarHBondContact NH1-OE2 3.47Å; R178-E181 IonicContact NH2-OE1 3.18Å; R178-E181 IonicContact NH2-OE2 2.62Å; R178-E181 PolarHBondContact NH2-OE2 2.86Å; R178-E181 PolarHBondContact O-N 3.22Å
179F87.2Confident83.5Confident1 Ų144.3 Ų44.30%0.00423%0.234CC..Hα-helixtrans-65.9-21.3177.9-168.2-109.5000113.3L127 M131 V161 I165 L175 I176 S177 E181 F182 L183 I188 V192 L222L127-F179 HydrophobicContact CD1-CD2 4Å; L127-F179 HydrophobicContact CD1-CE2 4.46Å; L127-F179 HydrophobicContact CD2-CB 4.18Å; L127-F179 HydrophobicContact CD2-CD2 4.2Å; M131-F179 HydrophobicContact CE-CE2 4.11Å; M131-F179 HydrophobicContact SD-CE2 3.8Å; V161-F179 HydrophobicContact CG1-CE2 4.23Å; I165-F179 HydrophobicContact CD1-CB 4.43Å; I165-F179 HydrophobicContact CD1-CD1 4.36Å; I165-F179 HydrophobicContact CD1-CD2 3.9Å; I165-F179 HydrophobicContact CD1-CE2 4.2Å; I165-F179 HydrophobicContact CD1-CG 3.97Å; L175-F179 WeakPolarHBondContact O-CB 3.36Å; L175-F179 PolarHBondContact O-N 2.82Å; I176-F179 PolarHBondContact O-N 2.72Å; S177-F179 VanDerWaalsContact C-N 3.34Å; F179-E181 VanDerWaalsContact C-N 3.25Å; F179-E181 PolarHBondContact O-N 2.88Å; F179-F182 HydrophobicContact CD2-CB 4.47Å; F179-F182 AromaticContact CD2-CD2 3.88Å; F179-F182 HydrophobicContact CD2-CD2 3.88Å; F179-F182 HydrophobicContact CE2-CB 4.44Å; F179-F182 HydrophobicContact CE2-CD2 4.4Å; F179-F182 PolarHBondContact O-N 2.91Å; F179-L183 HydrophobicContact CD1-CD1 4.19Å; F179-L183 HydrophobicContact CD1-CD2 4.12Å; F179-L183 HydrophobicContact CD1-CG 3.92Å; F179-L183 HydrophobicContact CE1-CD2 3.68Å; F179-L183 HydrophobicContact CE1-CG 4Å; F179-L183 PolarHBondContact O-N 3.27Å; F179-I188 HydrophobicContact CZ-CG2 4.46Å; F179-V192 HydrophobicContact CE1-CG1 4.47Å; F179-V192 HydrophobicContact CE1-CG2 4.11Å; F179-V192 HydrophobicContact CZ-CG2 4.08Å; F179-L222 HydrophobicContact CD1-CD1 3.89Å; F179-L222 HydrophobicContact CE1-CD1 4.34Å
180Q86.1Confident84.1Confident59 Ų5941.7 Ų41.728%0.27621%0.21SC..Hα-helixtrans-57-36.3176.9-172.9178.9-12.600112.8I176 S177 R178 F182 L183 E184 N225I176-Q180 PolarHBondContact O-N 3.07Å; S177-Q180 WeakPolarHBondContact O-CB 3.15Å; S177-Q180 PolarHBondContact O-N 3.5Å; R178-Q180 PolarHBondContact O-N 3.32Å; Q180-F182 PolarHBondContact O-N 2.86Å; Q180-L183 WeakPolarHBondContact O-CB 3.23Å; Q180-L183 PolarHBondContact O-N 3.34Å; Q180-E184 PolarHBondContact O-N 2.88Å; Q180-N225 HydrophobicContact CG-CB 4.22Å
181E85.9Confident84.4Confident95 Ų9539.4 Ų39.444%0.44420%0.197SC..Hα-helixtrans-58-34175.8-64.2-177.4175.200111.6R178 F179R178-E181 IonicContact CZ-OE1 3.28Å; R178-E181 IonicContact CZ-OE2 3.6Å; R178-E181 IonicContact NH1-OE1 2.66Å; R178-E181 PolarHBondContact NH1-OE1 3.34Å; R178-E181 IonicContact NH1-OE2 3.54Å; R178-E181 PolarHBondContact NH1-OE2 3.47Å; R178-E181 IonicContact NH2-OE1 3.18Å; R178-E181 IonicContact NH2-OE2 2.62Å; R178-E181 PolarHBondContact NH2-OE2 2.86Å; R178-E181 PolarHBondContact O-N 3.22Å; F179-E181 VanDerWaalsContact C-N 3.25Å; F179-E181 PolarHBondContact O-N 2.88Å
182F83.8Confident84.7Confident36 Ų3634.5 Ų34.516%0.15817%0.171CC..Hα-helixtrans-82.4-21.9176.8-52.8-69000112.9M131 F179 Q180 E184 M185 I188M131-F182 HydrophobicContact CB-CD1 4.11Å; M131-F182 HydrophobicContact CB-CD2 4.49Å; M131-F182 HydrophobicContact CB-CE1 3.76Å; M131-F182 HydrophobicContact CB-CE2 4.2Å; M131-F182 HydrophobicContact CB-CG 4.47Å; M131-F182 HydrophobicContact CB-CZ 3.82Å; M131-F182 HydrophobicContact CE-CB 3.87Å; M131-F182 HydrophobicContact CE-CD1 4.18Å; M131-F182 HydrophobicContact CE-CD2 4.44Å; M131-F182 HydrophobicContact CE-CG 3.92Å; M131-F182 HydrophobicContact CG-CD1 4.21Å; M131-F182 HydrophobicContact CG-CD2 3.82Å; M131-F182 HydrophobicContact CG-CE1 4.14Å; M131-F182 HydrophobicContact CG-CE2 3.76Å; M131-F182 HydrophobicContact CG-CG 4.06Å; M131-F182 HydrophobicContact CG-CZ 3.93Å; F179-F182 HydrophobicContact CD2-CB 4.47Å; F179-F182 AromaticContact CD2-CD2 3.88Å; F179-F182 HydrophobicContact CD2-CD2 3.88Å; F179-F182 HydrophobicContact CE2-CB 4.44Å; F179-F182 HydrophobicContact CE2-CD2 4.4Å; F179-F182 PolarHBondContact O-N 2.91Å; Q180-F182 PolarHBondContact O-N 2.86Å; F182-E184 PolarHBondContact O-N 3.11Å; F182-M185 HydrophobicContact CB-CE 3.9Å; F182-M185 HydrophobicContact CD1-CE 3.73Å; F182-M185 HydrophobicContact CG-CE 4.31Å; F182-M185 PolarHBondContact O-N 2.99Å; F182-I188 HydrophobicContact CB-CD1 4.35Å
183L82.7Confident85Confident6 Ų634.3 Ų34.33%0.03117%0.17CC..Hα-helixtrans-73-14.1174.1-67.6177.3000112.9F179 Q180 M185 V192 L222 N225 I226F179-L183 HydrophobicContact CD1-CD1 4.19Å; F179-L183 HydrophobicContact CD1-CD2 4.12Å; F179-L183 HydrophobicContact CD1-CG 3.92Å; F179-L183 HydrophobicContact CE1-CD2 3.68Å; F179-L183 HydrophobicContact CE1-CG 4Å; F179-L183 PolarHBondContact O-N 3.27Å; Q180-L183 WeakPolarHBondContact O-CB 3.23Å; Q180-L183 PolarHBondContact O-N 3.34Å; L183-M185 PolarHBondContact O-N 3.31Å; L183-V192 HydrophobicContact CD2-CB 4.18Å; L183-V192 HydrophobicContact CD2-CG1 4Å; L183-V192 HydrophobicContact CD2-CG2 4.18Å; L183-L222 HydrophobicContact CD1-CD1 3.95Å; L183-N225 HydrophobicContact CD1-CB 4.35Å; L183-I226 HydrophobicContact CD1-CG1 4.15Å
184E83.4Confident85.3Confident121 Ų12133.1 Ų33.157%0.56516%0.162SC*.THydrogen-bonded Turntrans-66.3-18.7169.1-62.9-173.3170.900112.4Q180 F182Q180-E184 PolarHBondContact O-N 2.88Å; F182-E184 PolarHBondContact O-N 3.11Å
185M83.3Confident85.4Confident29 Ų2928.4 Ų28.414%0.14314%0.136CC..SBendtrans-80.7128.2173.2-69178.7-84.100111F182 L183 D187 I188 R189 N237 M239F182-M185 HydrophobicContact CB-CE 3.9Å; F182-M185 HydrophobicContact CD1-CE 3.73Å; F182-M185 HydrophobicContact CG-CE 4.31Å; F182-M185 PolarHBondContact O-N 2.99Å; L183-M185 PolarHBondContact O-N 3.31Å; M185-D187 PolarHBondContact O-N 3.3Å; M185-I188 HydrophobicContact CB-CB 4.24Å; M185-I188 HydrophobicContact CB-CD1 4.05Å; M185-I188 HydrophobicContact CB-CG1 4Å; M185-I188 HydrophobicContact CE-CD1 3.24Å; M185-I188 HydrophobicContact CE-CG1 4.41Å; M185-I188 PolarHBondContact O-N 3.01Å; M185-I188 HydrophobicContact SD-CD1 3.86Å; M185-R189 WeakPolarHBondContact O-CB 3.07Å; M185-R189 PolarHBondContact O-N 2.95Å; M185-N237 CarbonylContact C-O 3.54Å; M185-N237 VanDerWaalsContact CA-O 3.27Å; M185-N237 WeakPolarHBondContact CA-O 3.35Å; M185-M239 HydrophobicContact SD-CB 3.55Å; M185-M239 VanDerWaalsContact SD-CB 3.55Å; M185-M239 HydrophobicContact SD-CG 3.81Å
186D80.7Confident85.6Confident5 Ų528.3 Ų28.33%0.02714%0.136CC..Hα-helixtrans-66.6-42.1-169.4-62.7-50000112.4R189 Y190 L235 T236 N237 F238 H257D186-R189 PolarHBondContact O-N 3.4Å; D186-R189 IonicContact OD1-CZ 2.66Å; D186-R189 IonicContact OD1-NH1 3.51Å; D186-R189 IonicContact OD1-NH2 3.83Å; D186-R189 PolarHBondContact OD1-NH2 2.94Å; D186-Y190 PolarHBondContact O-N 3.35Å; D186-L235 HydrophobicContact CB-CD2 4Å; D186-L235 WeakPolarHBondContact OD1-CD2 3.29Å; D186-L235 VanDerWaalsContact OD2-CA 3.26Å; D186-L235 WeakPolarHBondContact OD2-CA 3.44Å; D186-T236 PolarHBondContact OD2-N 2.9Å; D186-N237 PolarHBondContact N-O 3.44Å; D186-N237 PolarHBondContact OD2-N 2.98Å; D186-F238 HydrophobicContact CB-CD1 3.91Å; D186-F238 HydrophobicContact CB-CE1 3.65Å; D186-F238 HydrophobicContact CB-CZ 4.25Å; D186-H257 PolarHBondContact O-CE1 3.19Å
187D82.6Confident85.8Confident0 Ų032 Ų320%015%0.15CC..Hα-helixtrans-64.9-47.5177.450.5-4.7000111.9F153 M185 R189 Y190 Y191 F238 M239 V240 W249F153-D187 HydrophobicContact CE2-CB 4.11Å; M185-D187 PolarHBondContact O-N 3.3Å; D187-R189 VanDerWaalsContact C-N 3.34Å; D187-R189 PolarHBondContact O-N 2.9Å; D187-Y190 PolarHBondContact O-N 3.32Å; D187-Y191 WeakPolarHBondContact O-CD2 3.23Å; D187-Y191 PolarHBondContact O-N 3.33Å; D187-Y191 VanDerWaalsContact O-N 3.09Å; D187-F238 HydrophobicContact CB-CD1 4.26Å; D187-M239 WeakPolarHBondContact OD1-CB 3.03Å; D187-M239 PolarHBondContact OD1-N 3.35Å; D187-M239 VanDerWaalsContact OD2-CB 3.23Å; D187-M239 WeakPolarHBondContact OD2-CB 3.42Å; D187-M239 PolarHBondContact OD2-N 3.13Å; D187-V240 PolarHBondContact OD2-N 3.23Å; D187-W249 HydrophobicContact CB-CZ2 4.24Å
188I84.9Confident85.9Confident0 Ų031.9 Ų31.90%014%0.144CC..Hα-helixtrans-58.6-48.8176.3-57.2-172000110.1M131 F153 F179 F182 M185 Y190 Y191 V192 M239M131-I188 HydrophobicContact CE-CD1 3.64Å; F153-I188 HydrophobicContact CE2-CG1 4.46Å; F153-I188 HydrophobicContact CZ-CG1 4.39Å; F179-I188 HydrophobicContact CZ-CG2 4.46Å; F182-I188 HydrophobicContact CB-CD1 4.35Å; M185-I188 HydrophobicContact CB-CB 4.24Å; M185-I188 HydrophobicContact CB-CD1 4.05Å; M185-I188 HydrophobicContact CB-CG1 4Å; M185-I188 HydrophobicContact CE-CD1 3.24Å; M185-I188 HydrophobicContact CE-CG1 4.41Å; M185-I188 PolarHBondContact O-N 3.01Å; M185-I188 HydrophobicContact SD-CD1 3.86Å; I188-Y190 VanDerWaalsContact C-N 3.35Å; I188-Y190 PolarHBondContact O-N 3.02Å; I188-Y191 PolarHBondContact O-N 3.21Å; I188-V192 HydrophobicContact CG2-CG2 3.75Å; I188-V192 VanDerWaalsContact O-CB 3.28Å; I188-V192 WeakPolarHBondContact O-CB 3.31Å; I188-V192 WeakPolarHBondContact O-CG2 3.29Å; I188-V192 PolarHBondContact O-N 2.96Å; I188-M239 HydrophobicContact CD1-CB 4.24Å; I188-M239 HydrophobicContact CD1-CE 3.8Å; I188-M239 HydrophobicContact CD1-CG 4.22Å; I188-M239 HydrophobicContact CD1-SD 3.51Å; I188-M239 VanDerWaalsContact CD1-SD 3.51Å; I188-M239 HydrophobicContact CG1-CB 4.22Å; I188-M239 HydrophobicContact CG1-SD 3.87Å
189R85.4Confident85.9Confident12 Ų1228.9 Ų28.95%0.04513%0.134CC..Hα-helixtrans-53.8-49.8178.1-178.418064.8-146.6-18.1112M185 D186 D187 Y191 V192 M193 I226 N227 H257M185-R189 WeakPolarHBondContact O-CB 3.07Å; M185-R189 PolarHBondContact O-N 2.95Å; D186-R189 PolarHBondContact O-N 3.4Å; D186-R189 IonicContact OD1-CZ 2.66Å; D186-R189 IonicContact OD1-NH1 3.51Å; D186-R189 IonicContact OD1-NH2 3.83Å; D186-R189 PolarHBondContact OD1-NH2 2.94Å; D187-R189 VanDerWaalsContact C-N 3.34Å; D187-R189 PolarHBondContact O-N 2.9Å; R189-Y191 PolarHBondContact O-N 2.87Å; R189-V192 PolarHBondContact O-N 2.96Å; R189-M193 HydrophobicContact CG-CE 3.41Å; R189-M193 VanDerWaalsContact CG-CE 3.41Å; R189-M193 WeakPolarHBondContact O-CG 3.5Å; R189-M193 PolarHBondContact O-N 2.88Å; R189-I226 HydrophobicContact CG-CG2 3.96Å; R189-N227 WeakPolarHBondContact CD-O 3.22Å; R189-N227 PolarHBondContact NH1-O 3.45Å; R189-H257 PolarHBondContact NE-ND1 3.45Å; R189-H257 PolarHBondContact NH2-CE1 3.12Å
190Y86.5Confident85.9Confident37 Ų3729 Ų2915%0.14514%0.135CC..Hα-helixtrans-59.5-48.2179.5176-98.7000112.4D186 D187 I188 M193 S194 K250 A251 D256 A260D186-Y190 PolarHBondContact O-N 3.35Å; D187-Y190 PolarHBondContact O-N 3.32Å; I188-Y190 VanDerWaalsContact C-N 3.35Å; I188-Y190 PolarHBondContact O-N 3.02Å; Y190-M193 PolarHBondContact O-N 3.4Å; Y190-S194 PolarHBondContact O-N 3.07Å; Y190-K250 HydrophobicContact CE1-CB 4.4Å; Y190-A251 HydrophobicContact CD1-CB 3.64Å; Y190-A251 HydrophobicContact CE1-CB 4.34Å; Y190-A251 HydrophobicContact CG-CB 3.81Å; Y190-D256 HydrophobicContact CE2-CB 4.14Å; Y190-A260 HydrophobicContact CD2-CB 4.16Å; Y190-A260 HydrophobicContact CE2-CB 4.01Å
191Y86.5Confident86Confident13 Ų1327.8 Ų27.85%0.05114%0.135CC..Hα-helixtrans-69.6-40.3-179.2-74.6-66000112.2F151 F153 R155 D187 I188 R189 M193 S194 F195 A251F151-Y191 HydrophobicContact CD1-CE2 4.24Å; F151-Y191 AromaticContact CD1-CZ 3.92Å; F151-Y191 WeakPolarHBondContact CD1-OH 3.47Å; F151-Y191 HydrophobicContact CE1-CD2 4.37Å; F151-Y191 AromaticContact CE1-CE2 3.21Å; F151-Y191 HydrophobicContact CE1-CE2 3.21Å; F151-Y191 AromaticContact CE1-CZ 3.32Å; F151-Y191 WeakPolarHBondContact CE1-OH 3.17Å; F151-Y191 AromaticContact CZ-CE2 3.69Å; F151-Y191 HydrophobicContact CZ-CE2 3.69Å; F153-Y191 AromaticContact CD1-CD2 3.64Å; F153-Y191 HydrophobicContact CD1-CD2 3.64Å; F153-Y191 AromaticContact CD1-CE2 3.93Å; F153-Y191 HydrophobicContact CD1-CE2 3.93Å; F153-Y191 HydrophobicContact CD1-CG 4.04Å; F153-Y191 HydrophobicContact CD2-CD2 4.23Å; F153-Y191 HydrophobicContact CD2-CE2 4.25Å; F153-Y191 HydrophobicContact CE1-CD1 4.46Å; F153-Y191 AromaticContact CE1-CD2 3.28Å; F153-Y191 HydrophobicContact CE1-CD2 3.28Å; F153-Y191 HydrophobicContact CE1-CE2 4.04Å; F153-Y191 AromaticContact CE1-CG 3.56Å; F153-Y191 HydrophobicContact CE1-CG 3.56Å; F153-Y191 AromaticContact CE2-CD2 3.94Å; F153-Y191 HydrophobicContact CE2-CD2 3.94Å; F153-Y191 HydrophobicContact CE2-CE2 4.37Å; F153-Y191 HydrophobicContact CG-CD2 4.09Å; F153-Y191 HydrophobicContact CG-CE2 4.03Å; F153-Y191 AromaticContact CZ-CD2 3.45Å; F153-Y191 HydrophobicContact CZ-CD2 3.45Å; F153-Y191 VanDerWaalsContact CZ-CD2 3.45Å; F153-Y191 HydrophobicContact CZ-CE2 4.26Å; F153-Y191 HydrophobicContact CZ-CG 4.07Å; R155-Y191 HydrophobicContact CG-CD1 4.45Å; R155-Y191 HydrophobicContact CG-CE1 4.46Å; R155-Y191 VanDerWaalsContact NE-CE1 3.3Å; R155-Y191 PolarHBondContact NH2-OH 3.1Å; D187-Y191 WeakPolarHBondContact O-CD2 3.23Å; D187-Y191 PolarHBondContact O-N 3.33Å; D187-Y191 VanDerWaalsContact O-N 3.09Å; I188-Y191 PolarHBondContact O-N 3.21Å; R189-Y191 PolarHBondContact O-N 2.87Å; Y191-M193 VanDerWaalsContact C-N 3.33Å; Y191-M193 PolarHBondContact O-N 3.44Å; Y191-S194 PolarHBondContact O-N 3.24Å; Y191-S194 PolarHBondContact O-OG 2.94Å; Y191-F195 HydrophobicContact CD1-CZ 4.43Å; Y191-F195 WeakPolarHBondContact O-CD2 3.46Å; Y191-F195 VanDerWaalsContact O-CG 3.23Å; Y191-F195 WeakPolarHBondContact O-CG 3.25Å; Y191-F195 PolarHBondContact O-N 3.33Å; Y191-A251 HydrophobicContact CE2-CB 4.31Å
192V88.4Confident86Confident0 Ų026.6 Ų26.60%013%0.134CC..Hα-helixtrans-58.7-43.5175.9170.30000110.8I158 V162 F179 L183 I188 R189 S194 F195 I196 L222I158-V192 HydrophobicContact CG2-CG2 4.13Å; V162-V192 HydrophobicContact CG2-CG1 4.21Å; V162-V192 HydrophobicContact CG2-CG2 3.92Å; F179-V192 HydrophobicContact CE1-CG1 4.47Å; F179-V192 HydrophobicContact CE1-CG2 4.11Å; F179-V192 HydrophobicContact CZ-CG2 4.08Å; L183-V192 HydrophobicContact CD2-CB 4.18Å; L183-V192 HydrophobicContact CD2-CG1 4Å; L183-V192 HydrophobicContact CD2-CG2 4.18Å; I188-V192 HydrophobicContact CG2-CG2 3.75Å; I188-V192 VanDerWaalsContact O-CB 3.28Å; I188-V192 WeakPolarHBondContact O-CB 3.31Å; I188-V192 WeakPolarHBondContact O-CG2 3.29Å; I188-V192 PolarHBondContact O-N 2.96Å; R189-V192 PolarHBondContact O-N 2.96Å; V192-S194 VanDerWaalsContact C-N 3.28Å; V192-S194 PolarHBondContact O-N 2.86Å; V192-F195 PolarHBondContact O-N 3.39Å; V192-F195 VanDerWaalsContact O-N 3.16Å; V192-I196 HydrophobicContact CG1-CD1 3.66Å; V192-I196 HydrophobicContact CG1-CG1 4.11Å; V192-I196 VanDerWaalsContact O-CG1 3.25Å; V192-I196 WeakPolarHBondContact O-CG1 3.33Å; V192-I196 PolarHBondContact O-N 3.22Å; V192-L222 HydrophobicContact CG1-CD2 4.48Å
193M87.8Confident86Confident0 Ų025.3 Ų25.30%013%0.129CC..Hα-helixtrans-56.7-42.9174.3-69.8172-166.500112.4R189 Y190 Y191 R197 I226 M228 A260 F261 M264R189-M193 HydrophobicContact CG-CE 3.41Å; R189-M193 VanDerWaalsContact CG-CE 3.41Å; R189-M193 WeakPolarHBondContact O-CG 3.5Å; R189-M193 PolarHBondContact O-N 2.88Å; Y190-M193 PolarHBondContact O-N 3.4Å; Y191-M193 VanDerWaalsContact C-N 3.33Å; Y191-M193 PolarHBondContact O-N 3.44Å; M193-R197 PolarHBondContact O-N 2.77Å; M193-R197 VanDerWaalsContact O-N 3.15Å; M193-I226 HydrophobicContact CE-CG2 3.32Å; M193-I226 HydrophobicContact CG-CD1 4.12Å; M193-M228 HydrophobicContact CE-CE 4.46Å; M193-M228 HydrophobicContact CE-SD 3.25Å; M193-M228 WeakPolarHBondContact CE-SD 3.43Å; M193-M228 HydrophobicContact SD-SD 4.46Å; M193-A260 HydrophobicContact CB-CB 4.25Å; M193-A260 HydrophobicContact SD-CB 4.01Å; M193-F261 HydrophobicContact CE-CB 4.4Å; M193-F261 HydrophobicContact CE-CD2 4.17Å; M193-F261 HydrophobicContact SD-CB 4.02Å; M193-M264 HydrophobicContact CB-SD 4.03Å; M193-M264 HydrophobicContact CG-CE 4.38Å; M193-M264 HydrophobicContact CG-SD 3.89Å
194S87.9Confident86.1Confident18 Ų1825.1 Ų25.113%0.12613%0.128CC..Hα-helixtrans-67.1-39178.775.70000112.1Y190 Y191 V192 R197 D198Y190-S194 PolarHBondContact O-N 3.07Å; Y191-S194 PolarHBondContact O-N 3.24Å; Y191-S194 PolarHBondContact O-OG 2.94Å; V192-S194 VanDerWaalsContact C-N 3.28Å; V192-S194 PolarHBondContact O-N 2.86Å; S194-R197 WeakPolarHBondContact O-CB 3.15Å; S194-R197 PolarHBondContact O-N 3.25Å; S194-D198 VanDerWaalsContact O-CG 3.3Å; S194-D198 PolarHBondContact O-N 3.42Å; S194-D198 VanDerWaalsContact O-N 3.12Å
195F87.7Confident86.1Confident16 Ų1624.5 Ų24.57%0.0713%0.129CC..Hα-helixtrans-70.8-38.7177.6-59.9-37.6000112.4R155 I158 Q159 V162 Y191 V192 R197 D198 N199R155-F195 HydrophobicContact CB-CZ 3.91Å; R155-F195 HydrophobicContact CG-CZ 4.22Å; R155-F195 WeakPolarHBondContact O-CZ 3.48Å; I158-F195 HydrophobicContact CB-CE2 4.18Å; I158-F195 HydrophobicContact CG2-CD2 4.08Å; I158-F195 HydrophobicContact CG2-CE2 3.85Å; Q159-F195 HydrophobicContact CB-CD1 3.99Å; Q159-F195 HydrophobicContact CB-CD2 4.16Å; Q159-F195 HydrophobicContact CB-CE1 3.99Å; Q159-F195 HydrophobicContact CB-CE2 4.15Å; Q159-F195 HydrophobicContact CB-CG 4.09Å; Q159-F195 HydrophobicContact CB-CZ 4.08Å; Q159-F195 HydrophobicContact CG-CD1 3.97Å; Q159-F195 HydrophobicContact CG-CE1 4.32Å; Q159-F195 HydrophobicContact CG-CG 4.22Å; V162-F195 HydrophobicContact CG1-CB 4.34Å; Y191-F195 HydrophobicContact CD1-CZ 4.43Å; Y191-F195 WeakPolarHBondContact O-CD2 3.46Å; Y191-F195 VanDerWaalsContact O-CG 3.23Å; Y191-F195 WeakPolarHBondContact O-CG 3.25Å; Y191-F195 PolarHBondContact O-N 3.33Å; V192-F195 PolarHBondContact O-N 3.39Å; V192-F195 VanDerWaalsContact O-N 3.16Å; F195-R197 VanDerWaalsContact C-N 3.33Å; F195-R197 PolarHBondContact O-N 2.95Å; F195-D198 PolarHBondContact O-N 2.73Å; F195-N199 WeakPolarHBondContact O-CB 3.43Å; F195-N199 PolarHBondContact O-N 3.26Å
196I88.9Confident86.3Confident1 Ų131.3 Ų31.31%0.00516%0.157CC..Hα-helixtrans-58.1-49.2173.5-69.3165.8000109.4V162 L166 V192 D198 N199 V200 V219 L222 M223 I226 M264V162-I196 HydrophobicContact CG1-CG1 4.31Å; L166-I196 HydrophobicContact CD1-CG1 4.3Å; V192-I196 HydrophobicContact CG1-CD1 3.66Å; V192-I196 HydrophobicContact CG1-CG1 4.11Å; V192-I196 VanDerWaalsContact O-CG1 3.25Å; V192-I196 WeakPolarHBondContact O-CG1 3.33Å; V192-I196 PolarHBondContact O-N 3.22Å; I196-D198 PolarHBondContact O-N 3.16Å; I196-N199 PolarHBondContact O-N 3.45Å; I196-V200 HydrophobicContact CG2-CG2 4.12Å; I196-V200 WeakPolarHBondContact O-CB 3.42Å; I196-V200 WeakPolarHBondContact O-CG2 3.5Å; I196-V200 PolarHBondContact O-N 3.33Å; I196-V219 HydrophobicContact CG2-CG1 4.12Å; I196-L222 HydrophobicContact CD1-CD2 3.59Å; I196-L222 HydrophobicContact CD1-CG 3.94Å; I196-L222 HydrophobicContact CG1-CD2 3.88Å; I196-M223 HydrophobicContact CG2-CG 4.3Å; I196-M223 HydrophobicContact CG2-SD 4.33Å; I196-I226 HydrophobicContact CD1-CD1 4.01Å; I196-M264 HydrophobicContact CB-CG 4.21Å; I196-M264 HydrophobicContact CB-SD 4.24Å; I196-M264 HydrophobicContact CD1-SD 3.88Å; I196-M264 HydrophobicContact CG2-CG 3.87Å; I196-M264 HydrophobicContact CG2-SD 4.16Å
197R89.8Confident86.2Confident77 Ų7732.5 Ų32.529%0.29117%0.167SC..Hα-helixtrans-55-50.3177.8179.8-160.567.9-145.2-3111.7M193 S194 F195 A201M193-R197 PolarHBondContact O-N 2.77Å; M193-R197 VanDerWaalsContact O-N 3.15Å; S194-R197 WeakPolarHBondContact O-CB 3.15Å; S194-R197 PolarHBondContact O-N 3.25Å; F195-R197 VanDerWaalsContact C-N 3.33Å; F195-R197 PolarHBondContact O-N 2.95Å; R197-A201 WeakPolarHBondContact O-CB 3.27Å; R197-A201 PolarHBondContact O-N 3.36Å
198D88.3Confident86Confident64 Ų6442.1 Ų42.134%0.34221%0.208SC..Hα-helixtrans-70.6-35.7-175.6-64.3-16.6000111.8S194 F195 I196 T202S194-D198 VanDerWaalsContact O-CG 3.3Å; S194-D198 PolarHBondContact O-N 3.42Å; S194-D198 VanDerWaalsContact O-N 3.12Å; F195-D198 PolarHBondContact O-N 2.73Å; I196-D198 PolarHBondContact O-N 3.16Å; D198-T202 WeakPolarHBondContact O-CB 3.34Å; D198-T202 PolarHBondContact O-N 2.68Å; D198-T202 PolarHBondContact O-OG1 3.34Å
199N86.9Confident85.5Confident16 Ų1643.3 Ų43.39%0.08622%0.22CC..Hα-helixtrans-66.3-49.8175.2-171.9-50000111.1H163 F195 I196 A201 T202 V203 Y215H163-N199 PolarHBondContact ND1-ND2 2.97Å; F195-N199 WeakPolarHBondContact O-CB 3.43Å; F195-N199 PolarHBondContact O-N 3.26Å; I196-N199 PolarHBondContact O-N 3.45Å; N199-A201 VanDerWaalsContact C-N 3.32Å; N199-A201 PolarHBondContact O-N 3.44Å; N199-T202 PolarHBondContact O-N 2.98Å; N199-T202 VanDerWaalsContact O-N 3.08Å; N199-V203 WeakPolarHBondContact O-CB 3.38Å; N199-V203 WeakPolarHBondContact O-CG2 3.3Å; N199-V203 PolarHBondContact O-N 2.88Å; N199-V203 WeakPolarHBondContact OD1-CG2 2.89Å; N199-Y215 PolarHBondContact OD1-OH 3.2Å
200V87.2Confident85.2Confident4 Ų445.1 Ų45.12%0.02424%0.238CC..Hα-helixtrans-58.1-45.8176.8171.20000110.4I196 T202 M204 Y215 V219 F268 Y271I196-V200 HydrophobicContact CG2-CG2 4.12Å; I196-V200 WeakPolarHBondContact O-CB 3.42Å; I196-V200 WeakPolarHBondContact O-CG2 3.5Å; I196-V200 PolarHBondContact O-N 3.33Å; V200-T202 VanDerWaalsContact C-N 3.34Å; V200-T202 PolarHBondContact O-N 3.29Å; V200-M204 HydrophobicContact CG1-CG 4.03Å; V200-M204 WeakPolarHBondContact O-CB 2.86Å; V200-M204 WeakPolarHBondContact O-CG 3.33Å; V200-M204 PolarHBondContact O-N 3.13Å; V200-Y215 WeakPolarHBondContact CA-OH 2.85Å; V200-Y215 HydrophobicContact CG2-CE1 4.48Å; V200-Y215 PolarHBondContact N-OH 3.29Å; V200-V219 HydrophobicContact CG2-CG1 3.84Å; V200-V219 HydrophobicContact CG2-CG2 4.11Å; V200-F268 HydrophobicContact CG1-CD2 4.38Å; V200-F268 HydrophobicContact CG2-CD2 4.43Å; V200-Y271 HydrophobicContact CG1-CD2 4.06Å; V200-Y271 HydrophobicContact CG1-CE2 3.84Å
201A87.5Confident84.7Confident34 Ų3446.8 Ų46.828%0.28125%0.252SS..Hα-helixtrans-59.3-44.5175.400000111.9R197 N199 N205R197-A201 WeakPolarHBondContact O-CB 3.27Å; R197-A201 PolarHBondContact O-N 3.36Å; N199-A201 VanDerWaalsContact C-N 3.32Å; N199-A201 PolarHBondContact O-N 3.44Å; A201-N205 WeakPolarHBondContact O-CB 3.25Å; A201-N205 PolarHBondContact O-N 3.15Å; A201-N205 PolarHBondContact O-ND2 3.16Å
202T86.6Confident84.5Confident70 Ų7048.3 Ų48.343%0.42926%0.26SS..Hα-helixtrans-67.5-48.7-178.4-57.80000112.4D198 N199 V200 K206D198-T202 WeakPolarHBondContact O-CB 3.34Å; D198-T202 PolarHBondContact O-N 2.68Å; D198-T202 PolarHBondContact O-OG1 3.34Å; N199-T202 PolarHBondContact O-N 2.98Å; N199-T202 VanDerWaalsContact O-N 3.08Å; V200-T202 VanDerWaalsContact C-N 3.34Å; V200-T202 PolarHBondContact O-N 3.29Å; T202-K206 HydrophobicContact CG2-CD 4.28Å; T202-K206 WeakPolarHBondContact O-CB 3.49Å; T202-K206 VanDerWaalsContact O-CG 3.24Å; T202-K206 WeakPolarHBondContact O-CG 3.43Å; T202-K206 PolarHBondContact O-N 2.9Å; T202-K206 VanDerWaalsContact O-N 3.12Å
203V83.7Confident84.1Confident8 Ų852.1 Ų52.15%0.04829%0.285CS..Hα-helixtrans-68.8-44.8-177.3173.90000110.7N199 K206 S207 L212 Y215N199-V203 WeakPolarHBondContact O-CB 3.38Å; N199-V203 WeakPolarHBondContact O-CG2 3.3Å; N199-V203 PolarHBondContact O-N 2.88Å; N199-V203 WeakPolarHBondContact OD1-CG2 2.89Å; V203-K206 PolarHBondContact O-N 3.32Å; V203-S207 PolarHBondContact O-N 3.06Å; V203-S207 PolarHBondContact O-OG 3.04Å; V203-L212 HydrophobicContact CG1-CD1 4.09Å; V203-Y215 HydrophobicContact CB-CE1 4.2Å; V203-Y215 HydrophobicContact CB-CE2 4.42Å; V203-Y215 HydrophobicContact CG1-CD1 4.21Å; V203-Y215 HydrophobicContact CG1-CD2 4.48Å; V203-Y215 HydrophobicContact CG1-CE1 3.93Å; V203-Y215 HydrophobicContact CG1-CE2 4.2Å; V203-Y215 HydrophobicContact CG1-CG 4.48Å; V203-Y215 HydrophobicContact CG2-CE2 4.2Å
204M83.8Confident84Confident3 Ų355 Ų552%0.01530%0.302CS..Hα-helixtrans-72.5-32.8-178.2-62.3-60.1-73.400112.8V200 S207 K208 G209 A210 Y215 Y271V200-M204 HydrophobicContact CG1-CG 4.03Å; V200-M204 WeakPolarHBondContact O-CB 2.86Å; V200-M204 WeakPolarHBondContact O-CG 3.33Å; V200-M204 PolarHBondContact O-N 3.13Å; M204-S207 WeakPolarHBondContact CA-OG 3.28Å; M204-S207 PolarHBondContact O-N 3.34Å; M204-S207 PolarHBondContact O-OG 3.05Å; M204-K208 PolarHBondContact O-N 3.45Å; M204-G209 PolarHBondContact O-N 3.49Å; M204-A210 WeakPolarHBondContact CE-O 3.34Å; M204-Y215 HydrophobicContact SD-CE1 4.47Å; M204-Y271 HydrophobicContact CB-CD1 3.72Å; M204-Y271 HydrophobicContact CB-CD2 4.01Å; M204-Y271 HydrophobicContact CB-CE1 3.45Å; M204-Y271 VanDerWaalsContact CB-CE1 3.45Å; M204-Y271 HydrophobicContact CB-CE2 3.75Å; M204-Y271 HydrophobicContact CB-CG 3.99Å; M204-Y271 VanDerWaalsContact CB-CZ 3.47Å; M204-Y271 HydrophobicContact CE-CD1 4.01Å; M204-Y271 HydrophobicContact CE-CD2 4.4Å; M204-Y271 HydrophobicContact CE-CG 3.73Å; M204-Y271 HydrophobicContact CG-CD1 4.26Å; M204-Y271 HydrophobicContact CG-CD2 3.88Å; M204-Y271 HydrophobicContact CG-CE1 4.36Å; M204-Y271 HydrophobicContact CG-CE2 3.97Å; M204-Y271 HydrophobicContact CG-CG 4.02Å
205N84.6Confident83.9Confident108 Ų10854.2 Ų54.258%0.57830%0.297SS*.Hα-helixtrans-66.6-40.6171.6-73.7-25000111.3A201 S207 K208A201-N205 WeakPolarHBondContact O-CB 3.25Å; A201-N205 PolarHBondContact O-N 3.15Å; A201-N205 PolarHBondContact O-ND2 3.16Å; N205-S207 VanDerWaalsContact C-N 3.34Å; N205-S207 PolarHBondContact O-N 3.4Å; N205-K208 PolarHBondContact O-N 2.81Å
206K85.9Confident83.9Confident171 Ų17153.5 Ų53.574%0.74329%0.294SS*.Hα-helixtrans-63.4-38.9175.1-75.8175-178.8-178.70112.2T202 V203 K208T202-K206 HydrophobicContact CG2-CD 4.28Å; T202-K206 WeakPolarHBondContact O-CB 3.49Å; T202-K206 VanDerWaalsContact O-CG 3.24Å; T202-K206 WeakPolarHBondContact O-CG 3.43Å; T202-K206 PolarHBondContact O-N 2.9Å; T202-K206 VanDerWaalsContact O-N 3.12Å; V203-K206 PolarHBondContact O-N 3.32Å; K206-K208 PolarHBondContact O-N 3.09Å
207S79.8Confident83.8Confident31 Ų3155.7 Ų55.722%0.21731%0.309CS..THydrogen-bonded Turntrans-82.55.5178.371.20000114.1V203 M204 N205 G209 A210V203-S207 PolarHBondContact O-N 3.06Å; V203-S207 PolarHBondContact O-OG 3.04Å; M204-S207 WeakPolarHBondContact CA-OG 3.28Å; M204-S207 PolarHBondContact O-N 3.34Å; M204-S207 PolarHBondContact O-OG 3.05Å; N205-S207 VanDerWaalsContact C-N 3.34Å; N205-S207 PolarHBondContact O-N 3.4Å; S207-G209 PolarHBondContact O-N 2.96Å; S207-A210 VanDerWaalsContact O-CB 3.29Å; S207-A210 WeakPolarHBondContact O-CB 3.42Å; S207-A210 PolarHBondContact O-N 3.47Å; S207-A210 VanDerWaalsContact O-N 3.08Å
208K78.3Confident83.8Confident202 Ų20252 Ų5288%0.87830%0.295SS*.THydrogen-bonded Turntrans53.232.3-174.7-60179.9179178.30113.3M204 N205 K206 A210M204-K208 PolarHBondContact O-N 3.45Å; N205-K208 PolarHBondContact O-N 2.81Å; K206-K208 PolarHBondContact O-N 3.09Å; K208-A210 VanDerWaalsContact C-N 3.31Å; K208-A210 PolarHBondContact O-N 3.27Å
209G74Confident83.9Confident24 Ų2449 Ų4925%0.24728%0.279CS..THydrogen-bonded Turntrans72.919.6-179.500000114.5M204 S207M204-G209 PolarHBondContact O-N 3.49Å; S207-G209 PolarHBondContact O-N 2.96Å
210A78.2Confident84Confident50 Ų5048.7 Ų48.741%0.41328%0.277SS..  trans-63148172.400000111.3M204 S207 K208 L212M204-A210 WeakPolarHBondContact CE-O 3.34Å; S207-A210 VanDerWaalsContact O-CB 3.29Å; S207-A210 WeakPolarHBondContact O-CB 3.42Å; S207-A210 PolarHBondContact O-N 3.47Å; S207-A210 VanDerWaalsContact O-N 3.08Å; K208-A210 VanDerWaalsContact C-N 3.31Å; K208-A210 PolarHBondContact O-N 3.27Å; A210-L212 PolarHBondContact O-N 3.02Å
211V76.9Confident84Confident72 Ų7250.1 Ų50.144%0.43629%0.286SS..  trans-72119.9176.2-176.50000108.2P213 K272 P274V211-P213 HydrophobicContact CG1-CG 4.22Å; V211-P213 WeakPolarHBondContact O-CD 3.44Å; V211-K272 HydrophobicContact CG2-CB 4.25Å; V211-P274 HydrophobicContact CG1-CG 3.95Å
212L82.3Confident84Confident45 Ų4548.5 Ų48.524%0.23627%0.273CS..  trans-116.687.2176.5-69.3171000108V203 A210 V214 Y215 Q216V203-L212 HydrophobicContact CG1-CD1 4.09Å; A210-L212 PolarHBondContact O-N 3.02Å; L212-V214 PolarHBondContact O-N 3.15Å; L212-Y215 PolarHBondContact O-N 2.89Å; L212-Q216 VanDerWaalsContact O-CB 3.32Å; L212-Q216 WeakPolarHBondContact O-CB 3.48Å; L212-Q216 VanDerWaalsContact O-CG 3.28Å; L212-Q216 WeakPolarHBondContact O-CG 3.32Å; L212-Q216 PolarHBondContact O-N 3.49Å
213P81.1Confident84Confident81 Ų8145.3 Ų45.353%0.52625%0.253SS..Hα-helixtrans-59.1-42.3-167.3-26.234.5000114V211 S217V211-P213 HydrophobicContact CG1-CG 4.22Å; V211-P213 WeakPolarHBondContact O-CD 3.44Å; P213-S217 WeakPolarHBondContact O-CB 3.11Å; P213-S217 PolarHBondContact O-N 3.19Å
214V84.3Confident84.1Confident59 Ų5948 Ų4836%0.35827%0.266SS..Hα-helixtrans-67.6-51-178.5-179.30000110.7L212 Q216 S217 N218L212-V214 PolarHBondContact O-N 3.15Å; V214-Q216 PolarHBondContact O-N 3.49Å; V214-S217 WeakPolarHBondContact O-CB 3.5Å; V214-S217 PolarHBondContact O-N 3.3Å; V214-N218 PolarHBondContact O-N 3.48Å
215Y87.1Confident84.2Confident2 Ų249.4 Ų49.41%0.00827%0.274CS..Hα-helixtrans-57.7-50.3175.9176.4-102.3000112L166 Q168 N199 V200 V203 M204 L212 S217 N218 V219L166-Y215 HydrophobicContact CB-CE2 3.97Å; L166-Y215 VanDerWaalsContact O-CD2 3.29Å; L166-Y215 WeakPolarHBondContact O-CD2 3.48Å; L166-Y215 VanDerWaalsContact O-CE2 3.31Å; L166-Y215 WeakPolarHBondContact O-CE2 3.05Å; Q168-Y215 HydrophobicContact CG-CD2 4.13Å; Q168-Y215 HydrophobicContact CG-CG 4.46Å; N199-Y215 PolarHBondContact OD1-OH 3.2Å; V200-Y215 WeakPolarHBondContact CA-OH 2.85Å; V200-Y215 HydrophobicContact CG2-CE1 4.48Å; V200-Y215 PolarHBondContact N-OH 3.29Å; V203-Y215 HydrophobicContact CB-CE1 4.2Å; V203-Y215 HydrophobicContact CB-CE2 4.42Å; V203-Y215 HydrophobicContact CG1-CD1 4.21Å; V203-Y215 HydrophobicContact CG1-CD2 4.48Å; V203-Y215 HydrophobicContact CG1-CE1 3.93Å; V203-Y215 HydrophobicContact CG1-CE2 4.2Å; V203-Y215 HydrophobicContact CG1-CG 4.48Å; V203-Y215 HydrophobicContact CG2-CE2 4.2Å; M204-Y215 HydrophobicContact SD-CE1 4.47Å; L212-Y215 PolarHBondContact O-N 2.89Å; Y215-S217 VanDerWaalsContact C-N 3.25Å; Y215-S217 PolarHBondContact O-N 3.3Å; Y215-N218 PolarHBondContact O-N 3.31Å; Y215-V219 HydrophobicContact CD1-CG2 4.2Å; Y215-V219 HydrophobicContact CD2-CG2 4.39Å; Y215-V219 HydrophobicContact CE1-CG2 3.77Å; Y215-V219 HydrophobicContact CE2-CG2 4Å; Y215-V219 HydrophobicContact CG-CG2 4.49Å; Y215-V219 WeakPolarHBondContact O-CG2 3.15Å; Y215-V219 PolarHBondContact O-N 3.17Å
216Q86.5Confident84.1Confident2 Ų244.7 Ų44.71%0.00925%0.249CC..Hα-helixtrans-62.7-34.9179.4-70.5175-43.600111.3L212 V214 F220 F268 K272 M277L212-Q216 VanDerWaalsContact O-CB 3.32Å; L212-Q216 WeakPolarHBondContact O-CB 3.48Å; L212-Q216 VanDerWaalsContact O-CG 3.28Å; L212-Q216 WeakPolarHBondContact O-CG 3.32Å; L212-Q216 PolarHBondContact O-N 3.49Å; V214-Q216 PolarHBondContact O-N 3.49Å; Q216-F220 WeakPolarHBondContact O-CB 3.45Å; Q216-F220 PolarHBondContact O-N 3.37Å; Q216-F268 HydrophobicContact CB-CE2 4.48Å; Q216-F268 HydrophobicContact CB-CZ 4.46Å; Q216-K272 PolarHBondContact NE2-O 2.69Å; Q216-M277 VanDerWaalsContact C-CE 3.45Å; Q216-M277 HydrophobicContact CB-CE 3.95Å; Q216-M277 HydrophobicContact CB-SD 4.35Å; Q216-M277 VanDerWaalsContact O-CE 3.31Å; Q216-M277 WeakPolarHBondContact O-CE 3.25Å
217S87.9Confident83.6Confident46 Ų4641.5 Ų41.532%0.32224%0.24SC..Hα-helixtrans-65.7-46.1174.9-1710000111.5P213 V214 Y215 F220 T221P213-S217 WeakPolarHBondContact O-CB 3.11Å; P213-S217 PolarHBondContact O-N 3.19Å; V214-S217 WeakPolarHBondContact O-CB 3.5Å; V214-S217 PolarHBondContact O-N 3.3Å; Y215-S217 VanDerWaalsContact C-N 3.25Å; Y215-S217 PolarHBondContact O-N 3.3Å; S217-F220 PolarHBondContact O-N 3.06Å; S217-T221 WeakPolarHBondContact O-CB 3.45Å; S217-T221 PolarHBondContact O-N 2.96Å; S217-T221 PolarHBondContact O-OG1 3.35Å
218N89.4Confident83.4Confident1 Ų140.9 Ų40.91%0.00523%0.234CC..Hα-helixtrans-60.2-46.8175.6-70.9-23.7000111.5L166 S167 L170 N172 I176 V214 Y215 F220 T221 L222L166-N218 HydrophobicContact CD2-CB 4.37Å; S167-N218 PolarHBondContact O-ND2 3Å; S167-N218 VanDerWaalsContact O-ND2 3.17Å; L170-N218 PolarHBondContact O-ND2 2.87Å; N172-N218 PolarHBondContact N-OD1 3.01Å; N172-N218 VanDerWaalsContact N-OD1 3.11Å; I176-N218 HydrophobicContact CD1-CB 4.19Å; I176-N218 WeakPolarHBondContact CD1-O 3.27Å; V214-N218 PolarHBondContact O-N 3.48Å; Y215-N218 PolarHBondContact O-N 3.31Å; N218-F220 PolarHBondContact O-N 3.25Å; N218-T221 PolarHBondContact O-N 3.21Å; N218-L222 WeakPolarHBondContact O-CB 3.45Å; N218-L222 PolarHBondContact O-N 3.29Å
219V89.1Confident83Confident0 Ų031.6 Ų31.60%019%0.194CC..Hα-helixtrans-59.8-46.7176.2173.30000110.7L166 I196 V200 Y215 L222 M223 F268L166-V219 HydrophobicContact CD1-CG2 4.18Å; L166-V219 HydrophobicContact CD2-CB 4.35Å; L166-V219 HydrophobicContact CD2-CG2 3.73Å; L166-V219 HydrophobicContact CG-CG2 4.41Å; I196-V219 HydrophobicContact CG2-CG1 4.12Å; V200-V219 HydrophobicContact CG2-CG1 3.84Å; V200-V219 HydrophobicContact CG2-CG2 4.11Å; Y215-V219 HydrophobicContact CD1-CG2 4.2Å; Y215-V219 HydrophobicContact CD2-CG2 4.39Å; Y215-V219 HydrophobicContact CE1-CG2 3.77Å; Y215-V219 HydrophobicContact CE2-CG2 4Å; Y215-V219 HydrophobicContact CG-CG2 4.49Å; Y215-V219 WeakPolarHBondContact O-CG2 3.15Å; Y215-V219 PolarHBondContact O-N 3.17Å; V219-L222 PolarHBondContact O-N 3.14Å; V219-M223 HydrophobicContact CG1-CG 4.28Å; V219-M223 HydrophobicContact CG1-SD 3.63Å; V219-M223 WeakPolarHBondContact O-CB 3.43Å; V219-M223 VanDerWaalsContact O-CG 3.27Å; V219-M223 WeakPolarHBondContact O-CG 3.43Å; V219-M223 PolarHBondContact O-N 3.05Å; V219-F268 HydrophobicContact CB-CD2 4.49Å; V219-F268 HydrophobicContact CB-CE2 3.96Å; V219-F268 HydrophobicContact CG1-CD2 3.59Å; V219-F268 HydrophobicContact CG1-CE2 3.52Å; V219-F268 HydrophobicContact CG1-CG 4.48Å; V219-F268 HydrophobicContact CG1-CZ 4.35Å
220F89.3Confident82.6Confident9 Ų934.3 Ų34.34%0.03921%0.209CC..Hα-helixtrans-63.3-44.4-179.4179.7-117.1000112.4Q216 S217 N218 L222 M223 L224 W265 F268 M277 K280 I281Q216-F220 WeakPolarHBondContact O-CB 3.45Å; Q216-F220 PolarHBondContact O-N 3.37Å; S217-F220 PolarHBondContact O-N 3.06Å; N218-F220 PolarHBondContact O-N 3.25Å; F220-L222 VanDerWaalsContact C-N 3.34Å; F220-L222 PolarHBondContact O-N 3.06Å; F220-M223 PolarHBondContact O-N 2.65Å; F220-L224 HydrophobicContact CD1-CD1 4.07Å; F220-L224 HydrophobicContact CD2-CG 4.31Å; F220-L224 HydrophobicContact CE1-CD1 3.47Å; F220-L224 VanDerWaalsContact CE1-CD1 3.47Å; F220-L224 HydrophobicContact CE1-CG 4.26Å; F220-L224 HydrophobicContact CE2-CD1 3.93Å; F220-L224 HydrophobicContact CE2-CD2 4.05Å; F220-L224 HydrophobicContact CE2-CG 3.85Å; F220-L224 HydrophobicContact CZ-CD1 3.4Å; F220-L224 VanDerWaalsContact CZ-CD1 3.4Å; F220-L224 HydrophobicContact CZ-CD2 4.13Å; F220-L224 HydrophobicContact CZ-CG 3.86Å; F220-L224 WeakPolarHBondContact O-CG 3.28Å; F220-L224 PolarHBondContact O-N 3.27Å; F220-W265 HydrophobicContact CD2-CH2 4.33Å; F220-W265 HydrophobicContact CD2-CZ3 4.49Å; F220-W265 HydrophobicContact CE2-CH2 4.12Å; F220-W265 HydrophobicContact CE2-CZ3 4.4Å; F220-F268 HydrophobicContact CB-CZ 4.2Å; F220-F268 HydrophobicContact CD2-CE1 4.39Å; F220-M277 HydrophobicContact CB-CE 3.81Å; F220-M277 HydrophobicContact CB-CG 4.37Å; F220-M277 HydrophobicContact CB-SD 3.89Å; F220-M277 HydrophobicContact CD1-CE 4.37Å; F220-M277 HydrophobicContact CD1-CG 3.95Å; F220-M277 HydrophobicContact CD2-CG 4.16Å; F220-M277 HydrophobicContact CD2-SD 4.49Å; F220-M277 HydrophobicContact CE1-CG 4.24Å; F220-M277 HydrophobicContact CE2-CG 4.48Å; F220-M277 HydrophobicContact CG-CE 4.24Å; F220-M277 HydrophobicContact CG-CG 3.88Å; F220-M277 HydrophobicContact CG-SD 4.06Å; F220-M277 HydrophobicContact CZ-CG 4.49Å; F220-K280 HydrophobicContact CE1-CB 4.01Å; F220-K280 HydrophobicContact CE1-CD 4.05Å; F220-K280 HydrophobicContact CZ-CB 3.88Å; F220-I281 HydrophobicContact CD2-CD1 4.3Å; F220-I281 HydrophobicContact CD2-CG1 4Å; F220-I281 HydrophobicContact CE2-CD1 4.07Å; F220-I281 HydrophobicContact CE2-CG1 3.29Å; F220-I281 HydrophobicContact CZ-CG1 3.85Å
221T87.4Confident81.9Confident35 Ų3537.7 Ų37.722%0.21522%0.217CC..Hα-helixtrans-61.1-43.7175.4-57.60000111.2I176 S217 N218 M223 L224 N225I176-T221 HydrophobicContact CB-CG2 4.47Å; I176-T221 HydrophobicContact CD1-CG2 4.46Å; I176-T221 HydrophobicContact CG2-CG2 3.95Å; S217-T221 WeakPolarHBondContact O-CB 3.45Å; S217-T221 PolarHBondContact O-N 2.96Å; S217-T221 PolarHBondContact O-OG1 3.35Å; N218-T221 PolarHBondContact O-N 3.21Å; T221-M223 PolarHBondContact O-N 3.05Å; T221-L224 PolarHBondContact O-N 3.37Å; T221-N225 PolarHBondContact O-N 3.41Å
222L87.9Confident81.1Confident0 Ų040.7 Ų40.70%023%0.226CC..Hα-helixtrans-63.4-42.2177-175.965.1000111.7L166 I176 F179 L183 V192 I196 N218 V219 F220 N225 I226L166-L222 HydrophobicContact CD1-CD2 4.42Å; L166-L222 HydrophobicContact CD2-CB 4.43Å; L166-L222 HydrophobicContact CD2-CD2 3.8Å; L166-L222 HydrophobicContact CG-CD2 4.25Å; I176-L222 HydrophobicContact CD1-CB 4.47Å; I176-L222 HydrophobicContact CG2-CB 4.1Å; I176-L222 HydrophobicContact CG2-CD1 3.89Å; F179-L222 HydrophobicContact CD1-CD1 3.89Å; F179-L222 HydrophobicContact CE1-CD1 4.34Å; L183-L222 HydrophobicContact CD1-CD1 3.95Å; V192-L222 HydrophobicContact CG1-CD2 4.48Å; I196-L222 HydrophobicContact CD1-CD2 3.59Å; I196-L222 HydrophobicContact CD1-CG 3.94Å; I196-L222 HydrophobicContact CG1-CD2 3.88Å; N218-L222 WeakPolarHBondContact O-CB 3.45Å; N218-L222 PolarHBondContact O-N 3.29Å; V219-L222 PolarHBondContact O-N 3.14Å; F220-L222 VanDerWaalsContact C-N 3.34Å; F220-L222 PolarHBondContact O-N 3.06Å; L222-N225 PolarHBondContact O-N 3.02Å; L222-I226 WeakPolarHBondContact O-CG1 3.44Å
223M87.4Confident80Confident2 Ų243.5 Ų43.51%0.0125%0.245CC..Hα-helixtrans-66.1-35.8178.2-72.9174.266.500113.1I196 V219 F220 T221 N225 I226 M264 W265 F268I196-M223 HydrophobicContact CG2-CG 4.3Å; I196-M223 HydrophobicContact CG2-SD 4.33Å; V219-M223 HydrophobicContact CG1-CG 4.28Å; V219-M223 HydrophobicContact CG1-SD 3.63Å; V219-M223 WeakPolarHBondContact O-CB 3.43Å; V219-M223 VanDerWaalsContact O-CG 3.27Å; V219-M223 WeakPolarHBondContact O-CG 3.43Å; V219-M223 PolarHBondContact O-N 3.05Å; F220-M223 PolarHBondContact O-N 2.65Å; T221-M223 PolarHBondContact O-N 3.05Å; M223-N225 VanDerWaalsContact C-N 3.34Å; M223-I226 PolarHBondContact O-N 3.34Å; M223-M264 HydrophobicContact CB-CE 4.38Å; M223-M264 HydrophobicContact CE-CE 3.87Å; M223-M264 HydrophobicContact CE-CG 4.02Å; M223-M264 HydrophobicContact CE-SD 4.37Å; M223-M264 HydrophobicContact CG-CE 3.99Å; M223-M264 HydrophobicContact CG-CG 4.45Å; M223-M264 HydrophobicContact CG-SD 3.91Å; M223-M264 HydrophobicContact SD-CG 4.38Å; M223-W265 HydrophobicContact CB-CH2 4.19Å; M223-W265 HydrophobicContact CB-CZ2 3.99Å; M223-W265 HydrophobicContact CE-CB 4.35Å; M223-W265 HydrophobicContact CE-CD2 3.26Å; M223-W265 HydrophobicContact CE-CE3 3.35Å; M223-W265 HydrophobicContact CE-CG 3.74Å; M223-W265 HydrophobicContact CE-CH2 4.03Å; M223-W265 HydrophobicContact CE-CZ2 3.97Å; M223-W265 HydrophobicContact CE-CZ3 3.74Å; M223-F268 HydrophobicContact CE-CB 3.93Å; M223-F268 HydrophobicContact CE-CD1 4.27Å; M223-F268 HydrophobicContact CE-CG 4.22Å; M223-F268 HydrophobicContact SD-CB 4Å; M223-F268 HydrophobicContact SD-CD1 4.14Å; M223-F268 HydrophobicContact SD-CD2 4.21Å; M223-F268 HydrophobicContact SD-CG 3.86Å
224L85.9Confident79.2Confident64 Ų6444 Ų4434%0.33524%0.241SC..Hα-helixtrans-70.3-29.5176.5-76.1-179000113.2F220 T221 I226 W265 V284F220-L224 HydrophobicContact CD1-CD1 4.07Å; F220-L224 HydrophobicContact CD2-CG 4.31Å; F220-L224 HydrophobicContact CE1-CD1 3.47Å; F220-L224 VanDerWaalsContact CE1-CD1 3.47Å; F220-L224 HydrophobicContact CE1-CG 4.26Å; F220-L224 HydrophobicContact CE2-CD1 3.93Å; F220-L224 HydrophobicContact CE2-CD2 4.05Å; F220-L224 HydrophobicContact CE2-CG 3.85Å; F220-L224 HydrophobicContact CZ-CD1 3.4Å; F220-L224 VanDerWaalsContact CZ-CD1 3.4Å; F220-L224 HydrophobicContact CZ-CD2 4.13Å; F220-L224 HydrophobicContact CZ-CG 3.86Å; F220-L224 WeakPolarHBondContact O-CG 3.28Å; F220-L224 PolarHBondContact O-N 3.27Å; T221-L224 PolarHBondContact O-N 3.37Å; L224-I226 PolarHBondContact O-N 3.42Å; L224-W265 HydrophobicContact CD2-CH2 4.36Å; L224-V284 HydrophobicContact CD2-CG1 4.15Å
225N84.2Confident78.3Confident33 Ų3342.3 Ų42.318%0.17623%0.229CC..THydrogen-bonded Turntrans-77.3-6.6178.2-73.11.3000113.2Q180 L183 T221 L222 M223 N227Q180-N225 HydrophobicContact CG-CB 4.22Å; L183-N225 HydrophobicContact CD1-CB 4.35Å; T221-N225 PolarHBondContact O-N 3.41Å; L222-N225 PolarHBondContact O-N 3.02Å; M223-N225 VanDerWaalsContact C-N 3.34Å; N225-N227 PolarHBondContact O-N 3.38Å
226I83.5Confident77.2Confident9 Ų947.1 Ų47.15%0.04626%0.259CS..  trans-79.2102.7176.8-66.9171.2000108.9L183 R189 M193 I196 L222 M223 L224 M228 F261 M264L183-I226 HydrophobicContact CD1-CG1 4.15Å; R189-I226 HydrophobicContact CG-CG2 3.96Å; M193-I226 HydrophobicContact CE-CG2 3.32Å; M193-I226 HydrophobicContact CG-CD1 4.12Å; I196-I226 HydrophobicContact CD1-CD1 4.01Å; L222-I226 WeakPolarHBondContact O-CG1 3.44Å; M223-I226 PolarHBondContact O-N 3.34Å; L224-I226 PolarHBondContact O-N 3.42Å; I226-M228 HydrophobicContact CG2-SD 4.38Å; I226-F261 HydrophobicContact CG2-CD2 4.38Å; I226-F261 HydrophobicContact CG2-CE2 4.42Å; I226-M264 HydrophobicContact CD1-CE 4Å; I226-M264 HydrophobicContact CD1-SD 3.87Å
227N75.9Confident76.8Confident105 Ų10550.6 Ų50.656%0.56128%0.278SS*.PPolyproline II helixtrans-84120.2172.3-67.4-21.7000109.9R189 N225R189-N227 WeakPolarHBondContact CD-O 3.22Å; R189-N227 PolarHBondContact NH1-O 3.45Å; N225-N227 PolarHBondContact O-N 3.38Å
228M74.3Confident76.3Confident17 Ų1749.7 Ų49.78%0.08427%0.268CS..PPolyproline II helixtrans-89.5136.4177.2-72.4-65.6-68.800110.3M193 I226 H257 K258 F261 H292M193-M228 HydrophobicContact CE-CE 4.46Å; M193-M228 HydrophobicContact CE-SD 3.25Å; M193-M228 WeakPolarHBondContact CE-SD 3.43Å; M193-M228 HydrophobicContact SD-SD 4.46Å; I226-M228 HydrophobicContact CG2-SD 4.38Å; M228-H257 HydrophobicContact CE-CB 3.94Å; M228-K258 HydrophobicContact CE-CG 4.2Å; M228-F261 HydrophobicContact CE-CB 4.02Å; M228-F261 HydrophobicContact CE-CG 4.34Å; M228-F261 HydrophobicContact CG-CD2 3.69Å; M228-F261 HydrophobicContact CG-CE2 3.74Å; M228-F261 HydrophobicContact CG-CG 4.1Å; M228-F261 HydrophobicContact CG-CZ 4.22Å; M228-F261 HydrophobicContact SD-CB 4.14Å; M228-F261 HydrophobicContact SD-CD2 3.84Å; M228-F261 HydrophobicContact SD-CE2 4.46Å; M228-F261 HydrophobicContact SD-CG 4.13Å; M228-H292 HydrophobicContact CB-CB 3.82Å; M228-H292 VanDerWaalsContact CB-CG 3.47Å; M228-H292 HydrophobicContact CG-CB 3.91Å
229P70.8Confident75.3Confident7 Ų751 Ų515%0.04527%0.274CS..PPolyproline II helixtrans-70.3143.2175.37.27.6000109.7E234 L235 L254P229-E234 WeakPolarHBondContact CA-OE2 3.32Å; P229-E234 HydrophobicContact CB-CB 3.84Å; P229-E234 WeakPolarHBondContact CB-OE2 3.44Å; P229-L235 HydrophobicContact CG-CD2 3.82Å; P229-L235 HydrophobicContact CG-CG 4.4Å; P229-L254 HydrophobicContact CB-CD1 4.05Å; P229-L254 HydrophobicContact CG-CD1 3.8Å
230S64.8Low74.3Confident82 Ų8251.8 Ų51.857%0.57328%0.279SS*.SBendtrans-84.4-28176-65.10000111.3E234S230-E234 PolarHBondContact N-OE2 2.93Å
231Q63.8Low73.1Confident121 Ų12159.4 Ų59.457%0.56531%0.312SS*.SBendtrans-127.8150.3-178.1-59.8-174.71.200112T233 E234Q231-T233 WeakPolarHBondContact CB-OG1 3.37Å; Q231-T233 PolarHBondContact O-N 2.97Å; Q231-T233 PolarHBondContact OE1-OG1 2.89Å; Q231-E234 HydrophobicContact CB-CG 4.43Å; Q231-E234 PolarHBondContact N-OE2 3.46Å; Q231-E234 WeakPolarHBondContact O-CB 3.36Å; Q231-E234 PolarHBondContact O-N 2.86Å
232E60.9Low71.7Confident134 Ų13461.6 Ų61.663%0.62632%0.32SS*.G310 helixtrans-65.1-25.1177.5-56.7-163.9146.400112.7E234 L235 L254E232-E234 PolarHBondContact O-N 3.28Å; E232-L235 WeakPolarHBondContact O-CB 3.28Å; E232-L235 PolarHBondContact O-N 3.36Å; E232-L254 HydrophobicContact CG-CB 3.74Å; E232-L254 HydrophobicContact CG-CD2 3.82Å; E232-L254 HydrophobicContact CG-CG 4.34Å
233T59.1Low69.9Low104 Ų10470.9 Ų70.964%0.63836%0.363SS*.G310 helixtrans-66-16.7176.945.50000113.8Q231 T236Q231-T233 WeakPolarHBondContact CB-OG1 3.37Å; Q231-T233 PolarHBondContact O-N 2.97Å; Q231-T233 PolarHBondContact OE1-OG1 2.89Å; T233-T236 WeakPolarHBondContact O-CG2 3.48Å
234E63.6Low67.9Low93 Ų9375.1 Ų75.144%0.43539%0.39SS..G310 helixtrans-82-16178.2-65.9169.7177.300112.2P229 S230 Q231 E232 T236P229-E234 WeakPolarHBondContact CA-OE2 3.32Å; P229-E234 HydrophobicContact CB-CB 3.84Å; P229-E234 WeakPolarHBondContact CB-OE2 3.44Å; S230-E234 PolarHBondContact N-OE2 2.93Å; Q231-E234 HydrophobicContact CB-CG 4.43Å; Q231-E234 PolarHBondContact N-OE2 3.46Å; Q231-E234 WeakPolarHBondContact O-CB 3.36Å; Q231-E234 PolarHBondContact O-N 2.86Å; E232-E234 PolarHBondContact O-N 3.28Å; E234-T236 VanDerWaalsContact C-N 3.28Å; E234-T236 PolarHBondContact O-N 3.37Å; E234-T236 PolarHBondContact O-OG1 3.28Å
235L65.3Low66.2Low22 Ų2280 Ų8012%0.11541%0.408CS..  trans-75.576.9179.2-64.6168.9000110.8D186 P229 E232 F238 A252 L254D186-L235 HydrophobicContact CB-CD2 4Å; D186-L235 WeakPolarHBondContact OD1-CD2 3.29Å; D186-L235 VanDerWaalsContact OD2-CA 3.26Å; D186-L235 WeakPolarHBondContact OD2-CA 3.44Å; P229-L235 HydrophobicContact CG-CD2 3.82Å; P229-L235 HydrophobicContact CG-CG 4.4Å; E232-L235 WeakPolarHBondContact O-CB 3.28Å; E232-L235 PolarHBondContact O-N 3.36Å; L235-F238 HydrophobicContact CB-CZ 4.28Å; L235-F238 WeakPolarHBondContact O-CE2 3.36Å; L235-A252 WeakPolarHBondContact CD1-O 3.35Å; L235-L254 HydrophobicContact CD1-CB 4.06Å; L235-L254 HydrophobicContact CD1-CD1 4.3Å
236T64.5Low64.8Low104 Ų10483.9 Ų83.964%0.63843%0.425SS*.  trans-123.7-18.2-17455.10000113D186 T233 E234D186-T236 PolarHBondContact OD2-N 2.9Å; T233-T236 WeakPolarHBondContact O-CG2 3.48Å; E234-T236 VanDerWaalsContact C-N 3.28Å; E234-T236 PolarHBondContact O-N 3.37Å; E234-T236 PolarHBondContact O-OG1 3.28Å
237N77.1Confident63.3Low75 Ų7591 Ų9140%0.40146%0.458SS..  trans-106.886.9-170.3-166.919000110.5M185 D186M185-N237 CarbonylContact C-O 3.54Å; M185-N237 VanDerWaalsContact CA-O 3.27Å; M185-N237 WeakPolarHBondContact CA-O 3.35Å; D186-N237 PolarHBondContact N-O 3.44Å; D186-N237 PolarHBondContact OD2-N 2.98Å
238F77.5Confident62.5Low27 Ų2792.5 Ų92.512%0.11847%0.466CS..  trans-102135.5175.8-61.4-80.3000110.9D186 D187 L235 V240 W249 A252D186-F238 HydrophobicContact CB-CD1 3.91Å; D186-F238 HydrophobicContact CB-CE1 3.65Å; D186-F238 HydrophobicContact CB-CZ 4.25Å; D187-F238 HydrophobicContact CB-CD1 4.26Å; L235-F238 HydrophobicContact CB-CZ 4.28Å; L235-F238 WeakPolarHBondContact O-CE2 3.36Å; F238-V240 VanDerWaalsContact C-N 3.32Å; F238-W249 HydrophobicContact CB-CH2 3.96Å; F238-W249 AromaticContact CD1-CH2 3.22Å; F238-W249 HydrophobicContact CD1-CH2 3.22Å; F238-W249 AromaticContact CD1-CZ2 3.65Å; F238-W249 HydrophobicContact CD1-CZ2 3.65Å; F238-W249 AromaticContact CD1-CZ3 3.99Å; F238-W249 HydrophobicContact CD1-CZ3 3.99Å; F238-W249 HydrophobicContact CD2-CH2 4.21Å; F238-W249 HydrophobicContact CD2-CZ3 4.41Å; F238-W249 AromaticContact CE1-CH2 3.67Å; F238-W249 HydrophobicContact CE1-CH2 3.67Å; F238-W249 HydrophobicContact CE1-CZ2 4.02Å; F238-W249 HydrophobicContact CE1-CZ3 4.05Å; F238-W249 HydrophobicContact CE2-CZ3 4.48Å; F238-W249 AromaticContact CG-CH2 3.53Å; F238-W249 HydrophobicContact CG-CH2 3.53Å; F238-W249 HydrophobicContact CG-CZ2 4.35Å; F238-W249 HydrophobicContact CG-CZ3 4.16Å; F238-W249 HydrophobicContact CZ-CH2 4.33Å; F238-W249 HydrophobicContact CZ-CZ3 4.31Å; F238-A252 HydrophobicContact CE1-CB 4.47Å; F238-A252 HydrophobicContact CZ-CB 4.22Å
239M68.7Low62.2Low28 Ų2892.5 Ų92.514%0.13847%0.465CS..SBendtrans-63.2-41.8172.2-168.6-169.5-14800110.8M131 A134 A135 M185 D187 I188M131-M239 HydrophobicContact CE-CE 4.13Å; M131-M239 WeakPolarHBondContact O-CE 3.45Å; A134-M239 HydrophobicContact CB-CE 3.85Å; A135-M239 HydrophobicContact CB-CE 3.61Å; A135-M239 HydrophobicContact CB-CG 4.35Å; M185-M239 HydrophobicContact SD-CB 3.55Å; M185-M239 VanDerWaalsContact SD-CB 3.55Å; M185-M239 HydrophobicContact SD-CG 3.81Å; D187-M239 WeakPolarHBondContact OD1-CB 3.03Å; D187-M239 PolarHBondContact OD1-N 3.35Å; D187-M239 VanDerWaalsContact OD2-CB 3.23Å; D187-M239 WeakPolarHBondContact OD2-CB 3.42Å; D187-M239 PolarHBondContact OD2-N 3.13Å; I188-M239 HydrophobicContact CD1-CB 4.24Å; I188-M239 HydrophobicContact CD1-CE 3.8Å; I188-M239 HydrophobicContact CD1-CG 4.22Å; I188-M239 HydrophobicContact CD1-SD 3.51Å; I188-M239 VanDerWaalsContact CD1-SD 3.51Å; I188-M239 HydrophobicContact CG1-CB 4.22Å; I188-M239 HydrophobicContact CG1-SD 3.87Å
240V68.3Low62.2Low16 Ų1698.1 Ų98.110%0.09749%0.489CS..SBendtrans-111.3106.2176.3-173.60000109F153 D187 F238F153-V240 HydrophobicContact CD2-CG2 4.41Å; D187-V240 PolarHBondContact OD2-N 3.23Å; F238-V240 VanDerWaalsContact C-N 3.32Å
241K64.2Low62.5Low169 Ų16994.2 Ų94.274%0.73546%0.461SS*.  trans-82127.3176.6-62.2-173.7179.6-176.70109.8
242Q58.1Low62.9Low81 Ų8189.4 Ų89.438%0.37944%0.443SS..  trans-117.6143.8178.1-167.2174.5-4.900111.3T244Q242-T244 PolarHBondContact NE2-O 3.31Å
243E50.5Low63.7Low196 Ų19687.3 Ų87.392%0.91643%0.432SS*.SBendtrans-95.4-8.8-179-64.4-178.7163.900113.5
244T44.4Very low64.8Low91 Ų9183 Ų8356%0.55840%0.404SS*.SBendtrans-132.3119.1-168.7460000113.5Q242Q242-T244 PolarHBondContact NE2-O 3.31Å
245K51.4Low65.8Low165 Ų16584 Ų8472%0.71741%0.409SS*.  trans58.283.8169.7-60.6-173.7-178.2178.80117E247K245-E247 PolarHBondContact O-N 2.94Å; K245-E247 VanDerWaalsContact O-N 3.17Å
246H53.8Low66.7Low115 Ų11584.2 Ų84.253%0.53241%0.41SS..THydrogen-bonded Turntrans-61.2-15.2167.7-70.5-81.7000114.6D248 W249H246-D248 PolarHBondContact O-N 3.14Å; H246-W249 PolarHBondContact O-N 3.15Å
247E51.6Low67.7Low158 Ų15879.2 Ų79.274%0.73838%0.38SS*.THydrogen-bonded Turntrans-71-30.3-171.4-70.6-169.7156.300114.4K245 K253K245-E247 PolarHBondContact O-N 2.94Å; K245-E247 VanDerWaalsContact O-N 3.17Å; E247-K253 WeakPolarHBondContact O-CE 3.12Å; E247-K253 PolarHBondContact O-NZ 3.01Å
248D59.5Low68.2Low138 Ų13878.2 Ų78.274%0.73837%0.371SS*.SBendtrans-97.6-6.3178.2-69.6-39.4000113.1H246 K250H246-D248 PolarHBondContact O-N 3.14Å; D248-K250 PolarHBondContact O-N 2.88Å
249W68.4Low68.8Low16 Ų1682 Ų826%0.06139%0.385CS..  trans-81.493.8-176.4-168.920.1000111.4F151 D187 F238 H246 A251 A252F151-W249 AromaticContact CD2-NE1 3.61Å; F151-W249 AromaticContact CE2-CD1 3.97Å; F151-W249 HydrophobicContact CE2-CD2 4.46Å; F151-W249 AromaticContact CE2-CE2 3.47Å; F151-W249 VanDerWaalsContact CE2-CE2 3.47Å; F151-W249 AromaticContact CE2-CZ2 3.63Å; F151-W249 HydrophobicContact CE2-CZ2 3.63Å; F151-W249 AromaticContact CE2-NE1 3.1Å; F151-W249 HydrophobicContact CZ-CZ2 4.15Å; F151-W249 AromaticContact CZ-NE1 3.53Å; D187-W249 HydrophobicContact CB-CZ2 4.24Å; F238-W249 HydrophobicContact CB-CH2 3.96Å; F238-W249 AromaticContact CD1-CH2 3.22Å; F238-W249 HydrophobicContact CD1-CH2 3.22Å; F238-W249 AromaticContact CD1-CZ2 3.65Å; F238-W249 HydrophobicContact CD1-CZ2 3.65Å; F238-W249 AromaticContact CD1-CZ3 3.99Å; F238-W249 HydrophobicContact CD1-CZ3 3.99Å; F238-W249 HydrophobicContact CD2-CH2 4.21Å; F238-W249 HydrophobicContact CD2-CZ3 4.41Å; F238-W249 AromaticContact CE1-CH2 3.67Å; F238-W249 HydrophobicContact CE1-CH2 3.67Å; F238-W249 HydrophobicContact CE1-CZ2 4.02Å; F238-W249 HydrophobicContact CE1-CZ3 4.05Å; F238-W249 HydrophobicContact CE2-CZ3 4.48Å; F238-W249 AromaticContact CG-CH2 3.53Å; F238-W249 HydrophobicContact CG-CH2 3.53Å; F238-W249 HydrophobicContact CG-CZ2 4.35Å; F238-W249 HydrophobicContact CG-CZ3 4.16Å; F238-W249 HydrophobicContact CZ-CH2 4.33Å; F238-W249 HydrophobicContact CZ-CZ3 4.31Å; H246-W249 PolarHBondContact O-N 3.15Å; W249-A251 PolarHBondContact O-N 2.86Å; W249-A251 VanDerWaalsContact O-N 3.15Å; W249-A252 HydrophobicContact CB-CB 4.08Å; W249-A252 HydrophobicContact CD2-CB 3.76Å; W249-A252 HydrophobicContact CE3-CB 3.58Å; W249-A252 HydrophobicContact CG-CB 4.01Å; W249-A252 HydrophobicContact CZ3-CB 4.3Å; W249-A252 WeakPolarHBondContact O-CB 3.46Å; W249-A252 PolarHBondContact O-N 3.19Å
250K70.3Confident69.7Low125 Ų12581.1 Ų81.154%0.54338%0.382SS..G310 helixtrans-54.2-33.5177.6-64.3-179.2-179.9171.10113.4Y190 D248 A252 K253 D256Y190-K250 HydrophobicContact CE1-CB 4.4Å; D248-K250 PolarHBondContact O-N 2.88Å; K250-A252 PolarHBondContact O-N 3.46Å; K250-K253 PolarHBondContact O-N 3.47Å; K250-D256 HydrophobicContact CB-CB 4.31Å; K250-D256 VanDerWaalsContact O-CB 3.3Å; K250-D256 WeakPolarHBondContact O-CB 3.46Å
251A72.4Confident70.7Confident0 Ų080.5 Ų80.50%038%0.378CS..G310 helixtrans-76.9-8.7178.500000113.5Y190 Y191 W249 H257Y190-A251 HydrophobicContact CD1-CB 3.64Å; Y190-A251 HydrophobicContact CE1-CB 4.34Å; Y190-A251 HydrophobicContact CG-CB 3.81Å; Y191-A251 HydrophobicContact CE2-CB 4.31Å; W249-A251 PolarHBondContact O-N 2.86Å; W249-A251 VanDerWaalsContact O-N 3.15Å; A251-H257 PolarHBondContact O-NE2 3.39Å
252A70.8Confident72Confident21 Ų2173.1 Ų73.117%0.17435%0.346CS..G310 helixtrans-93.8-7171.100000113.1L235 F238 W249 K250L235-A252 WeakPolarHBondContact CD1-O 3.35Å; F238-A252 HydrophobicContact CE1-CB 4.47Å; F238-A252 HydrophobicContact CZ-CB 4.22Å; W249-A252 HydrophobicContact CB-CB 4.08Å; W249-A252 HydrophobicContact CD2-CB 3.76Å; W249-A252 HydrophobicContact CE3-CB 3.58Å; W249-A252 HydrophobicContact CG-CB 4.01Å; W249-A252 HydrophobicContact CZ3-CB 4.3Å; W249-A252 WeakPolarHBondContact O-CB 3.46Å; W249-A252 PolarHBondContact O-N 3.19Å; K250-A252 PolarHBondContact O-N 3.46Å
253K79.1Confident73.5Confident90 Ų9074.5 Ų74.539%0.39135%0.348SS..  trans-99.4119.3-177.8-66.7-176.5-177.2179.50111.4E247 K250 H255 D256 H257E247-K253 WeakPolarHBondContact O-CE 3.12Å; E247-K253 PolarHBondContact O-NZ 3.01Å; K250-K253 PolarHBondContact O-N 3.47Å; K253-H255 PolarHBondContact O-N 3.45Å; K253-D256 HydrophobicContact CB-CB 4.21Å; K253-D256 PolarHBondContact O-N 2.86Å; K253-H257 PolarHBondContact O-CD2 3.36Å; K253-H257 PolarHBondContact O-N 3.37Å; K253-H257 VanDerWaalsContact O-N 3.14Å
254L81.8Confident75.5Confident13 Ų1365.2 Ų65.27%0.06831%0.305CS..Hα-helixtrans-56.5-39.8177.2-171.283.5000112.1P229 E232 L235 D256 H257 K258P229-L254 HydrophobicContact CB-CD1 4.05Å; P229-L254 HydrophobicContact CG-CD1 3.8Å; E232-L254 HydrophobicContact CG-CB 3.74Å; E232-L254 HydrophobicContact CG-CD2 3.82Å; E232-L254 HydrophobicContact CG-CG 4.34Å; L235-L254 HydrophobicContact CD1-CB 4.06Å; L235-L254 HydrophobicContact CD1-CD1 4.3Å; L254-D256 VanDerWaalsContact C-N 3.3Å; L254-D256 PolarHBondContact O-N 3.05Å; L254-H257 WeakPolarHBondContact O-CB 3.49Å; L254-H257 PolarHBondContact O-N 3.31Å; L254-K258 WeakPolarHBondContact O-CG 3.26Å; L254-K258 PolarHBondContact O-N 3.4Å
255H84Confident77.7Confident115 Ų11561 Ų6153%0.53228%0.279SS..Hα-helixtrans-58-41.3176.9176.6-87.1000112.6K253 K258 R259K253-H255 PolarHBondContact O-N 3.45Å; H255-K258 PolarHBondContact O-N 3.43Å; H255-R259 WeakPolarHBondContact O-CB 3.25Å; H255-R259 PolarHBondContact O-N 2.93Å
256D84.8Confident79.6Confident25 Ų2555.7 Ų55.713%0.13426%0.258CS..Hα-helixtrans-72.2-33.4178.7-76.4-37000111.8Y190 K250 K253 L254 R259 A260Y190-D256 HydrophobicContact CE2-CB 4.14Å; K250-D256 HydrophobicContact CB-CB 4.31Å; K250-D256 VanDerWaalsContact O-CB 3.3Å; K250-D256 WeakPolarHBondContact O-CB 3.46Å; K253-D256 HydrophobicContact CB-CB 4.21Å; K253-D256 PolarHBondContact O-N 2.86Å; L254-D256 VanDerWaalsContact C-N 3.3Å; L254-D256 PolarHBondContact O-N 3.05Å; D256-R259 PolarHBondContact O-N 3.41Å; D256-A260 WeakPolarHBondContact O-CB 3.44Å; D256-A260 PolarHBondContact O-N 3.06Å
257H85.7Confident81.2Confident0 Ų051.3 Ų51.30%024%0.244CC..Hα-helixtrans-60.6-50.1168.3-83.1-108.4000111.8D186 R189 M228 A251 K253 L254 R259 A260 F261D186-H257 PolarHBondContact O-CE1 3.19Å; R189-H257 PolarHBondContact NE-ND1 3.45Å; R189-H257 PolarHBondContact NH2-CE1 3.12Å; M228-H257 HydrophobicContact CE-CB 3.94Å; A251-H257 PolarHBondContact O-NE2 3.39Å; K253-H257 PolarHBondContact O-CD2 3.36Å; K253-H257 PolarHBondContact O-N 3.37Å; K253-H257 VanDerWaalsContact O-N 3.14Å; L254-H257 WeakPolarHBondContact O-CB 3.49Å; L254-H257 PolarHBondContact O-N 3.31Å; H257-R259 VanDerWaalsContact C-N 3.27Å; H257-R259 PolarHBondContact O-N 3.47Å; H257-A260 PolarHBondContact O-N 3.05Å; H257-A260 VanDerWaalsContact O-N 3.14Å; H257-F261 WeakPolarHBondContact O-CB 3.48Å; H257-F261 PolarHBondContact O-N 3.03Å
258K87.3Confident83Confident53 Ų5344 Ų4423%0.2321%0.21CC..Hα-helixtrans-58.7-39.8177.1-69.1-169.2178.2-171.90111.8M228 L254 H255 F261 E262 H292M228-K258 HydrophobicContact CE-CG 4.2Å; L254-K258 WeakPolarHBondContact O-CG 3.26Å; L254-K258 PolarHBondContact O-N 3.4Å; H255-K258 PolarHBondContact O-N 3.43Å; K258-F261 PolarHBondContact O-N 3.48Å; K258-E262 WeakPolarHBondContact O-CB 3.23Å; K258-E262 PolarHBondContact O-N 3.34Å; K258-H292 WeakPolarHBondContact CB-O 3.33Å; K258-H292 VanDerWaalsContact CG-O 3.32Å; K258-H292 WeakPolarHBondContact CG-O 3.37Å
259R89.2Confident84.4Confident106 Ų10638.3 Ų38.340%0.418%0.179SC..Hα-helixtrans-68.1-38.7176.2-170.9-177.8-176.5-171.45.6112.6H255 D256 H257 R263H255-R259 WeakPolarHBondContact O-CB 3.25Å; H255-R259 PolarHBondContact O-N 2.93Å; D256-R259 PolarHBondContact O-N 3.41Å; H257-R259 VanDerWaalsContact C-N 3.27Å; H257-R259 PolarHBondContact O-N 3.47Å; R259-R263 WeakPolarHBondContact O-CB 3.5Å; R259-R263 VanDerWaalsContact O-CG 3.29Å; R259-R263 WeakPolarHBondContact O-CG 3.28Å; R259-R263 PolarHBondContact O-N 3.09Å; R259-R263 VanDerWaalsContact O-N 3.13Å
260A87.8Confident85.3Confident10 Ų1045.4 Ų45.48%0.08321%0.21CC..Hα-helixtrans-66.4-44.2175.200000111.1Y190 M193 D256 H257 R263 M264Y190-A260 HydrophobicContact CD2-CB 4.16Å; Y190-A260 HydrophobicContact CE2-CB 4.01Å; M193-A260 HydrophobicContact CB-CB 4.25Å; M193-A260 HydrophobicContact SD-CB 4.01Å; D256-A260 WeakPolarHBondContact O-CB 3.44Å; D256-A260 PolarHBondContact O-N 3.06Å; H257-A260 PolarHBondContact O-N 3.05Å; H257-A260 VanDerWaalsContact O-N 3.14Å; A260-R263 PolarHBondContact O-N 3.39Å; A260-M264 WeakPolarHBondContact O-CB 3.38Å; A260-M264 PolarHBondContact O-N 3.33Å
261F90.1Very high86.1Confident4 Ų441 Ų412%0.01819%0.191CC..Hα-helixtrans-59-48.8175.7-175.8-99.5000111.9M193 I226 M228 H257 K258 R263 M264 W265 I289 H292 M293M193-F261 HydrophobicContact CE-CB 4.4Å; M193-F261 HydrophobicContact CE-CD2 4.17Å; M193-F261 HydrophobicContact SD-CB 4.02Å; I226-F261 HydrophobicContact CG2-CD2 4.38Å; I226-F261 HydrophobicContact CG2-CE2 4.42Å; M228-F261 HydrophobicContact CE-CB 4.02Å; M228-F261 HydrophobicContact CE-CG 4.34Å; M228-F261 HydrophobicContact CG-CD2 3.69Å; M228-F261 HydrophobicContact CG-CE2 3.74Å; M228-F261 HydrophobicContact CG-CG 4.1Å; M228-F261 HydrophobicContact CG-CZ 4.22Å; M228-F261 HydrophobicContact SD-CB 4.14Å; M228-F261 HydrophobicContact SD-CD2 3.84Å; M228-F261 HydrophobicContact SD-CE2 4.46Å; M228-F261 HydrophobicContact SD-CG 4.13Å; H257-F261 WeakPolarHBondContact O-CB 3.48Å; H257-F261 PolarHBondContact O-N 3.03Å; K258-F261 PolarHBondContact O-N 3.48Å; F261-R263 PolarHBondContact O-N 3.22Å; F261-M264 HydrophobicContact CD2-CE 3.84Å; F261-M264 HydrophobicContact CE2-CE 4.18Å; F261-M264 WeakPolarHBondContact O-CB 3.32Å; F261-M264 PolarHBondContact O-N 3.43Å; F261-W265 AromaticContact CD1-CD1 3.72Å; F261-W265 AromaticContact CD2-CD1 3.97Å; F261-W265 AromaticContact CD2-NE1 3.82Å; F261-W265 AromaticContact CE1-CD1 3.46Å; F261-W265 VanDerWaalsContact CE1-CD1 3.46Å; F261-W265 AromaticContact CE1-NE1 3.48Å; F261-W265 AromaticContact CE2-CD1 3.75Å; F261-W265 AromaticContact CE2-NE1 3.18Å; F261-W265 AromaticContact CG-CD1 3.98Å; F261-W265 AromaticContact CZ-CD1 3.51Å; F261-W265 AromaticContact CZ-NE1 2.99Å; F261-W265 VanDerWaalsContact O-CD1 3.31Å; F261-W265 PolarHBondContact O-N 2.97Å; F261-I289 HydrophobicContact CE1-CG2 4.22Å; F261-H292 HydrophobicContact CD1-CB 4.14Å; F261-H292 HydrophobicContact CE1-CB 3.92Å; F261-H292 HydrophobicContact CZ-CB 4.45Å; F261-M293 HydrophobicContact CD1-CG 4.34Å
262E91Very high86.7Confident13 Ų1349 Ų496%0.06123%0.225CC..Hα-helixtrans-56.6-50.3175.3178.8-171.9119.400111.8K258 M264 W265 L266 M293 S294 K295 L298K258-E262 WeakPolarHBondContact O-CB 3.23Å; K258-E262 PolarHBondContact O-N 3.34Å; E262-M264 VanDerWaalsContact C-N 3.3Å; E262-M264 PolarHBondContact O-N 3.37Å; E262-W265 PolarHBondContact O-N 2.9Å; E262-L266 HydrophobicContact CG-CD1 3.83Å; E262-L266 HydrophobicContact CG-CG 4.39Å; E262-L266 WeakPolarHBondContact O-CB 3.41Å; E262-L266 VanDerWaalsContact O-CG 3.32Å; E262-L266 WeakPolarHBondContact O-CG 2.95Å; E262-L266 PolarHBondContact O-N 3.23Å; E262-M293 HydrophobicContact CB-CB 4.49Å; E262-M293 HydrophobicContact CB-CG 4.26Å; E262-M293 HydrophobicContact CG-CG 4.46Å; E262-S294 WeakPolarHBondContact OE2-CA 3.38Å; E262-S294 WeakPolarHBondContact OE2-CB 3.49Å; E262-S294 PolarHBondContact OE2-N 3.32Å; E262-S294 VanDerWaalsContact OE2-N 3.12Å; E262-S294 PolarHBondContact OE2-OG 3.39Å; E262-K295 PolarHBondContact OE2-N 3.08Å; E262-L298 WeakPolarHBondContact OE1-CD1 3.4Å
263R90.3Very high87.4Confident110 Ų11049 Ų4942%0.41522%0.222SC..Hα-helixtrans-64.2-34.8-179.6-74.4173169.2-169.8-9.3112.9R259 A260 F261 G267R259-R263 WeakPolarHBondContact O-CB 3.5Å; R259-R263 VanDerWaalsContact O-CG 3.29Å; R259-R263 WeakPolarHBondContact O-CG 3.28Å; R259-R263 PolarHBondContact O-N 3.09Å; R259-R263 VanDerWaalsContact O-N 3.13Å; A260-R263 PolarHBondContact O-N 3.39Å; F261-R263 PolarHBondContact O-N 3.22Å; R263-G267 PolarHBondContact O-N 3.17Å
264M92Very high87.7Confident2 Ų246 Ų461%0.0121%0.212CC..Hα-helixtrans-64.2-51.7175.5-179.4-167.965.300110.3M193 I196 M223 I226 A260 F261 E262 G267 F268M193-M264 HydrophobicContact CB-SD 4.03Å; M193-M264 HydrophobicContact CG-CE 4.38Å; M193-M264 HydrophobicContact CG-SD 3.89Å; I196-M264 HydrophobicContact CB-CG 4.21Å; I196-M264 HydrophobicContact CB-SD 4.24Å; I196-M264 HydrophobicContact CD1-SD 3.88Å; I196-M264 HydrophobicContact CG2-CG 3.87Å; I196-M264 HydrophobicContact CG2-SD 4.16Å; M223-M264 HydrophobicContact CB-CE 4.38Å; M223-M264 HydrophobicContact CE-CE 3.87Å; M223-M264 HydrophobicContact CE-CG 4.02Å; M223-M264 HydrophobicContact CE-SD 4.37Å; M223-M264 HydrophobicContact CG-CE 3.99Å; M223-M264 HydrophobicContact CG-CG 4.45Å; M223-M264 HydrophobicContact CG-SD 3.91Å; M223-M264 HydrophobicContact SD-CG 4.38Å; I226-M264 HydrophobicContact CD1-CE 4Å; I226-M264 HydrophobicContact CD1-SD 3.87Å; A260-M264 WeakPolarHBondContact O-CB 3.38Å; A260-M264 PolarHBondContact O-N 3.33Å; F261-M264 HydrophobicContact CD2-CE 3.84Å; F261-M264 HydrophobicContact CE2-CE 4.18Å; F261-M264 WeakPolarHBondContact O-CB 3.32Å; F261-M264 PolarHBondContact O-N 3.43Å; E262-M264 VanDerWaalsContact C-N 3.3Å; E262-M264 PolarHBondContact O-N 3.37Å; M264-G267 PolarHBondContact O-N 3.26Å; M264-F268 PolarHBondContact O-N 3.13Å
265W91.8Very high87.9Confident3 Ų351.1 Ų51.11%0.01124%0.24CC..Hα-helixtrans-62.6-47.8178-81.7104.7000112.7F220 M223 L224 F261 E262 G267 F268 L269 I281 I289 M293F220-W265 HydrophobicContact CD2-CH2 4.33Å; F220-W265 HydrophobicContact CD2-CZ3 4.49Å; F220-W265 HydrophobicContact CE2-CH2 4.12Å; F220-W265 HydrophobicContact CE2-CZ3 4.4Å; M223-W265 HydrophobicContact CB-CH2 4.19Å; M223-W265 HydrophobicContact CB-CZ2 3.99Å; M223-W265 HydrophobicContact CE-CB 4.35Å; M223-W265 HydrophobicContact CE-CD2 3.26Å; M223-W265 HydrophobicContact CE-CE3 3.35Å; M223-W265 HydrophobicContact CE-CG 3.74Å; M223-W265 HydrophobicContact CE-CH2 4.03Å; M223-W265 HydrophobicContact CE-CZ2 3.97Å; M223-W265 HydrophobicContact CE-CZ3 3.74Å; L224-W265 HydrophobicContact CD2-CH2 4.36Å; F261-W265 AromaticContact CD1-CD1 3.72Å; F261-W265 AromaticContact CD2-CD1 3.97Å; F261-W265 AromaticContact CD2-NE1 3.82Å; F261-W265 AromaticContact CE1-CD1 3.46Å; F261-W265 VanDerWaalsContact CE1-CD1 3.46Å; F261-W265 AromaticContact CE1-NE1 3.48Å; F261-W265 AromaticContact CE2-CD1 3.75Å; F261-W265 AromaticContact CE2-NE1 3.18Å; F261-W265 AromaticContact CG-CD1 3.98Å; F261-W265 AromaticContact CZ-CD1 3.51Å; F261-W265 AromaticContact CZ-NE1 2.99Å; F261-W265 VanDerWaalsContact O-CD1 3.31Å; F261-W265 PolarHBondContact O-N 2.97Å; E262-W265 PolarHBondContact O-N 2.9Å; W265-G267 VanDerWaalsContact C-N 3.29Å; W265-G267 PolarHBondContact O-N 3.4Å; W265-F268 PolarHBondContact O-N 3.21Å; W265-F268 VanDerWaalsContact O-N 3.13Å; W265-L269 WeakPolarHBondContact O-CB 3.02Å; W265-L269 VanDerWaalsContact O-CG 3.26Å; W265-L269 WeakPolarHBondContact O-CG 3.17Å; W265-L269 PolarHBondContact O-N 3.09Å; W265-I281 HydrophobicContact CZ3-CG1 4.37Å; W265-I289 HydrophobicContact CD2-CD1 4.22Å; W265-I289 HydrophobicContact CD2-CG2 4.16Å; W265-I289 HydrophobicContact CE3-CD1 4.11Å; W265-I289 HydrophobicContact CG-CG2 4.15Å; W265-I289 HydrophobicContact CH2-CD1 3.62Å; W265-I289 HydrophobicContact CH2-CG1 4.48Å; W265-I289 HydrophobicContact CZ2-CD1 3.71Å; W265-I289 HydrophobicContact CZ2-CG1 4.1Å; W265-I289 HydrophobicContact CZ3-CD1 3.82Å; W265-M293 HydrophobicContact CB-CE 3.64Å; W265-M293 HydrophobicContact CG-CE 4.05Å
266L90Very high88Confident52 Ų5249.6 Ų49.627%0.27224%0.241SC..Hα-helixtrans-61.4-38.5177.2-68.2175.8000112E262 F268 K270 L298 M299E262-L266 HydrophobicContact CG-CD1 3.83Å; E262-L266 HydrophobicContact CG-CG 4.39Å; E262-L266 WeakPolarHBondContact O-CB 3.41Å; E262-L266 VanDerWaalsContact O-CG 3.32Å; E262-L266 WeakPolarHBondContact O-CG 2.95Å; E262-L266 PolarHBondContact O-N 3.23Å; L266-F268 VanDerWaalsContact C-N 3.3Å; L266-F268 PolarHBondContact O-N 3.22Å; L266-K270 WeakPolarHBondContact O-CB 3Å; L266-K270 PolarHBondContact O-N 3.17Å; L266-K270 VanDerWaalsContact O-N 3.16Å; L266-L298 HydrophobicContact CD1-CB 3.96Å; L266-L298 HydrophobicContact CD1-CD1 3.75Å; L266-L298 HydrophobicContact CD2-CB 4.3Å; L266-M299 HydrophobicContact CD2-CE 4.27Å
267G87.9Confident88.1Confident23 Ų2348.9 Ų48.924%0.23724%0.237CC..Hα-helixtrans-63.2-35.7175.600000113R263 M264 W265 Y271R263-G267 PolarHBondContact O-N 3.17Å; M264-G267 PolarHBondContact O-N 3.26Å; W265-G267 VanDerWaalsContact C-N 3.29Å; W265-G267 PolarHBondContact O-N 3.4Å; G267-Y271 VanDerWaalsContact O-CD2 3.3Å; G267-Y271 WeakPolarHBondContact O-CD2 3.23Å; G267-Y271 WeakPolarHBondContact O-CE2 3.43Å
268F89.7Confident88.2Confident5 Ų550.6 Ų50.62%0.02224%0.244CC..Hα-helixtrans-76.6-46.3177.2-175.6-109.8000112.6V200 Q216 V219 F220 M223 M264 W265 L266 K270 Y271 L273 M277 I281V200-F268 HydrophobicContact CG1-CD2 4.38Å; V200-F268 HydrophobicContact CG2-CD2 4.43Å; Q216-F268 HydrophobicContact CB-CE2 4.48Å; Q216-F268 HydrophobicContact CB-CZ 4.46Å; V219-F268 HydrophobicContact CB-CD2 4.49Å; V219-F268 HydrophobicContact CB-CE2 3.96Å; V219-F268 HydrophobicContact CG1-CD2 3.59Å; V219-F268 HydrophobicContact CG1-CE2 3.52Å; V219-F268 HydrophobicContact CG1-CG 4.48Å; V219-F268 HydrophobicContact CG1-CZ 4.35Å; F220-F268 HydrophobicContact CB-CZ 4.2Å; F220-F268 HydrophobicContact CD2-CE1 4.39Å; M223-F268 HydrophobicContact CE-CB 3.93Å; M223-F268 HydrophobicContact CE-CD1 4.27Å; M223-F268 HydrophobicContact CE-CG 4.22Å; M223-F268 HydrophobicContact SD-CB 4Å; M223-F268 HydrophobicContact SD-CD1 4.14Å; M223-F268 HydrophobicContact SD-CD2 4.21Å; M223-F268 HydrophobicContact SD-CG 3.86Å; M264-F268 PolarHBondContact O-N 3.13Å; W265-F268 PolarHBondContact O-N 3.21Å; W265-F268 VanDerWaalsContact O-N 3.13Å; L266-F268 VanDerWaalsContact C-N 3.3Å; L266-F268 PolarHBondContact O-N 3.22Å; F268-K270 PolarHBondContact O-N 2.66Å; F268-Y271 PolarHBondContact O-N 3.48Å; F268-L273 HydrophobicContact CD1-CD1 4.44Å; F268-L273 HydrophobicContact CD1-CD2 4.32Å; F268-L273 HydrophobicContact CE1-CD1 4.08Å; F268-L273 HydrophobicContact CE1-CD2 3.7Å; F268-L273 HydrophobicContact CE2-CD2 4.21Å; F268-L273 HydrophobicContact CZ-CD2 3.64Å; F268-M277 HydrophobicContact CE1-SD 3.99Å; F268-M277 HydrophobicContact CZ-SD 3.68Å; F268-I281 HydrophobicContact CE1-CD1 4.25Å
269L88.6Confident88.2Confident18 Ų1852 Ų529%0.09425%0.25CS..Hα-helixtrans-68.6-17.3-178.1-65.2176.4000113.7W265 Y271 L273 I281 M299 F302W265-L269 WeakPolarHBondContact O-CB 3.02Å; W265-L269 VanDerWaalsContact O-CG 3.26Å; W265-L269 WeakPolarHBondContact O-CG 3.17Å; W265-L269 PolarHBondContact O-N 3.09Å; L269-Y271 PolarHBondContact O-N 2.85Å; L269-L273 HydrophobicContact CD2-CD1 3.9Å; L269-I281 HydrophobicContact CD2-CD1 3.99Å; L269-I281 HydrophobicContact CD2-CG2 4.19Å; L269-M299 HydrophobicContact CD1-CE 3.63Å; L269-M299 HydrophobicContact CD1-SD 3.55Å; L269-M299 VanDerWaalsContact CD1-SD 3.55Å; L269-F302 HydrophobicContact CB-CD2 4.22Å; L269-F302 HydrophobicContact CB-CE2 4.27Å; L269-F302 HydrophobicContact CD1-CD1 4.42Å; L269-F302 HydrophobicContact CD1-CD2 4.39Å; L269-F302 HydrophobicContact CD1-CE1 4.46Å; L269-F302 HydrophobicContact CD1-CE2 4.4Å; L269-F302 HydrophobicContact CD1-CG 4.39Å; L269-F302 HydrophobicContact CD1-CZ 4.46Å; L269-F302 HydrophobicContact CD2-CE2 3.82Å; L269-F302 HydrophobicContact CD2-CZ 3.89Å; L269-F302 HydrophobicContact CG-CE2 4.38Å
270K87.8Confident88.2Confident165 Ų16553.2 Ų53.272%0.71726%0.259SS*.THydrogen-bonded Turntrans-60-28.5174.4-176.7179.1177.8-175.50113.1L266 F268L266-K270 WeakPolarHBondContact O-CB 3Å; L266-K270 PolarHBondContact O-N 3.17Å; L266-K270 VanDerWaalsContact O-N 3.16Å; F268-K270 PolarHBondContact O-N 2.66Å
271Y87Confident88.4Confident34 Ų3452.8 Ų52.813%0.13326%0.255CS..SBendtrans-96.4159.3-175.5-57.9-76.3000112V200 M204 G267 F268 L269 L273V200-Y271 HydrophobicContact CG1-CD2 4.06Å; V200-Y271 HydrophobicContact CG1-CE2 3.84Å; M204-Y271 HydrophobicContact CB-CD1 3.72Å; M204-Y271 HydrophobicContact CB-CD2 4.01Å; M204-Y271 HydrophobicContact CB-CE1 3.45Å; M204-Y271 VanDerWaalsContact CB-CE1 3.45Å; M204-Y271 HydrophobicContact CB-CE2 3.75Å; M204-Y271 HydrophobicContact CB-CG 3.99Å; M204-Y271 VanDerWaalsContact CB-CZ 3.47Å; M204-Y271 HydrophobicContact CE-CD1 4.01Å; M204-Y271 HydrophobicContact CE-CD2 4.4Å; M204-Y271 HydrophobicContact CE-CG 3.73Å; M204-Y271 HydrophobicContact CG-CD1 4.26Å; M204-Y271 HydrophobicContact CG-CD2 3.88Å; M204-Y271 HydrophobicContact CG-CE1 4.36Å; M204-Y271 HydrophobicContact CG-CE2 3.97Å; M204-Y271 HydrophobicContact CG-CG 4.02Å; G267-Y271 VanDerWaalsContact O-CD2 3.3Å; G267-Y271 WeakPolarHBondContact O-CD2 3.23Å; G267-Y271 WeakPolarHBondContact O-CE2 3.43Å; F268-Y271 PolarHBondContact O-N 3.48Å; L269-Y271 PolarHBondContact O-N 2.85Å; Y271-L273 PolarHBondContact O-N 2.94Å
272K83.6Confident88.3Confident167 Ų16752.6 Ų52.673%0.72625%0.254SS*.  trans-66.7126.2176.9-67.8-171.8177.1-175.20110.4V211 Q216V211-K272 HydrophobicContact CG2-CB 4.25Å; Q216-K272 PolarHBondContact NE2-O 2.69Å
273L85.8Confident88.2Confident21 Ų2153.4 Ų53.411%0.1126%0.26CS..  trans-108.7151.1-178.6-60.9176.1000111.4F268 L269 Y271 M277 Y278 I281F268-L273 HydrophobicContact CD1-CD1 4.44Å; F268-L273 HydrophobicContact CD1-CD2 4.32Å; F268-L273 HydrophobicContact CE1-CD1 4.08Å; F268-L273 HydrophobicContact CE1-CD2 3.7Å; F268-L273 HydrophobicContact CE2-CD2 4.21Å; F268-L273 HydrophobicContact CZ-CD2 3.64Å; L269-L273 HydrophobicContact CD2-CD1 3.9Å; Y271-L273 PolarHBondContact O-N 2.94Å; L273-M277 HydrophobicContact CD2-SD 4.04Å; L273-Y278 HydrophobicContact CD1-CD2 4.48Å; L273-I281 HydrophobicContact CD1-CD1 3.54Å
274P86.8Confident88.2Confident28 Ų2850.4 Ų50.418%0.18225%0.253CS..  trans-61.4142.7170-20.932.5000112.1V211 S276 M277 Y278V211-P274 HydrophobicContact CG1-CG 3.95Å; P274-S276 PolarHBondContact O-N 3.15Å; P274-S276 VanDerWaalsContact O-N 3.15Å; P274-M277 WeakPolarHBondContact O-CB 3.29Å; P274-M277 PolarHBondContact O-N 3.42Å; P274-Y278 PolarHBondContact O-N 3.25Å
275N85.2Confident88Confident120 Ų12050.3 Ų50.364%0.64225%0.253SS*.Hα-helixtrans-56.7-34.2-177.3-72.6-11.8000113.9K279N275-K279 WeakPolarHBondContact O-CG 3.46Å; N275-K279 PolarHBondContact O-N 2.72Å
276S85.9Confident87.7Confident82 Ų8251.3 Ų51.357%0.57326%0.258SS*.Hα-helixtrans-65.3-41.2177.3540000112P274 K280P274-S276 PolarHBondContact O-N 3.15Å; P274-S276 VanDerWaalsContact O-N 3.15Å; S276-K280 WeakPolarHBondContact O-CG 3.45Å; S276-K280 PolarHBondContact O-N 2.76Å
277M86.5Confident87.4Confident10 Ų1054 Ų545%0.04927%0.272CS..Hα-helixtrans-71.8-41.5177.7-174.2-178.7-68.100111.3Q216 F220 F268 L273 P274 K279 K280 I281Q216-M277 VanDerWaalsContact C-CE 3.45Å; Q216-M277 HydrophobicContact CB-CE 3.95Å; Q216-M277 HydrophobicContact CB-SD 4.35Å; Q216-M277 VanDerWaalsContact O-CE 3.31Å; Q216-M277 WeakPolarHBondContact O-CE 3.25Å; F220-M277 HydrophobicContact CB-CE 3.81Å; F220-M277 HydrophobicContact CB-CG 4.37Å; F220-M277 HydrophobicContact CB-SD 3.89Å; F220-M277 HydrophobicContact CD1-CE 4.37Å; F220-M277 HydrophobicContact CD1-CG 3.95Å; F220-M277 HydrophobicContact CD2-CG 4.16Å; F220-M277 HydrophobicContact CD2-SD 4.49Å; F220-M277 HydrophobicContact CE1-CG 4.24Å; F220-M277 HydrophobicContact CE2-CG 4.48Å; F220-M277 HydrophobicContact CG-CE 4.24Å; F220-M277 HydrophobicContact CG-CG 3.88Å; F220-M277 HydrophobicContact CG-SD 4.06Å; F220-M277 HydrophobicContact CZ-CG 4.49Å; F268-M277 HydrophobicContact CE1-SD 3.99Å; F268-M277 HydrophobicContact CZ-SD 3.68Å; L273-M277 HydrophobicContact CD2-SD 4.04Å; P274-M277 WeakPolarHBondContact O-CB 3.29Å; P274-M277 PolarHBondContact O-N 3.42Å; M277-K279 VanDerWaalsContact C-N 3.3Å; M277-K279 PolarHBondContact O-N 3.02Å; M277-K280 WeakPolarHBondContact O-CB 3.41Å; M277-K280 PolarHBondContact O-N 2.75Å; M277-K280 VanDerWaalsContact O-N 3.08Å; M277-I281 HydrophobicContact CG-CD1 3.97Å; M277-I281 HydrophobicContact CG-CG1 4.47Å; M277-I281 WeakPolarHBondContact O-CG1 3.3Å; M277-I281 PolarHBondContact O-N 3.33Å
278Y87.8Confident87.3Confident36 Ų3655.1 Ų55.114%0.14128%0.277CS..Hα-helixtrans-55-46.1176.7-160.5-98.8000112L273 P274 I281 L282 F302 A306 I313L273-Y278 HydrophobicContact CD1-CD2 4.48Å; P274-Y278 PolarHBondContact O-N 3.25Å; Y278-I281 PolarHBondContact O-N 2.9Å; Y278-L282 HydrophobicContact CD1-CD1 3.85Å; Y278-L282 HydrophobicContact CE1-CD1 3.71Å; Y278-L282 HydrophobicContact CE1-CG 4.43Å; Y278-L282 WeakPolarHBondContact O-CG 3.48Å; Y278-L282 PolarHBondContact O-N 3.41Å; Y278-L282 VanDerWaalsContact O-N 3.12Å; Y278-F302 HydrophobicContact CD2-CE2 4.29Å; Y278-F302 HydrophobicContact CD2-CZ 4.21Å; Y278-F302 HydrophobicContact CE2-CD2 4.46Å; Y278-F302 AromaticContact CE2-CE2 3.35Å; Y278-F302 HydrophobicContact CE2-CE2 3.35Å; Y278-F302 AromaticContact CE2-CZ 3.47Å; Y278-F302 HydrophobicContact CE2-CZ 3.47Å; Y278-F302 VanDerWaalsContact CE2-CZ 3.47Å; Y278-F302 AromaticContact CZ-CE2 3.82Å; Y278-F302 AromaticContact CZ-CZ 3.71Å; Y278-A306 HydrophobicContact CE1-CB 3.97Å; Y278-A306 WeakPolarHBondContact OH-CA 3.32Å; Y278-A306 WeakPolarHBondContact OH-CB 3.42Å; Y278-I313 HydrophobicContact CD1-CD1 4.22Å; Y278-I313 HydrophobicContact CD1-CG2 3.8Å; Y278-I313 HydrophobicContact CE1-CG2 3.43Å; Y278-I313 VanDerWaalsContact CE1-CG2 3.43Å
279K88.7Confident87.1Confident83 Ų8354.9 Ų54.936%0.36128%0.276SS..Hα-helixtrans-62.8-42.8174.8-69.6176.8-176.7-178.10112.5N275 M277 L282 V283 I313 L316N275-K279 WeakPolarHBondContact O-CG 3.46Å; N275-K279 PolarHBondContact O-N 2.72Å; M277-K279 VanDerWaalsContact C-N 3.3Å; M277-K279 PolarHBondContact O-N 3.02Å; K279-L282 PolarHBondContact O-N 2.89Å; K279-V283 VanDerWaalsContact O-CG2 3.28Å; K279-V283 WeakPolarHBondContact O-CG2 3.36Å; K279-V283 PolarHBondContact O-N 3.11Å; K279-V283 VanDerWaalsContact O-N 3.09Å; K279-I313 HydrophobicContact CG-CG1 4.28Å; K279-L316 HydrophobicContact CB-CD1 4.18Å; K279-L316 HydrophobicContact CG-CD1 4.32Å
280K89.1Confident87Confident132 Ų13254 Ų5457%0.57427%0.271SS*.Hα-helixtrans-62.1-42.4177.8-72.7179.6-179.6-173.80111.9F220 S276 M277 V283 V284F220-K280 HydrophobicContact CE1-CB 4.01Å; F220-K280 HydrophobicContact CE1-CD 4.05Å; F220-K280 HydrophobicContact CZ-CB 3.88Å; S276-K280 WeakPolarHBondContact O-CG 3.45Å; S276-K280 PolarHBondContact O-N 2.76Å; M277-K280 WeakPolarHBondContact O-CB 3.41Å; M277-K280 PolarHBondContact O-N 2.75Å; M277-K280 VanDerWaalsContact O-N 3.08Å; K280-V283 PolarHBondContact O-N 3.12Å; K280-V284 WeakPolarHBondContact O-CG2 3.38Å; K280-V284 PolarHBondContact O-N 2.54Å
281I90.6Very high87Confident0 Ų049 Ų490%026%0.256CS..Hα-helixtrans-58.8-52.4175.9-68.9162.9000109.9F220 W265 F268 L269 L273 M277 Y278 V283 V284 L285 I289F220-I281 HydrophobicContact CD2-CD1 4.3Å; F220-I281 HydrophobicContact CD2-CG1 4Å; F220-I281 HydrophobicContact CE2-CD1 4.07Å; F220-I281 HydrophobicContact CE2-CG1 3.29Å; F220-I281 HydrophobicContact CZ-CG1 3.85Å; W265-I281 HydrophobicContact CZ3-CG1 4.37Å; F268-I281 HydrophobicContact CE1-CD1 4.25Å; L269-I281 HydrophobicContact CD2-CD1 3.99Å; L269-I281 HydrophobicContact CD2-CG2 4.19Å; L273-I281 HydrophobicContact CD1-CD1 3.54Å; M277-I281 HydrophobicContact CG-CD1 3.97Å; M277-I281 HydrophobicContact CG-CG1 4.47Å; M277-I281 WeakPolarHBondContact O-CG1 3.3Å; M277-I281 PolarHBondContact O-N 3.33Å; Y278-I281 PolarHBondContact O-N 2.9Å; I281-V283 VanDerWaalsContact C-N 3.28Å; I281-V283 PolarHBondContact O-N 3.43Å; I281-V284 PolarHBondContact O-N 2.97Å; I281-V284 VanDerWaalsContact O-N 3.07Å; I281-L285 HydrophobicContact CG2-CD1 4.45Å; I281-L285 WeakPolarHBondContact O-CB 3.45Å; I281-L285 PolarHBondContact O-N 3.5Å; I281-I289 HydrophobicContact CG2-CD1 4.37Å
282L88.6Confident87Confident1 Ų148.9 Ų48.91%0.00526%0.256CS..Hα-helixtrans-62.3-33.2-177.7-66.9172.5000113.3Y278 K279 V284 L285 F302 L303 A306 I313 L316 A317Y278-L282 HydrophobicContact CD1-CD1 3.85Å; Y278-L282 HydrophobicContact CE1-CD1 3.71Å; Y278-L282 HydrophobicContact CE1-CG 4.43Å; Y278-L282 WeakPolarHBondContact O-CG 3.48Å; Y278-L282 PolarHBondContact O-N 3.41Å; Y278-L282 VanDerWaalsContact O-N 3.12Å; K279-L282 PolarHBondContact O-N 2.89Å; L282-V284 VanDerWaalsContact C-N 3.29Å; L282-V284 PolarHBondContact O-N 3.2Å; L282-L285 HydrophobicContact CD2-CD2 4.34Å; L282-F302 HydrophobicContact CD2-CE1 3.83Å; L282-F302 HydrophobicContact CD2-CZ 4.43Å; L282-L303 HydrophobicContact CD2-CD2 4.05Å; L282-A306 HydrophobicContact CD1-CB 4.33Å; L282-A306 HydrophobicContact CD2-CB 4.26Å; L282-I313 HydrophobicContact CD1-CG2 3.66Å; L282-L316 HydrophobicContact CB-CB 3.67Å; L282-L316 HydrophobicContact CB-CD1 4.4Å; L282-L316 HydrophobicContact CD1-CB 4.1Å; L282-A317 HydrophobicContact CD2-CB 4.3Å
283V89.3Confident87Confident30 Ų3041.4 Ų41.418%0.18222%0.224CC..Hα-helixtrans-62.5-37.8175.2167.90000111.8K279 K280 I281 H286 L316 Y352K279-V283 VanDerWaalsContact O-CG2 3.28Å; K279-V283 WeakPolarHBondContact O-CG2 3.36Å; K279-V283 PolarHBondContact O-N 3.11Å; K279-V283 VanDerWaalsContact O-N 3.09Å; K280-V283 PolarHBondContact O-N 3.12Å; I281-V283 VanDerWaalsContact C-N 3.28Å; I281-V283 PolarHBondContact O-N 3.43Å; V283-H286 PolarHBondContact O-CE1 3.14Å; V283-H286 PolarHBondContact O-ND1 3.3Å; V283-H286 VanDerWaalsContact O-ND1 3.17Å; V283-L316 HydrophobicContact CG2-CD1 4.05Å; V283-L316 HydrophobicContact CG2-CD2 3.58Å; V283-L316 HydrophobicContact CG2-CG 4.45Å; V283-Y352 HydrophobicContact CG2-CE1 3.79Å
284V88.9Confident87.1Confident46 Ų4642.2 Ų42.228%0.27923%0.231SC..Hα-helixtrans-97.8-15.6-171.7175.90000112L224 K280 I281 L282 H286 D287 S288L224-V284 HydrophobicContact CD2-CG1 4.15Å; K280-V284 WeakPolarHBondContact O-CG2 3.38Å; K280-V284 PolarHBondContact O-N 2.54Å; I281-V284 PolarHBondContact O-N 2.97Å; I281-V284 VanDerWaalsContact O-N 3.07Å; L282-V284 VanDerWaalsContact C-N 3.29Å; L282-V284 PolarHBondContact O-N 3.2Å; V284-H286 PolarHBondContact O-N 3.36Å; V284-D287 PolarHBondContact O-N 3.04Å; V284-S288 WeakPolarHBondContact CG1-OG 3.34Å; V284-S288 PolarHBondContact O-N 3.35Å; V284-S288 PolarHBondContact O-OG 3.24Å
285L88.6Confident87.1Confident1 Ų147.3 Ų47.31%0.00525%0.251CS..Iπ-helixtrans-54.3-50-173-171.678.5000113.8I281 L282 I289 L290 M299 L303I281-L285 HydrophobicContact CG2-CD1 4.45Å; I281-L285 WeakPolarHBondContact O-CB 3.45Å; I281-L285 PolarHBondContact O-N 3.5Å; L282-L285 HydrophobicContact CD2-CD2 4.34Å; L285-I289 HydrophobicContact CD1-CB 3.96Å; L285-I289 HydrophobicContact CD1-CD1 3.98Å; L285-I289 HydrophobicContact CD1-CG2 3.92Å; L285-I289 WeakPolarHBondContact O-CB 3.5Å; L285-I289 PolarHBondContact O-N 2.91Å; L285-I289 VanDerWaalsContact O-N 3.15Å; L285-L290 HydrophobicContact CG-CD1 4.49Å; L285-L290 HydrophobicContact CG-CD2 4.43Å; L285-L290 HydrophobicContact CG-CG 4.14Å; L285-L290 WeakPolarHBondContact O-CG 3.32Å; L285-L290 PolarHBondContact O-N 2.84Å; L285-M299 HydrophobicContact CD1-CE 4.34Å; L285-M299 HydrophobicContact CD1-CG 4.43Å; L285-M299 HydrophobicContact CD1-SD 4.42Å; L285-M299 HydrophobicContact CD2-CG 4.37Å; L285-L303 HydrophobicContact CD2-CD1 4.08Å; L285-L303 HydrophobicContact CD2-CD2 3.54Å; L285-L303 HydrophobicContact CD2-CG 4.01Å
286H85.4Confident87.2Confident24 Ų2442 Ų4211%0.11122%0.223CC..Iπ-helixtrans-67-39.3-175.368-61.8000113.8V283 V284 P291 N319 V323V283-H286 PolarHBondContact O-CE1 3.14Å; V283-H286 PolarHBondContact O-ND1 3.3Å; V283-H286 VanDerWaalsContact O-ND1 3.17Å; V284-H286 PolarHBondContact O-N 3.36Å; H286-P291 WeakPolarHBondContact O-CD 3.2Å; H286-N319 PolarHBondContact CD2-ND2 3.09Å; H286-N319 PolarHBondContact CE1-ND2 3.27Å; H286-N319 VanDerWaalsContact CE1-ND2 3.27Å; H286-N319 VanDerWaalsContact CG-ND2 3.27Å; H286-N319 PolarHBondContact ND1-ND2 3.08Å; H286-N319 PolarHBondContact NE2-ND2 3.39Å; H286-V323 HydrophobicContact CB-CG2 4.03Å
287D84.8Confident87.3Confident107 Ų10740.9 Ų40.957%0.57221%0.212SC*.Iπ-helixtrans-85.9-40.7-174.5-67.2-29.1000112.9V284V284-D287 PolarHBondContact O-N 3.04Å
288S84.1Confident87.4Confident47 Ų4744.6 Ų44.633%0.32923%0.232SC..Iπ-helixtrans-121.7-6.3-169.384.90000115.4V284 H292V284-S288 WeakPolarHBondContact CG1-OG 3.34Å; V284-S288 PolarHBondContact O-N 3.35Å; V284-S288 PolarHBondContact O-OG 3.24Å; S288-H292 PolarHBondContact O-CD2 3.39Å; S288-H292 VanDerWaalsContact O-CD2 3.27Å
289I87Confident87.4Confident0 Ų043 Ų430%023%0.226CC..Iπ-helixtrans-109.2-56-179.7-54.4-178.9000110.5F261 W265 I281 L285 H292 M293F261-I289 HydrophobicContact CE1-CG2 4.22Å; W265-I289 HydrophobicContact CD2-CD1 4.22Å; W265-I289 HydrophobicContact CD2-CG2 4.16Å; W265-I289 HydrophobicContact CE3-CD1 4.11Å; W265-I289 HydrophobicContact CG-CG2 4.15Å; W265-I289 HydrophobicContact CH2-CD1 3.62Å; W265-I289 HydrophobicContact CH2-CG1 4.48Å; W265-I289 HydrophobicContact CZ2-CD1 3.71Å; W265-I289 HydrophobicContact CZ2-CG1 4.1Å; W265-I289 HydrophobicContact CZ3-CD1 3.82Å; I281-I289 HydrophobicContact CG2-CD1 4.37Å; L285-I289 HydrophobicContact CD1-CB 3.96Å; L285-I289 HydrophobicContact CD1-CD1 3.98Å; L285-I289 HydrophobicContact CD1-CG2 3.92Å; L285-I289 WeakPolarHBondContact O-CB 3.5Å; L285-I289 PolarHBondContact O-N 2.91Å; L285-I289 VanDerWaalsContact O-N 3.15Å; I289-H292 PolarHBondContact O-N 3.44Å; I289-M293 HydrophobicContact CG2-CE 3.29Å; I289-M293 HydrophobicContact CG2-SD 4.23Å; I289-M293 PolarHBondContact O-N 2.59Å
290L86.7Confident87.4Confident1 Ų141 Ų411%0.00522%0.219CC..G310 helixtrans-58.8-43.5-177-65.7178.3000113.7L285 H292 M293 P296 M299 V323 L324L285-L290 HydrophobicContact CG-CD1 4.49Å; L285-L290 HydrophobicContact CG-CD2 4.43Å; L285-L290 HydrophobicContact CG-CG 4.14Å; L285-L290 WeakPolarHBondContact O-CG 3.32Å; L285-L290 PolarHBondContact O-N 2.84Å; L290-H292 PolarHBondContact O-N 3.49Å; L290-H292 VanDerWaalsContact O-N 3.16Å; L290-M293 HydrophobicContact CD2-SD 4.38Å; L290-M293 PolarHBondContact O-N 3.33Å; L290-P296 HydrophobicContact CD2-CB 4.26Å; L290-P296 WeakPolarHBondContact O-CG 3.4Å; L290-M299 HydrophobicContact CD2-CB 4.14Å; L290-M299 HydrophobicContact CD2-CG 4.21Å; L290-V323 HydrophobicContact CB-CG1 4.41Å; L290-V323 HydrophobicContact CD1-CB 3.93Å; L290-V323 HydrophobicContact CD1-CG1 3.87Å; L290-L324 HydrophobicContact CD2-CD2 4.38Å
291P86.8Confident87.5Confident60 Ų6041 Ų4139%0.3923%0.225SC..G310 helixtrans-64.1-24.2-176.7-25.237.2000114.2H286H286-P291 WeakPolarHBondContact O-CD 3.2Å
292H86.2Confident87.4Confident30 Ų3042.4 Ų42.414%0.13923%0.231CC..G310 helixtrans-99.70.1-176-56.6-59000113.6M228 K258 F261 S288 I289 L290M228-H292 HydrophobicContact CB-CB 3.82Å; M228-H292 VanDerWaalsContact CB-CG 3.47Å; M228-H292 HydrophobicContact CG-CB 3.91Å; K258-H292 WeakPolarHBondContact CB-O 3.33Å; K258-H292 VanDerWaalsContact CG-O 3.32Å; K258-H292 WeakPolarHBondContact CG-O 3.37Å; F261-H292 HydrophobicContact CD1-CB 4.14Å; F261-H292 HydrophobicContact CE1-CB 3.92Å; F261-H292 HydrophobicContact CZ-CB 4.45Å; S288-H292 PolarHBondContact O-CD2 3.39Å; S288-H292 VanDerWaalsContact O-CD2 3.27Å; I289-H292 PolarHBondContact O-N 3.44Å; L290-H292 PolarHBondContact O-N 3.49Å; L290-H292 VanDerWaalsContact O-N 3.16Å
293M85.3Confident87.5Confident10 Ų1042.4 Ų42.45%0.04923%0.231CC..  trans-79.3147.6173.6-74.9178.1170.700111.5F261 E262 W265 I289 L290 P296 M299F261-M293 HydrophobicContact CD1-CG 4.34Å; E262-M293 HydrophobicContact CB-CB 4.49Å; E262-M293 HydrophobicContact CB-CG 4.26Å; E262-M293 HydrophobicContact CG-CG 4.46Å; W265-M293 HydrophobicContact CB-CE 3.64Å; W265-M293 HydrophobicContact CG-CE 4.05Å; I289-M293 HydrophobicContact CG2-CE 3.29Å; I289-M293 HydrophobicContact CG2-SD 4.23Å; I289-M293 PolarHBondContact O-N 2.59Å; L290-M293 HydrophobicContact CD2-SD 4.38Å; L290-M293 PolarHBondContact O-N 3.33Å; M293-P296 HydrophobicContact CB-CG 4.01Å; M293-M299 HydrophobicContact CE-CE 3.34Å; M293-M299 HydrophobicContact SD-CE 3.75Å
294S86.3Confident87.4Confident39 Ų3942.5 Ų42.527%0.27323%0.232SC..SBendtrans-74.4-37.2175.964.20000112.1E262E262-S294 WeakPolarHBondContact OE2-CA 3.38Å; E262-S294 WeakPolarHBondContact OE2-CB 3.49Å; E262-S294 PolarHBondContact OE2-N 3.32Å; E262-S294 VanDerWaalsContact OE2-N 3.12Å; E262-S294 PolarHBondContact OE2-OG 3.39Å
295K87.5Confident87.4Confident135 Ų13542.9 Ų42.959%0.58724%0.24SC*.  trans-134.586.9175-68.6-176-179.8-174.80110.3E262 T297 L298E262-K295 PolarHBondContact OE2-N 3.08Å; K295-T297 PolarHBondContact O-N 3.4Å; K295-T297 VanDerWaalsContact O-N 3.11Å; K295-L298 HydrophobicContact CB-CD1 4.45Å; K295-L298 HydrophobicContact CB-CG 4.47Å; K295-L298 PolarHBondContact O-N 3.38Å
296P87.4Confident87.4Confident8 Ų842.9 Ų42.95%0.05224%0.24CC..G310 helixtrans-60.4-22.2-179-27.939.3000114.3L290 M293 L298 M299 L324 H328L290-P296 HydrophobicContact CD2-CB 4.26Å; L290-P296 WeakPolarHBondContact O-CG 3.4Å; M293-P296 HydrophobicContact CB-CG 4.01Å; P296-L298 PolarHBondContact O-N 3.37Å; P296-L298 VanDerWaalsContact O-N 3.13Å; P296-M299 VanDerWaalsContact O-CB 3.29Å; P296-M299 WeakPolarHBondContact O-CB 3.26Å; P296-M299 PolarHBondContact O-N 3.28Å; P296-L324 HydrophobicContact CB-CD2 3.72Å; P296-L324 WeakPolarHBondContact O-CD2 3.4Å; P296-H328 VanDerWaalsContact CG-NE2 3.35Å; P296-H328 WeakPolarHBondContact CG-NE2 3.34Å
297T87.8Confident87.6Confident58 Ų5842.2 Ų42.236%0.35624%0.236SC..G310 helixtrans-59.3-22176.453.90000113.7K295 M299 I300 H328K295-T297 PolarHBondContact O-N 3.4Å; K295-T297 VanDerWaalsContact O-N 3.11Å; T297-M299 PolarHBondContact O-N 2.73Å; T297-M299 VanDerWaalsContact O-N 3.09Å; T297-I300 WeakPolarHBondContact O-CD1 3.41Å; T297-I300 WeakPolarHBondContact O-CG1 3.34Å; T297-I300 PolarHBondContact O-N 3.09Å; T297-H328 HydrophobicContact CG2-CB 4.24Å
298L88.4Confident87.6Confident89 Ų8941.6 Ų41.647%0.46623%0.233SC..G310 helixtrans-66.7-12.3174.8-64.8176.4000113.4E262 L266 K295 P296 I300E262-L298 WeakPolarHBondContact OE1-CD1 3.4Å; L266-L298 HydrophobicContact CD1-CB 3.96Å; L266-L298 HydrophobicContact CD1-CD1 3.75Å; L266-L298 HydrophobicContact CD2-CB 4.3Å; K295-L298 HydrophobicContact CB-CD1 4.45Å; K295-L298 HydrophobicContact CB-CG 4.47Å; K295-L298 PolarHBondContact O-N 3.38Å; P296-L298 PolarHBondContact O-N 3.37Å; P296-L298 VanDerWaalsContact O-N 3.13Å; L298-I300 VanDerWaalsContact C-N 3.33Å
299M88.9Confident87.7Confident1 Ų143.9 Ų43.91%0.00525%0.245CC..G310 helixtrans-83.2-6.4177.2-159.359.665.700113.4L266 L269 L285 L290 M293 P296 T297 D301 F302 L303L266-M299 HydrophobicContact CD2-CE 4.27Å; L269-M299 HydrophobicContact CD1-CE 3.63Å; L269-M299 HydrophobicContact CD1-SD 3.55Å; L269-M299 VanDerWaalsContact CD1-SD 3.55Å; L285-M299 HydrophobicContact CD1-CE 4.34Å; L285-M299 HydrophobicContact CD1-CG 4.43Å; L285-M299 HydrophobicContact CD1-SD 4.42Å; L285-M299 HydrophobicContact CD2-CG 4.37Å; L290-M299 HydrophobicContact CD2-CB 4.14Å; L290-M299 HydrophobicContact CD2-CG 4.21Å; M293-M299 HydrophobicContact CE-CE 3.34Å; M293-M299 HydrophobicContact SD-CE 3.75Å; P296-M299 VanDerWaalsContact O-CB 3.29Å; P296-M299 WeakPolarHBondContact O-CB 3.26Å; P296-M299 PolarHBondContact O-N 3.28Å; T297-M299 PolarHBondContact O-N 2.73Å; T297-M299 VanDerWaalsContact O-N 3.09Å; M299-D301 PolarHBondContact O-N 3.3Å; M299-F302 HydrophobicContact CG-CB 4.49Å; M299-F302 HydrophobicContact CG-CD1 4.16Å; M299-F302 PolarHBondContact O-N 3.39Å; M299-F302 HydrophobicContact SD-CB 3.77Å; M299-F302 HydrophobicContact SD-CD1 3.49Å; M299-F302 WeakPolarHBondContact SD-CD1 3.27Å; M299-F302 HydrophobicContact SD-CE1 4.34Å; M299-F302 HydrophobicContact SD-CG 3.81Å; M299-L303 HydrophobicContact CB-CD1 4.34Å; M299-L303 HydrophobicContact CG-CD1 3.9Å; M299-L303 HydrophobicContact CG-CG 3.99Å; M299-L303 WeakPolarHBondContact O-CB 3.39Å; M299-L303 PolarHBondContact O-N 2.91Å
300I88.8Confident87.4Confident41 Ų4145.5 Ų45.521%0.2126%0.262CS..Hα-helixtrans-57.1-49.1-176.7-62.8153.9000111.1T297 L298 F302 L303 T304 L324 L330T297-I300 WeakPolarHBondContact O-CD1 3.41Å; T297-I300 WeakPolarHBondContact O-CG1 3.34Å; T297-I300 PolarHBondContact O-N 3.09Å; L298-I300 VanDerWaalsContact C-N 3.33Å; I300-F302 VanDerWaalsContact C-N 3.28Å; I300-F302 PolarHBondContact O-N 3.3Å; I300-L303 PolarHBondContact O-N 3.42Å; I300-T304 VanDerWaalsContact O-CB 3.23Å; I300-T304 WeakPolarHBondContact O-CB 2.9Å; I300-T304 PolarHBondContact O-N 3.36Å; I300-T304 PolarHBondContact O-OG1 3.28Å; I300-L324 HydrophobicContact CG1-CD1 4.04Å; I300-L330 HydrophobicContact CD1-CD1 3.1Å; I300-L330 HydrophobicContact CD1-CG 4.43Å; I300-L330 HydrophobicContact CG1-CD1 3.45Å; I300-L330 VanDerWaalsContact CG1-CD1 3.45Å; I300-L330 HydrophobicContact CG1-CD2 4.08Å; I300-L330 HydrophobicContact CG1-CG 4.41Å; I300-L330 HydrophobicContact CG2-CD1 4.49Å; I300-L330 HydrophobicContact CG2-CD2 4.35Å
301D89.3Confident87.3Confident133 Ų13347 Ų4771%0.71128%0.278SS*.Hα-helixtrans-61.9-41.1-176.4-66.9-7.7000111.1M299 A305M299-D301 PolarHBondContact O-N 3.3Å; D301-A305 VanDerWaalsContact O-CB 3.28Å; D301-A305 WeakPolarHBondContact O-CB 3.42Å; D301-A305 PolarHBondContact O-N 2.83Å
302F90.4Very high87.1Confident30 Ų3045.4 Ų45.413%0.13227%0.27CS..Hα-helixtrans-65.1-47.6176.5173.2-96.3000111.9L269 Y278 L282 M299 I300 A305 A306L269-F302 HydrophobicContact CB-CD2 4.22Å; L269-F302 HydrophobicContact CB-CE2 4.27Å; L269-F302 HydrophobicContact CD1-CD1 4.42Å; L269-F302 HydrophobicContact CD1-CD2 4.39Å; L269-F302 HydrophobicContact CD1-CE1 4.46Å; L269-F302 HydrophobicContact CD1-CE2 4.4Å; L269-F302 HydrophobicContact CD1-CG 4.39Å; L269-F302 HydrophobicContact CD1-CZ 4.46Å; L269-F302 HydrophobicContact CD2-CE2 3.82Å; L269-F302 HydrophobicContact CD2-CZ 3.89Å; L269-F302 HydrophobicContact CG-CE2 4.38Å; Y278-F302 HydrophobicContact CD2-CE2 4.29Å; Y278-F302 HydrophobicContact CD2-CZ 4.21Å; Y278-F302 HydrophobicContact CE2-CD2 4.46Å; Y278-F302 AromaticContact CE2-CE2 3.35Å; Y278-F302 HydrophobicContact CE2-CE2 3.35Å; Y278-F302 AromaticContact CE2-CZ 3.47Å; Y278-F302 HydrophobicContact CE2-CZ 3.47Å; Y278-F302 VanDerWaalsContact CE2-CZ 3.47Å; Y278-F302 AromaticContact CZ-CE2 3.82Å; Y278-F302 AromaticContact CZ-CZ 3.71Å; L282-F302 HydrophobicContact CD2-CE1 3.83Å; L282-F302 HydrophobicContact CD2-CZ 4.43Å; M299-F302 HydrophobicContact CG-CB 4.49Å; M299-F302 HydrophobicContact CG-CD1 4.16Å; M299-F302 PolarHBondContact O-N 3.39Å; M299-F302 HydrophobicContact SD-CB 3.77Å; M299-F302 HydrophobicContact SD-CD1 3.49Å; M299-F302 WeakPolarHBondContact SD-CD1 3.27Å; M299-F302 HydrophobicContact SD-CE1 4.34Å; M299-F302 HydrophobicContact SD-CG 3.81Å; I300-F302 VanDerWaalsContact C-N 3.28Å; I300-F302 PolarHBondContact O-N 3.3Å; F302-A305 PolarHBondContact O-N 3.04Å; F302-A306 WeakPolarHBondContact O-CB 3.46Å; F302-A306 PolarHBondContact O-N 3.35Å
303L89.6Confident87.1Confident0 Ų044.9 Ų44.90%027%0.268CS..Hα-helixtrans-68.5-36-179.9-82.3169.2000112.6L282 L285 M299 I300 A306 Y307 A317 L321 L324L282-L303 HydrophobicContact CD2-CD2 4.05Å; L285-L303 HydrophobicContact CD2-CD1 4.08Å; L285-L303 HydrophobicContact CD2-CD2 3.54Å; L285-L303 HydrophobicContact CD2-CG 4.01Å; M299-L303 HydrophobicContact CB-CD1 4.34Å; M299-L303 HydrophobicContact CG-CD1 3.9Å; M299-L303 HydrophobicContact CG-CG 3.99Å; M299-L303 WeakPolarHBondContact O-CB 3.39Å; M299-L303 PolarHBondContact O-N 2.91Å; I300-L303 PolarHBondContact O-N 3.42Å; L303-A306 WeakPolarHBondContact O-CB 3.45Å; L303-A306 PolarHBondContact O-N 3.15Å; L303-Y307 WeakPolarHBondContact O-CB 3.47Å; L303-Y307 PolarHBondContact O-N 3.27Å; L303-A317 HydrophobicContact CD2-CB 4.06Å; L303-L321 HydrophobicContact CB-CD2 3.7Å; L303-L321 HydrophobicContact CB-CG 4.04Å; L303-L321 HydrophobicContact CD1-CD2 4.37Å; L303-L324 HydrophobicContact CD1-CD1 3.53Å; L303-L324 HydrophobicContact CD1-CG 4.33Å
304T88.1Confident87.2Confident32 Ų3244.5 Ų44.520%0.19627%0.266CS..Hα-helixtrans-65.5-47.7175-57.90000109.9I300 A306 Y307 D308 Y332I300-T304 VanDerWaalsContact O-CB 3.23Å; I300-T304 WeakPolarHBondContact O-CB 2.9Å; I300-T304 PolarHBondContact O-N 3.36Å; I300-T304 PolarHBondContact O-OG1 3.28Å; T304-A306 VanDerWaalsContact C-N 3.32Å; T304-A306 PolarHBondContact O-N 3.15Å; T304-Y307 PolarHBondContact O-N 3.44Å; T304-Y307 VanDerWaalsContact O-N 3.15Å; T304-D308 PolarHBondContact O-N 3.07Å; T304-Y332 HydrophobicContact CG2-CE2 4.08Å
305A88.6Confident87.2Confident55 Ų5543.1 Ų43.146%0.45526%0.255SS..Hα-helixtrans-59.6-43.3173.800000111.5D301 F302 Y307 D308 V309D301-A305 VanDerWaalsContact O-CB 3.28Å; D301-A305 WeakPolarHBondContact O-CB 3.42Å; D301-A305 PolarHBondContact O-N 2.83Å; F302-A305 PolarHBondContact O-N 3.04Å; A305-Y307 VanDerWaalsContact C-N 3.29Å; A305-Y307 PolarHBondContact O-N 3.37Å; A305-D308 PolarHBondContact O-N 3.33Å; A305-V309 WeakPolarHBondContact O-CG2 3.14Å; A305-V309 PolarHBondContact O-N 3.38Å
306A89.1Confident87.2Confident0 Ų037 Ų370%023%0.229CC..Hα-helixtrans-60.5-39.717600000112.2Y278 L282 F302 L303 T304 V309 I313 A317Y278-A306 HydrophobicContact CE1-CB 3.97Å; Y278-A306 WeakPolarHBondContact OH-CA 3.32Å; Y278-A306 WeakPolarHBondContact OH-CB 3.42Å; L282-A306 HydrophobicContact CD1-CB 4.33Å; L282-A306 HydrophobicContact CD2-CB 4.26Å; F302-A306 WeakPolarHBondContact O-CB 3.46Å; F302-A306 PolarHBondContact O-N 3.35Å; L303-A306 WeakPolarHBondContact O-CB 3.45Å; L303-A306 PolarHBondContact O-N 3.15Å; T304-A306 VanDerWaalsContact C-N 3.32Å; T304-A306 PolarHBondContact O-N 3.15Å; A306-V309 PolarHBondContact O-N 2.93Å; A306-I313 HydrophobicContact CB-CG2 4.33Å; A306-I313 WeakPolarHBondContact O-CG2 3.4Å; A306-A317 HydrophobicContact CB-CB 3.69Å
307Y87.8Confident87.4Confident10 Ų1036.7 Ų36.74%0.03923%0.227CC..Hα-helixtrans-71.7-33.2-179.2-170.7-113.5000112.6L303 T304 A305 V309 S314 L318 L321 Y332 K338 L339 L342L303-Y307 WeakPolarHBondContact O-CB 3.47Å; L303-Y307 PolarHBondContact O-N 3.27Å; T304-Y307 PolarHBondContact O-N 3.44Å; T304-Y307 VanDerWaalsContact O-N 3.15Å; A305-Y307 VanDerWaalsContact C-N 3.29Å; A305-Y307 PolarHBondContact O-N 3.37Å; Y307-V309 VanDerWaalsContact C-N 3.31Å; Y307-V309 PolarHBondContact O-N 2.62Å; Y307-S314 WeakPolarHBondContact CD2-O 3.48Å; Y307-S314 WeakPolarHBondContact O-CB 3.39Å; Y307-S314 PolarHBondContact O-OG 3.07Å; Y307-L318 HydrophobicContact CE2-CB 4.46Å; Y307-L318 HydrophobicContact CE2-CD1 4.06Å; Y307-L321 HydrophobicContact CD1-CD1 4.26Å; Y307-L321 HydrophobicContact CD2-CD1 4.09Å; Y307-L321 HydrophobicContact CG-CD1 3.86Å; Y307-Y332 HydrophobicContact CE1-CE1 4.49Å; Y307-K338 HydrophobicContact CD1-CD 3.86Å; Y307-K338 HydrophobicContact CE1-CB 3.42Å; Y307-K338 VanDerWaalsContact CE1-CB 3.42Å; Y307-K338 HydrophobicContact CE1-CD 3.48Å; Y307-K338 VanDerWaalsContact CE1-CD 3.48Å; Y307-K338 HydrophobicContact CE1-CG 4.1Å; Y307-K338 VanDerWaalsContact OH-C 3.23Å; Y307-K338 WeakPolarHBondContact OH-CB 3.42Å; Y307-K338 PolarHBondContact OH-O 3.42Å; Y307-L339 PolarHBondContact OH-N 3.17Å; Y307-L342 HydrophobicContact CE2-CD2 4.25Å
308D86.1Confident87.4Confident95 Ų9533.9 Ų33.951%0.50821%0.21SC..Hα-helixtrans-77.3-12.2177.5-67.1-26000113.6T304 A305 G310 K338T304-D308 PolarHBondContact O-N 3.07Å; A305-D308 PolarHBondContact O-N 3.33Å; D308-G310 VanDerWaalsContact C-N 3.33Å; D308-G310 PolarHBondContact O-N 3.18Å; D308-K338 IonicContact OD1-NZ 2.73Å; D308-K338 PolarHBondContact OD1-NZ 2.9Å; D308-K338 IonicContact OD2-NZ 3.94Å
309V85.3Confident87.3Confident94 Ų9430.7 Ų30.757%0.5719%0.193SC*.THydrogen-bonded Turntrans-65.5-33.5176.6176.20000112.7A305 A306 Y307 I313A305-V309 WeakPolarHBondContact O-CG2 3.14Å; A305-V309 PolarHBondContact O-N 3.38Å; A306-V309 PolarHBondContact O-N 2.93Å; Y307-V309 VanDerWaalsContact C-N 3.31Å; Y307-V309 PolarHBondContact O-N 2.62Å; V309-I313 HydrophobicContact CB-CG2 4.42Å; V309-I313 HydrophobicContact CG1-CD1 4.08Å
310G81.3Confident87.2Confident34 Ų3430.7 Ų30.735%0.35119%0.194SC..  trans90.3165.3-176.800000114.9D308 S314D308-G310 VanDerWaalsContact C-N 3.33Å; D308-G310 PolarHBondContact O-N 3.18Å; G310-S314 VanDerWaalsContact C-OG 3.28Å; G310-S314 WeakPolarHBondContact CA-OG 3.47Å; G310-S314 PolarHBondContact N-OG 3.17Å
311G83.5Confident87.1Confident34 Ų3428.8 Ų28.835%0.35118%0.184SC..THydrogen-bonded Turntrans67.1-141.1174.100000114.6I313 S314 L315G311-I313 PolarHBondContact O-N 3.07Å; G311-S314 PolarHBondContact O-N 3.03Å; G311-L315 PolarHBondContact O-N 3.12Å
312A83.2Confident87Confident26 Ų2624.1 Ų24.122%0.21516%0.157CC..Hα-helixtrans-63.5-24.1-17500000114.2L316 V350A312-L316 WeakPolarHBondContact O-CG 3.35Å; A312-L316 PolarHBondContact O-N 2.87Å; A312-V350 HydrophobicContact CB-CG1 3.94Å
313I87.4Confident86.8Confident19 Ų1923.3 Ų23.310%0.09716%0.155CC..Hα-helixtrans-74-44.8179.7-66.1176.9000109.9Y278 K279 L282 A306 V309 G311 L315 L316 A317Y278-I313 HydrophobicContact CD1-CD1 4.22Å; Y278-I313 HydrophobicContact CD1-CG2 3.8Å; Y278-I313 HydrophobicContact CE1-CG2 3.43Å; Y278-I313 VanDerWaalsContact CE1-CG2 3.43Å; K279-I313 HydrophobicContact CG-CG1 4.28Å; L282-I313 HydrophobicContact CD1-CG2 3.66Å; A306-I313 HydrophobicContact CB-CG2 4.33Å; A306-I313 WeakPolarHBondContact O-CG2 3.4Å; V309-I313 HydrophobicContact CB-CG2 4.42Å; V309-I313 HydrophobicContact CG1-CD1 4.08Å; G311-I313 PolarHBondContact O-N 3.07Å; I313-L315 VanDerWaalsContact C-N 3.32Å; I313-L315 PolarHBondContact O-N 2.7Å; I313-L316 PolarHBondContact O-N 2.74Å; I313-L316 VanDerWaalsContact O-N 3.15Å; I313-A317 WeakPolarHBondContact O-CB 3.45Å; I313-A317 PolarHBondContact O-N 3.23Å
314S87Confident86.6Confident1 Ų123.4 Ų23.41%0.00716%0.155CC..Hα-helixtrans-61.3-39.9175.8-55.60000112.7Y307 G310 G311 L316 A317 L318Y307-S314 WeakPolarHBondContact CD2-O 3.48Å; Y307-S314 WeakPolarHBondContact O-CB 3.39Å; Y307-S314 PolarHBondContact O-OG 3.07Å; G310-S314 VanDerWaalsContact C-OG 3.28Å; G310-S314 WeakPolarHBondContact CA-OG 3.47Å; G310-S314 PolarHBondContact N-OG 3.17Å; G311-S314 PolarHBondContact O-N 3.03Å; S314-L316 VanDerWaalsContact C-N 3.29Å; S314-L316 PolarHBondContact O-N 3.23Å; S314-A317 PolarHBondContact O-N 3.45Å; S314-L318 PolarHBondContact O-N 3.26Å
315L86.1Confident86.5Confident10 Ų1024 Ų245%0.05216%0.157CC..Hα-helixtrans-60.1-38.9175.3-67.5170.3000112.1G311 I313 L342 V350 F356G311-L315 PolarHBondContact O-N 3.12Å; I313-L315 VanDerWaalsContact C-N 3.32Å; I313-L315 PolarHBondContact O-N 2.7Å; L315-L342 HydrophobicContact CD2-CD2 3.34Å; L315-L342 HydrophobicContact CD2-CG 3.83Å; L315-L342 HydrophobicContact CG-CD2 4.09Å; L315-L342 HydrophobicContact CG-CG 4.43Å; L315-V350 HydrophobicContact CD1-CB 4.09Å; L315-V350 HydrophobicContact CD1-CG1 3.99Å; L315-V350 HydrophobicContact CD1-CG2 3.89Å; L315-F356 HydrophobicContact CD2-CB 3.88Å; L315-F356 HydrophobicContact CD2-CD1 4.07Å; L315-F356 HydrophobicContact CD2-CD2 3.21Å; L315-F356 HydrophobicContact CD2-CE1 4.47Å; L315-F356 HydrophobicContact CD2-CE2 3.71Å; L315-F356 HydrophobicContact CD2-CG 3.41Å; L315-F356 VanDerWaalsContact CD2-CG 3.41Å; L315-F356 HydrophobicContact CD2-CZ 4.3Å
316L87.3Confident86.3Confident8 Ų827.6 Ų27.64%0.04216%0.164CC..Hα-helixtrans-74.6-39.5177.3-69.5170.7000112.1K279 L282 V283 A312 I313 S314 L318 N319 Y352K279-L316 HydrophobicContact CB-CD1 4.18Å; K279-L316 HydrophobicContact CG-CD1 4.32Å; L282-L316 HydrophobicContact CB-CB 3.67Å; L282-L316 HydrophobicContact CB-CD1 4.4Å; L282-L316 HydrophobicContact CD1-CB 4.1Å; V283-L316 HydrophobicContact CG2-CD1 4.05Å; V283-L316 HydrophobicContact CG2-CD2 3.58Å; V283-L316 HydrophobicContact CG2-CG 4.45Å; A312-L316 WeakPolarHBondContact O-CG 3.35Å; A312-L316 PolarHBondContact O-N 2.87Å; I313-L316 PolarHBondContact O-N 2.74Å; I313-L316 VanDerWaalsContact O-N 3.15Å; S314-L316 VanDerWaalsContact C-N 3.29Å; S314-L316 PolarHBondContact O-N 3.23Å; L316-L318 PolarHBondContact O-N 3.31Å; L316-N319 PolarHBondContact O-N 3.25Å; L316-Y352 HydrophobicContact CD1-CD2 4.19Å; L316-Y352 HydrophobicContact CD1-CE2 3.96Å; L316-Y352 HydrophobicContact CD2-CD1 3.83Å; L316-Y352 HydrophobicContact CD2-CD2 3.79Å; L316-Y352 HydrophobicContact CD2-CE1 4.1Å; L316-Y352 HydrophobicContact CD2-CE2 4.09Å; L316-Y352 HydrophobicContact CD2-CG 3.66Å; L316-Y352 HydrophobicContact CG-CD2 4.09Å; L316-Y352 HydrophobicContact CG-CE2 4.35Å; L316-Y352 HydrophobicContact CG-CG 4.4Å
317A90.6Very high86Confident0 Ų033.1 Ų33.10%019%0.19CC..Hα-helixtrans-63.4-31.6177.300000112.5L282 L303 A306 I313 S314 N319 G320 L321L282-A317 HydrophobicContact CD2-CB 4.3Å; L303-A317 HydrophobicContact CD2-CB 4.06Å; A306-A317 HydrophobicContact CB-CB 3.69Å; I313-A317 WeakPolarHBondContact O-CB 3.45Å; I313-A317 PolarHBondContact O-N 3.23Å; S314-A317 PolarHBondContact O-N 3.45Å; A317-N319 PolarHBondContact O-N 2.82Å; A317-G320 PolarHBondContact O-N 3.06Å; A317-L321 PolarHBondContact O-N 3.17Å
318L88.1Confident85.7Confident0 Ų036.1 Ų36.10%020%0.204CC..Hα-helixtrans-54.4-35.9178.3-173.367.4000112.7Y307 S314 L316 L321 F322 F335 L339 F356 L359 F363Y307-L318 HydrophobicContact CE2-CB 4.46Å; Y307-L318 HydrophobicContact CE2-CD1 4.06Å; S314-L318 PolarHBondContact O-N 3.26Å; L316-L318 PolarHBondContact O-N 3.31Å; L318-L321 PolarHBondContact O-N 2.93Å; L318-F322 WeakPolarHBondContact O-CB 3.4Å; L318-F322 PolarHBondContact O-N 3.09Å; L318-F335 HydrophobicContact CD1-CE2 3.69Å; L318-F335 HydrophobicContact CD1-CZ 3.91Å; L318-L339 HydrophobicContact CD1-CD1 4.45Å; L318-L339 HydrophobicContact CD2-CD1 3.91Å; L318-F356 HydrophobicContact CD2-CD2 3.67Å; L318-F356 HydrophobicContact CD2-CE2 3.77Å; L318-L359 HydrophobicContact CD2-CB 4.49Å; L318-L359 HydrophobicContact CG-CD1 4.47Å; L318-F363 HydrophobicContact CD1-CE2 3.93Å; L318-F363 HydrophobicContact CD1-CZ 4.28Å; L318-F363 HydrophobicContact CD2-CE2 4.01Å; L318-F363 HydrophobicContact CG-CE2 3.9Å; L318-F363 HydrophobicContact CG-CZ 4.46Å
319N86.8Confident85.4Confident21 Ų2138 Ų3811%0.11221%0.214CC..Hα-helixtrans-69-41.3178.7-161.25.8000112.1H286 L316 A317 F322 V323 L359H286-N319 PolarHBondContact CD2-ND2 3.09Å; H286-N319 PolarHBondContact CE1-ND2 3.27Å; H286-N319 VanDerWaalsContact CE1-ND2 3.27Å; H286-N319 VanDerWaalsContact CG-ND2 3.27Å; H286-N319 PolarHBondContact ND1-ND2 3.08Å; H286-N319 PolarHBondContact NE2-ND2 3.39Å; L316-N319 PolarHBondContact O-N 3.25Å; A317-N319 PolarHBondContact O-N 2.82Å; N319-F322 WeakPolarHBondContact O-CB 3.39Å; N319-F322 PolarHBondContact O-N 3.28Å; N319-V323 PolarHBondContact O-N 3.35Å; N319-L359 HydrophobicContact CB-CD1 3.7Å
320G87.1Confident85.2Confident2 Ų234.7 Ų34.72%0.02119%0.193CC..Hα-helixtrans-64-41.4172.900000112.1A317 V323 L324A317-G320 PolarHBondContact O-N 3.06Å; G320-V323 PolarHBondContact O-N 3.04Å; G320-L324 WeakPolarHBondContact O-CG 3.45Å; G320-L324 PolarHBondContact O-N 3.32Å
321L87.5Confident85.2Confident0 Ų040.5 Ų40.50%022%0.216CC..Hα-helixtrans-63.3-40.7174.5-72.2174.1000111.7L303 Y307 A317 L318 V323 L324 I325 Y332L303-L321 HydrophobicContact CB-CD2 3.7Å; L303-L321 HydrophobicContact CB-CG 4.04Å; L303-L321 HydrophobicContact CD1-CD2 4.37Å; Y307-L321 HydrophobicContact CD1-CD1 4.26Å; Y307-L321 HydrophobicContact CD2-CD1 4.09Å; Y307-L321 HydrophobicContact CG-CD1 3.86Å; A317-L321 PolarHBondContact O-N 3.17Å; L318-L321 PolarHBondContact O-N 2.93Å; L321-V323 VanDerWaalsContact C-N 3.35Å; L321-V323 PolarHBondContact O-N 3.25Å; L321-L324 PolarHBondContact O-N 3.2Å; L321-I325 HydrophobicContact CB-CD1 4.46Å; L321-I325 WeakPolarHBondContact O-CB 2.99Å; L321-I325 WeakPolarHBondContact O-CD1 3.17Å; L321-I325 WeakPolarHBondContact O-CG1 3.41Å; L321-I325 PolarHBondContact O-N 3.03Å; L321-Y332 HydrophobicContact CD2-CD2 4.39Å; L321-Y332 HydrophobicContact CD2-CE2 4.45Å
322F86.1Confident85Confident36 Ų3640.1 Ų40.116%0.15820%0.204CC..Hα-helixtrans-55.3-49.7176173.6-112.4000111.6L318 N319 L324 I325 H326 L359 L362 F363L318-F322 WeakPolarHBondContact O-CB 3.4Å; L318-F322 PolarHBondContact O-N 3.09Å; N319-F322 WeakPolarHBondContact O-CB 3.39Å; N319-F322 PolarHBondContact O-N 3.28Å; F322-L324 VanDerWaalsContact C-N 3.31Å; F322-L324 PolarHBondContact O-N 3.15Å; F322-I325 PolarHBondContact O-N 3.3Å; F322-H326 HydrophobicContact CD2-CB 4.48Å; F322-H326 HydrophobicContact CE2-CB 4.01Å; F322-H326 HydrophobicContact CZ-CB 4.03Å; F322-H326 VanDerWaalsContact O-CB 3.31Å; F322-H326 WeakPolarHBondContact O-CB 3.42Å; F322-H326 PolarHBondContact O-N 3.26Å; F322-L359 HydrophobicContact CB-CD2 4.13Å; F322-L359 HydrophobicContact CD1-CD2 3.76Å; F322-L359 HydrophobicContact CE1-CD2 4.39Å; F322-L359 HydrophobicContact CG-CD2 3.86Å; F322-L362 HydrophobicContact CE1-CD2 3.85Å; F322-L362 HydrophobicContact CE2-CD2 3.61Å; F322-L362 HydrophobicContact CE2-CG 4.23Å; F322-L362 HydrophobicContact CZ-CD2 3.2Å; F322-L362 HydrophobicContact CZ-CG 4.22Å; F322-F363 HydrophobicContact CB-CE1 4.33Å; F322-F363 HydrophobicContact CB-CZ 3.69Å; F322-F363 HydrophobicContact CD2-CD1 4.27Å; F322-F363 AromaticContact CD2-CE1 3.4Å; F322-F363 HydrophobicContact CD2-CE1 3.4Å; F322-F363 VanDerWaalsContact CD2-CE1 3.4Å; F322-F363 AromaticContact CD2-CZ 3.54Å; F322-F363 HydrophobicContact CD2-CZ 3.54Å; F322-F363 HydrophobicContact CE2-CE1 4.19Å; F322-F363 HydrophobicContact CG-CE1 4.29Å; F322-F363 AromaticContact CG-CZ 4Å; F322-F363 HydrophobicContact CG-CZ 4Å
323V86.3Confident85Confident13 Ų1343.6 Ų43.68%0.07923%0.225CC..Hα-helixtrans-59.6-42.6178.21730000111.1H286 L290 N319 G320 L321 Q327H286-V323 HydrophobicContact CB-CG2 4.03Å; L290-V323 HydrophobicContact CB-CG1 4.41Å; L290-V323 HydrophobicContact CD1-CB 3.93Å; L290-V323 HydrophobicContact CD1-CG1 3.87Å; N319-V323 PolarHBondContact O-N 3.35Å; G320-V323 PolarHBondContact O-N 3.04Å; L321-V323 VanDerWaalsContact C-N 3.35Å; L321-V323 PolarHBondContact O-N 3.25Å; V323-Q327 HydrophobicContact CG1-CG 4.38Å; V323-Q327 VanDerWaalsContact O-CB 3.27Å; V323-Q327 WeakPolarHBondContact O-CB 3.42Å; V323-Q327 PolarHBondContact O-N 3.42Å
324L86.6Confident84.7Confident1 Ų148.2 Ų48.21%0.00525%0.25CC..Hα-helixtrans-66.9-39.8177.3-66.9-178.1000113L290 P296 I300 L303 G320 L321 F322 H328 N329 L330L290-L324 HydrophobicContact CD2-CD2 4.38Å; P296-L324 HydrophobicContact CB-CD2 3.72Å; P296-L324 WeakPolarHBondContact O-CD2 3.4Å; I300-L324 HydrophobicContact CG1-CD1 4.04Å; L303-L324 HydrophobicContact CD1-CD1 3.53Å; L303-L324 HydrophobicContact CD1-CG 4.33Å; G320-L324 WeakPolarHBondContact O-CG 3.45Å; G320-L324 PolarHBondContact O-N 3.32Å; L321-L324 PolarHBondContact O-N 3.2Å; F322-L324 VanDerWaalsContact C-N 3.31Å; F322-L324 PolarHBondContact O-N 3.15Å; L324-H328 CarbonylContact O-C 3.3Å; L324-H328 VanDerWaalsContact O-C 3.3Å; L324-H328 WeakPolarHBondContact O-CA 3.5Å; L324-H328 WeakPolarHBondContact O-CB 3.48Å; L324-H328 PolarHBondContact O-N 3.34Å; L324-H328 VanDerWaalsContact O-N 3.13Å; L324-N329 PolarHBondContact O-N 3.41Å; L324-L330 HydrophobicContact CB-CB 4.28Å; L324-L330 HydrophobicContact CB-CD2 4.35Å; L324-L330 WeakPolarHBondContact O-CB 3.47Å; L324-L330 PolarHBondContact O-N 3.4Å
325I85.9Confident84.7Confident45 Ų4549.1 Ų49.123%0.23125%0.253CS..Hα-helixtrans-66.8-47.6177.7-66.5163.1000110L321 F322 N329 L330 F335L321-I325 HydrophobicContact CB-CD1 4.46Å; L321-I325 WeakPolarHBondContact O-CB 2.99Å; L321-I325 WeakPolarHBondContact O-CD1 3.17Å; L321-I325 WeakPolarHBondContact O-CG1 3.41Å; L321-I325 PolarHBondContact O-N 3.03Å; F322-I325 PolarHBondContact O-N 3.3Å; I325-N329 VanDerWaalsContact O-CA 3.31Å; I325-N329 WeakPolarHBondContact O-CA 3.12Å; I325-N329 PolarHBondContact O-N 2.82Å; I325-L330 HydrophobicContact CG1-CB 4.28Å; I325-L330 HydrophobicContact CG1-CD2 4.38Å; I325-F335 HydrophobicContact CD1-CD2 3.95Å; I325-F335 HydrophobicContact CD1-CE2 3.99Å
326H82.9Confident84.8Confident130 Ų13051.5 Ų51.560%0.60226%0.262SS*.Hα-helixtrans-79.5-42.8-172.9-173.5-80.2000113.6F322F322-H326 HydrophobicContact CD2-CB 4.48Å; F322-H326 HydrophobicContact CE2-CB 4.01Å; F322-H326 HydrophobicContact CZ-CB 4.03Å; F322-H326 VanDerWaalsContact O-CB 3.31Å; F322-H326 WeakPolarHBondContact O-CB 3.42Å; F322-H326 PolarHBondContact O-N 3.26Å
327Q84.2Confident84.9Confident117 Ų11754 Ų5455%0.54727%0.273SS..Hα-helixtrans-95.6-25.5-174.4-59.3-178-3.400113.3V323V323-Q327 HydrophobicContact CG1-CG 4.38Å; V323-Q327 VanDerWaalsContact O-CB 3.27Å; V323-Q327 WeakPolarHBondContact O-CB 3.42Å; V323-Q327 PolarHBondContact O-N 3.42Å
328H81.6Confident84.8Confident73 Ų7357.1 Ų57.134%0.33829%0.286SS..Hα-helixtrans-116.711.5-177.6-63.2-70.7000113.4P296 T297 L324 L330P296-H328 VanDerWaalsContact CG-NE2 3.35Å; P296-H328 WeakPolarHBondContact CG-NE2 3.34Å; T297-H328 HydrophobicContact CG2-CB 4.24Å; L324-H328 CarbonylContact O-C 3.3Å; L324-H328 VanDerWaalsContact O-C 3.3Å; L324-H328 WeakPolarHBondContact O-CA 3.5Å; L324-H328 WeakPolarHBondContact O-CB 3.48Å; L324-H328 PolarHBondContact O-N 3.34Å; L324-H328 VanDerWaalsContact O-N 3.13Å; H328-L330 PolarHBondContact O-N 3.38Å
329N79.6Confident84.9Confident134 Ų13457.1 Ų57.172%0.71729%0.286SS*.  trans49.743.3175.9-61.735.1000112.4L324 I325 D331L324-N329 PolarHBondContact O-N 3.41Å; I325-N329 VanDerWaalsContact O-CA 3.31Å; I325-N329 WeakPolarHBondContact O-CA 3.12Å; I325-N329 PolarHBondContact O-N 2.82Å; N329-D331 PolarHBondContact O-N 2.99Å
330L81.3Confident85.1Confident25 Ų2556.1 Ų56.113%0.13128%0.281CS..  trans-72.6122.2176.6-172.287.7000110.8I300 L324 I325 H328 Y332I300-L330 HydrophobicContact CD1-CD1 3.1Å; I300-L330 HydrophobicContact CD1-CG 4.43Å; I300-L330 HydrophobicContact CG1-CD1 3.45Å; I300-L330 VanDerWaalsContact CG1-CD1 3.45Å; I300-L330 HydrophobicContact CG1-CD2 4.08Å; I300-L330 HydrophobicContact CG1-CG 4.41Å; I300-L330 HydrophobicContact CG2-CD1 4.49Å; I300-L330 HydrophobicContact CG2-CD2 4.35Å; L324-L330 HydrophobicContact CB-CB 4.28Å; L324-L330 HydrophobicContact CB-CD2 4.35Å; L324-L330 WeakPolarHBondContact O-CB 3.47Å; L324-L330 PolarHBondContact O-N 3.4Å; I325-L330 HydrophobicContact CG1-CB 4.28Å; I325-L330 HydrophobicContact CG1-CD2 4.38Å; H328-L330 PolarHBondContact O-N 3.38Å; L330-Y332 HydrophobicContact CD2-CD2 4.47Å; L330-Y332 PolarHBondContact O-N 3.17Å
331D79.7Confident85.2Confident156 Ų15658.2 Ų58.283%0.83429%0.292SS*.  trans-81.5106.4166.4-72.3-30.3000110.1N329N329-D331 PolarHBondContact O-N 2.99Å
332Y80.3Confident85.3Confident26 Ų2659.1 Ų59.110%0.10230%0.296CS..  trans-98.5113173.2-167.9-90.1000110.1T304 Y307 L321 L330 F335 K338T304-Y332 HydrophobicContact CG2-CE2 4.08Å; Y307-Y332 HydrophobicContact CE1-CE1 4.49Å; L321-Y332 HydrophobicContact CD2-CD2 4.39Å; L321-Y332 HydrophobicContact CD2-CE2 4.45Å; L330-Y332 HydrophobicContact CD2-CD2 4.47Å; L330-Y332 PolarHBondContact O-N 3.17Å; Y332-F335 HydrophobicContact CD1-CB 3.97Å; Y332-F335 HydrophobicContact CD1-CD2 4.11Å; Y332-K338 HydrophobicContact CE1-CD 4Å; Y332-K338 PolarHBondContact OH-NZ 3.27Å
333P82Confident85.4Confident99 Ų9957.7 Ų57.764%0.64329%0.29SS*.THydrogen-bonded Turntrans-64.5143.7-177.427.3-34000111.2F335P333-F335 PolarHBondContact O-N 2.95Å
334D82.5Confident85.5Confident116 Ų11661.7 Ų61.762%0.6231%0.308SS*.THydrogen-bonded Turntrans51.930.1177.1-60.2-32.6000114.9Y336 K337 K338D334-Y336 VanDerWaalsContact C-N 3.33Å; D334-Y336 PolarHBondContact O-N 3.06Å; D334-K337 HydrophobicContact CB-CB 4.13Å; D334-K337 WeakPolarHBondContact O-CB 3.46Å; D334-K337 PolarHBondContact O-N 3.18Å; D334-K337 VanDerWaalsContact O-N 3.08Å; D334-K338 PolarHBondContact O-N 2.88Å; D334-K338 VanDerWaalsContact O-N 3.09Å
335F86.6Confident85.6Confident19 Ų1964.9 Ų64.98%0.08333%0.329CS..Hα-helixtrans-49.6-51.3-178.6175.2-100.3000112.7L318 I325 Y332 P333 K337 K338 L339 F363L318-F335 HydrophobicContact CD1-CE2 3.69Å; L318-F335 HydrophobicContact CD1-CZ 3.91Å; I325-F335 HydrophobicContact CD1-CD2 3.95Å; I325-F335 HydrophobicContact CD1-CE2 3.99Å; Y332-F335 HydrophobicContact CD1-CB 3.97Å; Y332-F335 HydrophobicContact CD1-CD2 4.11Å; P333-F335 PolarHBondContact O-N 2.95Å; F335-K337 VanDerWaalsContact C-N 3.33Å; F335-K337 PolarHBondContact O-N 3.25Å; F335-K338 PolarHBondContact O-N 2.97Å; F335-L339 HydrophobicContact CE1-CD2 4.01Å; F335-L339 HydrophobicContact CZ-CD2 4.33Å; F335-L339 WeakPolarHBondContact O-CB 3.35Å; F335-L339 PolarHBondContact O-N 3.41Å; F335-F363 HydrophobicContact CE1-CB 4.26Å; F335-F363 AromaticContact CE1-CD1 3.66Å; F335-F363 HydrophobicContact CE1-CD1 3.66Å; F335-F363 HydrophobicContact CE1-CD2 4.12Å; F335-F363 AromaticContact CE1-CE1 3.86Å; F335-F363 HydrophobicContact CE1-CE1 3.86Å; F335-F363 HydrophobicContact CE1-CE2 4.37Å; F335-F363 AromaticContact CE1-CG 3.78Å; F335-F363 HydrophobicContact CE1-CG 3.78Å; F335-F363 HydrophobicContact CE1-CZ 4.23Å; F335-F363 HydrophobicContact CE2-CE1 4.27Å; F335-F363 HydrophobicContact CE2-CE2 4.47Å; F335-F363 HydrophobicContact CE2-CZ 4.09Å; F335-F363 AromaticContact CZ-CD1 3.69Å; F335-F363 HydrophobicContact CZ-CD1 3.69Å; F335-F363 AromaticContact CZ-CD2 3.75Å; F335-F363 HydrophobicContact CZ-CD2 3.75Å; F335-F363 AromaticContact CZ-CE1 3.45Å; F335-F363 HydrophobicContact CZ-CE1 3.45Å; F335-F363 VanDerWaalsContact CZ-CE1 3.45Å; F335-F363 AromaticContact CZ-CE2 3.58Å; F335-F363 HydrophobicContact CZ-CE2 3.58Å; F335-F363 AromaticContact CZ-CG 3.82Å; F335-F363 HydrophobicContact CZ-CG 3.82Å; F335-F363 AromaticContact CZ-CZ 3.4Å; F335-F363 HydrophobicContact CZ-CZ 3.4Å
336Y88.4Confident85.6Confident60 Ų6065.3 Ų65.324%0.23534%0.336CS..Hα-helixtrans-68.2-31.2-177.9-73.1-75.4000113.4D334 L339 Y340 F363 L364 L369 L373 F377D334-Y336 VanDerWaalsContact C-N 3.33Å; D334-Y336 PolarHBondContact O-N 3.06Å; Y336-L339 HydrophobicContact CD1-CD2 4.33Å; Y336-L339 PolarHBondContact O-N 3.19Å; Y336-Y340 VanDerWaalsContact O-CB 3.26Å; Y336-Y340 WeakPolarHBondContact O-CB 3.39Å; Y336-Y340 PolarHBondContact O-N 3.33Å; Y336-F363 HydrophobicContact CE1-CB 4.4Å; Y336-F363 PolarHBondContact OH-O 2.89Å; Y336-L364 HydrophobicContact CD1-CD2 4.4Å; Y336-L364 HydrophobicContact CE1-CD2 4.14Å; Y336-L369 HydrophobicContact CD2-CD2 4.38Å; Y336-L369 HydrophobicContact CE1-CD1 4.28Å; Y336-L369 HydrophobicContact CE1-CD2 3.86Å; Y336-L369 HydrophobicContact CE2-CD2 3.6Å; Y336-L369 VanDerWaalsContact OH-CD2 3.32Å; Y336-L369 WeakPolarHBondContact OH-CD2 3.48Å; Y336-L373 HydrophobicContact CD1-CD2 3.82Å; Y336-L373 HydrophobicContact CD2-CD2 4.15Å; Y336-L373 HydrophobicContact CE1-CD2 4.36Å; Y336-L373 HydrophobicContact CG-CD2 3.71Å; Y336-F377 HydrophobicContact CD1-CE2 4.23Å; Y336-F377 HydrophobicContact CD1-CZ 4.49Å
337K89.8Confident85.8Confident61 Ų6159.3 Ų59.327%0.26531%0.308SS..Hα-helixtrans-64-46.9174.4-171.6172.6-176.5156.90110.2D334 F335 Y340 N341 V433 D434D334-K337 HydrophobicContact CB-CB 4.13Å; D334-K337 WeakPolarHBondContact O-CB 3.46Å; D334-K337 PolarHBondContact O-N 3.18Å; D334-K337 VanDerWaalsContact O-N 3.08Å; F335-K337 VanDerWaalsContact C-N 3.33Å; F335-K337 PolarHBondContact O-N 3.25Å; K337-Y340 WeakPolarHBondContact O-CB 3.3Å; K337-Y340 PolarHBondContact O-N 3.16Å; K337-N341 VanDerWaalsContact O-CG 3.31Å; K337-N341 PolarHBondContact O-N 3.26Å; K337-N341 VanDerWaalsContact O-N 3.09Å; K337-N341 PolarHBondContact O-ND2 3.24Å; K337-V433 HydrophobicContact CG-CG1 4.46Å; K337-V433 WeakPolarHBondContact CG-O 3.41Å; K337-D434 IonicContact NZ-OD2 3.62Å; K337-D434 PolarHBondContact NZ-OD2 3.23Å
338K87.6Confident86Confident65 Ų6554 Ų5428%0.28328%0.283SS..Hα-helixtrans-68-38.4176.5-63.6-163.4-179.3-177.10112.7Y307 D308 Y332 D334 F335 Y340 N341 L342Y307-K338 HydrophobicContact CD1-CD 3.86Å; Y307-K338 HydrophobicContact CE1-CB 3.42Å; Y307-K338 VanDerWaalsContact CE1-CB 3.42Å; Y307-K338 HydrophobicContact CE1-CD 3.48Å; Y307-K338 VanDerWaalsContact CE1-CD 3.48Å; Y307-K338 HydrophobicContact CE1-CG 4.1Å; Y307-K338 VanDerWaalsContact OH-C 3.23Å; Y307-K338 WeakPolarHBondContact OH-CB 3.42Å; Y307-K338 PolarHBondContact OH-O 3.42Å; D308-K338 IonicContact OD1-NZ 2.73Å; D308-K338 PolarHBondContact OD1-NZ 2.9Å; D308-K338 IonicContact OD2-NZ 3.94Å; Y332-K338 HydrophobicContact CE1-CD 4Å; Y332-K338 PolarHBondContact OH-NZ 3.27Å; D334-K338 PolarHBondContact O-N 2.88Å; D334-K338 VanDerWaalsContact O-N 3.09Å; F335-K338 PolarHBondContact O-N 2.97Å; K338-Y340 VanDerWaalsContact C-N 3.29Å; K338-Y340 PolarHBondContact O-N 2.99Å; K338-N341 PolarHBondContact O-N 2.88Å; K338-L342 PolarHBondContact O-N 3.06Å
339L89.8Confident86.1Confident1 Ų157 Ų571%0.00530%0.297CS..Hα-helixtrans-60.7-40.4174.3-177.464.8000111.6Y307 L318 F335 Y336 L342 F356 F363 F377Y307-L339 PolarHBondContact OH-N 3.17Å; L318-L339 HydrophobicContact CD1-CD1 4.45Å; L318-L339 HydrophobicContact CD2-CD1 3.91Å; F335-L339 HydrophobicContact CE1-CD2 4.01Å; F335-L339 HydrophobicContact CZ-CD2 4.33Å; F335-L339 WeakPolarHBondContact O-CB 3.35Å; F335-L339 PolarHBondContact O-N 3.41Å; Y336-L339 HydrophobicContact CD1-CD2 4.33Å; Y336-L339 PolarHBondContact O-N 3.19Å; L339-L342 WeakPolarHBondContact O-CB 3.27Å; L339-L342 PolarHBondContact O-N 3.24Å; L339-F356 HydrophobicContact CD1-CE2 3.76Å; L339-F356 HydrophobicContact CD1-CZ 4.18Å; L339-F363 HydrophobicContact CD2-CB 4.19Å; L339-F363 HydrophobicContact CD2-CD2 4.24Å; L339-F363 HydrophobicContact CD2-CG 4.5Å; L339-F377 HydrophobicContact CB-CZ 4.17Å; L339-F377 HydrophobicContact CD2-CE1 4.25Å; L339-F377 HydrophobicContact CD2-CZ 4.07Å; L339-F377 HydrophobicContact CG-CE1 4.02Å; L339-F377 HydrophobicContact CG-CZ 4.03Å
340Y90.8Very high86.4Confident0 Ų051.9 Ų51.90%027%0.271CS..Hα-helixtrans-62.4-44.6175.8-178.7-107.4000111.7Y336 K337 K338 L342 L343 A376 F377 R380 Y428 E432 P435Y336-Y340 VanDerWaalsContact O-CB 3.26Å; Y336-Y340 WeakPolarHBondContact O-CB 3.39Å; Y336-Y340 PolarHBondContact O-N 3.33Å; K337-Y340 WeakPolarHBondContact O-CB 3.3Å; K337-Y340 PolarHBondContact O-N 3.16Å; K338-Y340 VanDerWaalsContact C-N 3.29Å; K338-Y340 PolarHBondContact O-N 2.99Å; Y340-L342 VanDerWaalsContact C-N 3.25Å; Y340-L342 PolarHBondContact O-N 2.81Å; Y340-L343 WeakPolarHBondContact O-CB 3.39Å; Y340-L343 PolarHBondContact O-N 3.45Å; Y340-L343 VanDerWaalsContact O-N 3.15Å; Y340-A376 HydrophobicContact CE2-CB 3.96Å; Y340-F377 HydrophobicContact CD2-CD1 4.28Å; Y340-F377 HydrophobicContact CD2-CE1 4.23Å; Y340-F377 HydrophobicContact CD2-CE2 4.47Å; Y340-F377 HydrophobicContact CD2-CG 4.42Å; Y340-F377 HydrophobicContact CD2-CZ 4.32Å; Y340-R380 VanDerWaalsContact CD1-NH1 3.31Å; Y340-R380 HydrophobicContact CD2-CB 4.46Å; Y340-R380 HydrophobicContact CE2-CB 3.63Å; Y340-R380 HydrophobicContact CE2-CG 4.03Å; Y340-R380 PolarHBondContact O-NE 3.37Å; Y340-Y428 PolarHBondContact OH-OH 3.32Å; Y340-E432 WeakPolarHBondContact CE1-O 3.42Å; Y340-P435 HydrophobicContact CD1-CB 4.25Å; Y340-P435 HydrophobicContact CD2-CB 4.21Å; Y340-P435 HydrophobicContact CE1-CB 4.45Å; Y340-P435 HydrophobicContact CE2-CB 4.43Å; Y340-P435 HydrophobicContact CG-CB 4.11Å
341N89.3Confident86.5Confident46 Ų4659.4 Ų59.425%0.24630%0.303CS..Hα-helixtrans-66.4-27.5177.3-65.2-39.2000113.4K337 K338 L343 V433K337-N341 VanDerWaalsContact O-CG 3.31Å; K337-N341 PolarHBondContact O-N 3.26Å; K337-N341 VanDerWaalsContact O-N 3.09Å; K337-N341 PolarHBondContact O-ND2 3.24Å; K338-N341 PolarHBondContact O-N 2.88Å; N341-L343 PolarHBondContact O-N 3.49Å; N341-V433 WeakPolarHBondContact ND2-CG1 3.48Å; N341-V433 WeakPolarHBondContact OD1-CA 3.49Å; N341-V433 PolarHBondContact OD1-O 2.98Å
342L89.5Confident86.7Confident19 Ų1954.9 Ų54.910%0.09927%0.274CS..Hα-helixtrans-68.2-20.3176.9-156.173.5000112.5Y307 L315 K338 L339 Y340 E344 V347 F356Y307-L342 HydrophobicContact CE2-CD2 4.25Å; L315-L342 HydrophobicContact CD2-CD2 3.34Å; L315-L342 HydrophobicContact CD2-CG 3.83Å; L315-L342 HydrophobicContact CG-CD2 4.09Å; L315-L342 HydrophobicContact CG-CG 4.43Å; K338-L342 PolarHBondContact O-N 3.06Å; L339-L342 WeakPolarHBondContact O-CB 3.27Å; L339-L342 PolarHBondContact O-N 3.24Å; Y340-L342 VanDerWaalsContact C-N 3.25Å; Y340-L342 PolarHBondContact O-N 2.81Å; L342-E344 VanDerWaalsContact C-N 3.32Å; L342-E344 PolarHBondContact O-N 3.28Å; L342-V347 WeakPolarHBondContact O-CG2 3.49Å; L342-F356 HydrophobicContact CD2-CD2 4.13Å; L342-F356 HydrophobicContact CD2-CE2 3.63Å; L342-F356 HydrophobicContact CD2-CZ 4.36Å
343L89.4Confident87Confident6 Ų655.4 Ų55.43%0.03128%0.277CS..  trans-7585.4173.9-65.2176.2000110.2Y340 N341 F356 F377 R380 L381 L384Y340-L343 WeakPolarHBondContact O-CB 3.39Å; Y340-L343 PolarHBondContact O-N 3.45Å; Y340-L343 VanDerWaalsContact O-N 3.15Å; N341-L343 PolarHBondContact O-N 3.49Å; L343-F356 HydrophobicContact CD2-CE1 3.53Å; L343-F356 HydrophobicContact CD2-CZ 3.62Å; L343-F356 HydrophobicContact CG-CZ 4.43Å; L343-F377 HydrophobicContact CD1-CD1 3.46Å; L343-F377 VanDerWaalsContact CD1-CD1 3.46Å; L343-F377 HydrophobicContact CD1-CE1 3.7Å; L343-R380 HydrophobicContact CB-CG 4.36Å; L343-R380 PolarHBondContact O-NE 2.93Å; L343-R380 PolarHBondContact O-NH2 3.4Å; L343-L381 HydrophobicContact CD1-CD2 4.01Å; L343-L381 HydrophobicContact CD1-CG 4.16Å; L343-L381 HydrophobicContact CD2-CD2 3.88Å; L343-L384 HydrophobicContact CB-CD1 3.88Å; L343-L384 WeakPolarHBondContact O-CD1 3.46Å
344E88.3Confident87.3Confident97 Ų9751.7 Ų51.745%0.45326%0.255SS..  trans-112.1162.1171.9-69.8-179.417900110.8L342 S346 V347L342-E344 VanDerWaalsContact C-N 3.32Å; L342-E344 PolarHBondContact O-N 3.28Å; E344-S346 PolarHBondContact O-N 3.42Å; E344-S346 VanDerWaalsContact O-N 3.07Å; E344-S346 PolarHBondContact OE2-OG 3.32Å; E344-V347 WeakPolarHBondContact O-CB 3.4Å; E344-V347 WeakPolarHBondContact O-CG2 3.38Å; E344-V347 PolarHBondContact O-N 3.18Å
345P87.6Confident87.5Confident67 Ų6751.4 Ų51.444%0.43525%0.245SC..G310 helixtrans-55-30.2175.1-24.633.6000113V347 H349 L384P345-V347 PolarHBondContact O-N 3.3Å; P345-H349 PolarHBondContact O-CD2 3.03Å; P345-L384 HydrophobicContact CB-CD2 4.48Å; P345-L384 HydrophobicContact CG-CD2 3.72Å
346S86.8Confident87.7Confident54 Ų5450.5 Ų50.538%0.37824%0.241SC..G310 helixtrans-59.7-30.2179.666.50000113.2E344 F348 H349 V350E344-S346 PolarHBondContact O-N 3.42Å; E344-S346 VanDerWaalsContact O-N 3.07Å; E344-S346 PolarHBondContact OE2-OG 3.32Å; S346-F348 VanDerWaalsContact C-N 3.27Å; S346-F348 PolarHBondContact O-N 2.95Å; S346-H349 PolarHBondContact O-N 3.11Å; S346-V350 WeakPolarHBondContact O-CG2 3.31Å; S346-V350 PolarHBondContact O-N 3.08Å
347V87.5Confident87.7Confident4 Ų447.7 Ų47.72%0.02423%0.23CC..G310 helixtrans-58.5-37.1-174.5177.30000112.3L342 E344 P345 H349 V350 F356 F357L342-V347 WeakPolarHBondContact O-CG2 3.49Å; E344-V347 WeakPolarHBondContact O-CB 3.4Å; E344-V347 WeakPolarHBondContact O-CG2 3.38Å; E344-V347 PolarHBondContact O-N 3.18Å; P345-V347 PolarHBondContact O-N 3.3Å; V347-H349 PolarHBondContact O-N 3.18Å; V347-V350 PolarHBondContact O-N 3.24Å; V347-F356 HydrophobicContact CG1-CD1 3.58Å; V347-F356 HydrophobicContact CG1-CE1 3.73Å; V347-F356 HydrophobicContact CG1-CG 4.45Å; V347-F357 HydrophobicContact CG1-CE2 3.87Å; V347-F357 HydrophobicContact CG1-CZ 4.14Å
348F87.1Confident87.7Confident5 Ų549.4 Ų49.42%0.02224%0.239CC..G310 helixtrans-69.6-17.6-178.9-59.8-52.4000114.1S346 K353 F357 L384 A388 A392 V396S346-F348 VanDerWaalsContact C-N 3.27Å; S346-F348 PolarHBondContact O-N 2.95Å; F348-K353 VanDerWaalsContact O-CD 3.3Å; F348-K353 WeakPolarHBondContact O-CD 3.26Å; F348-F357 AromaticContact CD1-CE2 3.94Å; F348-F357 HydrophobicContact CD1-CE2 3.94Å; F348-F357 AromaticContact CD1-CZ 3.94Å; F348-F357 HydrophobicContact CD1-CZ 3.94Å; F348-F357 HydrophobicContact CE1-CE1 4.39Å; F348-F357 AromaticContact CE1-CE2 3.9Å; F348-F357 HydrophobicContact CE1-CE2 3.9Å; F348-F357 AromaticContact CE1-CZ 3.43Å; F348-F357 HydrophobicContact CE1-CZ 3.43Å; F348-F357 VanDerWaalsContact CE1-CZ 3.43Å; F348-F357 HydrophobicContact CZ-CZ 4.4Å; F348-L384 HydrophobicContact CE2-CB 3.71Å; F348-L384 HydrophobicContact CZ-CB 4.08Å; F348-A388 HydrophobicContact CD2-CB 3.62Å; F348-A388 HydrophobicContact CE2-CB 3.68Å; F348-A388 HydrophobicContact CG-CB 4.15Å; F348-A388 HydrophobicContact CZ-CB 4.3Å; F348-A392 HydrophobicContact CB-CB 3.93Å; F348-A392 HydrophobicContact CD1-CB 3.62Å; F348-A392 HydrophobicContact CE1-CB 4.31Å; F348-A392 HydrophobicContact CG-CB 3.88Å; F348-V396 HydrophobicContact CD1-CG2 4.37Å; F348-V396 HydrophobicContact CE1-CG2 3.38Å; F348-V396 HydrophobicContact CZ-CG2 3.8Å
349H84.8Confident87.7Confident136 Ų13646.7 Ų46.763%0.6323%0.227SC*.G310 helixtrans-100.5-6-179.6-59.3-76.1000112.9P345 S346 V347P345-H349 PolarHBondContact O-CD2 3.03Å; S346-H349 PolarHBondContact O-N 3.11Å; V347-H349 PolarHBondContact O-N 3.18Å
350V84.8Confident87.7Confident28 Ų2846.9 Ų46.917%0.1723%0.229CC..SBendtrans-77.7139.7179.7-173.70000110.8A312 L315 S346 V347 Y352 K353A312-V350 HydrophobicContact CB-CG1 3.94Å; L315-V350 HydrophobicContact CD1-CB 4.09Å; L315-V350 HydrophobicContact CD1-CG1 3.99Å; L315-V350 HydrophobicContact CD1-CG2 3.89Å; S346-V350 WeakPolarHBondContact O-CG2 3.31Å; S346-V350 PolarHBondContact O-N 3.08Å; V347-V350 PolarHBondContact O-N 3.24Å; V350-Y352 HydrophobicContact CG1-CD2 4.25Å; V350-Y352 PolarHBondContact O-N 3.2Å; V350-Y352 VanDerWaalsContact O-N 3.12Å; V350-K353 WeakPolarHBondContact O-CB 3.45Å; V350-K353 PolarHBondContact O-N 3.1Å
351K84.3Confident87.7Confident183 Ų18348.5 Ų48.580%0.79624%0.238SC*.THydrogen-bonded Turntrans-54.3-31.5177.2-176.6172.2-179175.20113.9
352Y83.9Confident87.6Confident61 Ų6150 Ų5024%0.23925%0.245CC..THydrogen-bonded Turntrans-97.917.8-174.7-52.5-75.1000113.7V283 L316 V350 A354 R355 F356V283-Y352 HydrophobicContact CG2-CE1 3.79Å; L316-Y352 HydrophobicContact CD1-CD2 4.19Å; L316-Y352 HydrophobicContact CD1-CE2 3.96Å; L316-Y352 HydrophobicContact CD2-CD1 3.83Å; L316-Y352 HydrophobicContact CD2-CD2 3.79Å; L316-Y352 HydrophobicContact CD2-CE1 4.1Å; L316-Y352 HydrophobicContact CD2-CE2 4.09Å; L316-Y352 HydrophobicContact CD2-CG 3.66Å; L316-Y352 HydrophobicContact CG-CD2 4.09Å; L316-Y352 HydrophobicContact CG-CE2 4.35Å; L316-Y352 HydrophobicContact CG-CG 4.4Å; V350-Y352 HydrophobicContact CG1-CD2 4.25Å; V350-Y352 PolarHBondContact O-N 3.2Å; V350-Y352 VanDerWaalsContact O-N 3.12Å; Y352-A354 VanDerWaalsContact C-N 3.31Å; Y352-A354 PolarHBondContact O-N 2.9Å; Y352-R355 PolarHBondContact O-N 3.2Å; Y352-F356 PolarHBondContact O-N 3.04Å
353K87.2Confident87.6Confident37 Ų3749.7 Ų49.716%0.16124%0.243CC..Hα-helixtrans-56.6-40-178.367.3-176.2-177.2173.60113.6F348 V350 R355 F356 F357F348-K353 VanDerWaalsContact O-CD 3.3Å; F348-K353 WeakPolarHBondContact O-CD 3.26Å; V350-K353 WeakPolarHBondContact O-CB 3.45Å; V350-K353 PolarHBondContact O-N 3.1Å; K353-R355 PolarHBondContact O-N 3.2Å; K353-F356 WeakPolarHBondContact O-CB 3.48Å; K353-F356 PolarHBondContact O-N 3.37Å; K353-F356 VanDerWaalsContact O-N 3.15Å; K353-F357 HydrophobicContact CB-CD2 4.41Å; K353-F357 VanDerWaalsContact O-CD2 3.3Å; K353-F357 WeakPolarHBondContact O-CD2 3.48Å; K353-F357 PolarHBondContact O-N 2.87Å
354A87.8Confident87.5Confident21 Ų2149.5 Ų49.517%0.17424%0.242CC..Hα-helixtrans-57.4-48.7179.900000111.5Y352 F356 F357 H358 L481 E482Y352-A354 VanDerWaalsContact C-N 3.31Å; Y352-A354 PolarHBondContact O-N 2.9Å; A354-F356 VanDerWaalsContact C-N 3.34Å; A354-F356 PolarHBondContact O-N 3.31Å; A354-F357 PolarHBondContact O-N 3.05Å; A354-H358 WeakPolarHBondContact O-CB 3.44Å; A354-H358 PolarHBondContact O-N 3.36Å; A354-L481 HydrophobicContact CB-CB 4.12Å; A354-L481 WeakPolarHBondContact CB-O 3.43Å; A354-E482 HydrophobicContact CB-CG 4.44Å
355R87.1Confident87.4Confident109 Ų10947.4 Ų47.441%0.41124%0.238SC..Hα-helixtrans-62.1-41.8176.7-65.7-175.5178.9-166.3-5.8111.9Y352 K353 L359Y352-R355 PolarHBondContact O-N 3.2Å; K353-R355 PolarHBondContact O-N 3.2Å; R355-L359 WeakPolarHBondContact O-CG 3.34Å; R355-L359 PolarHBondContact O-N 3.44Å; R355-L359 VanDerWaalsContact O-N 3.07Å
356F89.3Confident87.3Confident1 Ų146.3 Ų46.30%0.00423%0.232CC..Hα-helixtrans-62.4-49.9177.5170.1-104.6000112.1L315 L318 L339 L342 L343 V347 Y352 K353 A354 H358 L359 A360L315-F356 HydrophobicContact CD2-CB 3.88Å; L315-F356 HydrophobicContact CD2-CD1 4.07Å; L315-F356 HydrophobicContact CD2-CD2 3.21Å; L315-F356 HydrophobicContact CD2-CE1 4.47Å; L315-F356 HydrophobicContact CD2-CE2 3.71Å; L315-F356 HydrophobicContact CD2-CG 3.41Å; L315-F356 VanDerWaalsContact CD2-CG 3.41Å; L315-F356 HydrophobicContact CD2-CZ 4.3Å; L318-F356 HydrophobicContact CD2-CD2 3.67Å; L318-F356 HydrophobicContact CD2-CE2 3.77Å; L339-F356 HydrophobicContact CD1-CE2 3.76Å; L339-F356 HydrophobicContact CD1-CZ 4.18Å; L342-F356 HydrophobicContact CD2-CD2 4.13Å; L342-F356 HydrophobicContact CD2-CE2 3.63Å; L342-F356 HydrophobicContact CD2-CZ 4.36Å; L343-F356 HydrophobicContact CD2-CE1 3.53Å; L343-F356 HydrophobicContact CD2-CZ 3.62Å; L343-F356 HydrophobicContact CG-CZ 4.43Å; V347-F356 HydrophobicContact CG1-CD1 3.58Å; V347-F356 HydrophobicContact CG1-CE1 3.73Å; V347-F356 HydrophobicContact CG1-CG 4.45Å; Y352-F356 PolarHBondContact O-N 3.04Å; K353-F356 WeakPolarHBondContact O-CB 3.48Å; K353-F356 PolarHBondContact O-N 3.37Å; K353-F356 VanDerWaalsContact O-N 3.15Å; A354-F356 VanDerWaalsContact C-N 3.34Å; A354-F356 PolarHBondContact O-N 3.31Å; F356-H358 VanDerWaalsContact C-N 3.33Å; F356-H358 PolarHBondContact O-N 3Å; F356-L359 PolarHBondContact O-N 3.29Å; F356-A360 HydrophobicContact CZ-CB 4.4Å; F356-A360 WeakPolarHBondContact O-CB 3.37Å; F356-A360 PolarHBondContact O-N 3.21Å
357F89.8Confident87Confident1 Ų148.4 Ų48.40%0.00425%0.247CC..Hα-helixtrans-69-31.1-179.4-80.2-74000112.8V347 F348 K353 A354 A360 N361 L381 M395 V396 F399 L481V347-F357 HydrophobicContact CG1-CE2 3.87Å; V347-F357 HydrophobicContact CG1-CZ 4.14Å; F348-F357 AromaticContact CD1-CE2 3.94Å; F348-F357 HydrophobicContact CD1-CE2 3.94Å; F348-F357 AromaticContact CD1-CZ 3.94Å; F348-F357 HydrophobicContact CD1-CZ 3.94Å; F348-F357 HydrophobicContact CE1-CE1 4.39Å; F348-F357 AromaticContact CE1-CE2 3.9Å; F348-F357 HydrophobicContact CE1-CE2 3.9Å; F348-F357 AromaticContact CE1-CZ 3.43Å; F348-F357 HydrophobicContact CE1-CZ 3.43Å; F348-F357 VanDerWaalsContact CE1-CZ 3.43Å; F348-F357 HydrophobicContact CZ-CZ 4.4Å; K353-F357 HydrophobicContact CB-CD2 4.41Å; K353-F357 VanDerWaalsContact O-CD2 3.3Å; K353-F357 WeakPolarHBondContact O-CD2 3.48Å; K353-F357 PolarHBondContact O-N 2.87Å; A354-F357 PolarHBondContact O-N 3.05Å; F357-A360 PolarHBondContact O-N 3.21Å; F357-N361 WeakPolarHBondContact O-CB 3.42Å; F357-N361 PolarHBondContact O-N 3.3Å; F357-L381 HydrophobicContact CE1-CD2 3.95Å; F357-L381 HydrophobicContact CZ-CD2 4.47Å; F357-M395 HydrophobicContact CB-SD 3.62Å; F357-M395 HydrophobicContact CD1-SD 4.29Å; F357-M395 HydrophobicContact CD2-SD 3.39Å; F357-M395 WeakPolarHBondContact CD2-SD 3.33Å; F357-M395 HydrophobicContact CE2-SD 4.15Å; F357-M395 HydrophobicContact CG-SD 3.49Å; F357-M395 WeakPolarHBondContact CG-SD 3.21Å; F357-V396 HydrophobicContact CE1-CG2 4.49Å; F357-V396 HydrophobicContact CZ-CG2 4.48Å; F357-F399 HydrophobicContact CD1-CD2 4.39Å; F357-F399 HydrophobicContact CD1-CE2 4.31Å; F357-L481 HydrophobicContact CB-CD2 3.62Å
358H89.5Confident86.8Confident96 Ų9656.4 Ų56.444%0.44428%0.283SS..Hα-helixtrans-58.3-52.2168.6-178.174.9000111.4A354 F356 N361 L362 L481A354-H358 WeakPolarHBondContact O-CB 3.44Å; A354-H358 PolarHBondContact O-N 3.36Å; F356-H358 VanDerWaalsContact C-N 3.33Å; F356-H358 PolarHBondContact O-N 3Å; H358-N361 WeakPolarHBondContact O-CB 2.98Å; H358-N361 PolarHBondContact O-N 3.31Å; H358-L362 PolarHBondContact O-N 3.28Å; H358-L362 VanDerWaalsContact O-N 3.15Å; H358-L481 HydrophobicContact CB-CD1 3.79Å
359L88.2Confident86.8Confident8 Ų857 Ų574%0.04229%0.287CS..Hα-helixtrans-64.3-42.3178.1-69.1171.8000111.8L318 N319 F322 R355 F356 N361 L362 F363L318-L359 HydrophobicContact CD2-CB 4.49Å; L318-L359 HydrophobicContact CG-CD1 4.47Å; N319-L359 HydrophobicContact CB-CD1 3.7Å; F322-L359 HydrophobicContact CB-CD2 4.13Å; F322-L359 HydrophobicContact CD1-CD2 3.76Å; F322-L359 HydrophobicContact CE1-CD2 4.39Å; F322-L359 HydrophobicContact CG-CD2 3.86Å; R355-L359 WeakPolarHBondContact O-CG 3.34Å; R355-L359 PolarHBondContact O-N 3.44Å; R355-L359 VanDerWaalsContact O-N 3.07Å; F356-L359 PolarHBondContact O-N 3.29Å; L359-N361 VanDerWaalsContact C-N 3.3Å; L359-N361 PolarHBondContact O-N 3.13Å; L359-L362 WeakPolarHBondContact O-CB 3.34Å; L359-L362 PolarHBondContact O-N 3.49Å; L359-L362 VanDerWaalsContact O-N 3.13Å; L359-F363 HydrophobicContact CB-CD2 4.29Å; L359-F363 HydrophobicContact CB-CE2 3.92Å; L359-F363 WeakPolarHBondContact O-CD2 3.31Å; L359-F363 WeakPolarHBondContact O-CG 3.27Å; L359-F363 PolarHBondContact O-N 2.88Å
360A89.9Confident87.1Confident5 Ų552.9 Ų52.94%0.04127%0.272CS..Hα-helixtrans-60.6-39.9177.100000111.9F356 F357 L362 F363 L364 F399F356-A360 HydrophobicContact CZ-CB 4.4Å; F356-A360 WeakPolarHBondContact O-CB 3.37Å; F356-A360 PolarHBondContact O-N 3.21Å; F357-A360 PolarHBondContact O-N 3.21Å; A360-L362 VanDerWaalsContact C-N 3.3Å; A360-L362 PolarHBondContact O-N 3.03Å; A360-F363 PolarHBondContact O-N 3.45Å; A360-L364 WeakPolarHBondContact O-CB 3.23Å; A360-L364 WeakPolarHBondContact O-CG 3.48Å; A360-L364 PolarHBondContact O-N 2.88Å; A360-F399 HydrophobicContact CB-CE2 4.31Å; A360-F399 HydrophobicContact CB-CZ 4.06Å
361N89.3Confident87.4Confident35 Ų3553.8 Ų53.819%0.18728%0.278CS..Hα-helixtrans-61.7-41.6175.3-173.830.2000111.1F357 H358 L359 L364 S365 F399 R406F357-N361 WeakPolarHBondContact O-CB 3.42Å; F357-N361 PolarHBondContact O-N 3.3Å; H358-N361 WeakPolarHBondContact O-CB 2.98Å; H358-N361 PolarHBondContact O-N 3.31Å; L359-N361 VanDerWaalsContact C-N 3.3Å; L359-N361 PolarHBondContact O-N 3.13Å; N361-L364 CarbonylContact O-C 3.57Å; N361-L364 PolarHBondContact O-N 2.84Å; N361-S365 WeakPolarHBondContact O-CB 3.37Å; N361-S365 PolarHBondContact O-N 3.24Å; N361-F399 HydrophobicContact CB-CD2 4.23Å; N361-F399 HydrophobicContact CB-CE2 3.61Å; N361-F399 HydrophobicContact CB-CZ 4.42Å; N361-R406 PolarHBondContact O-NH1 3.4Å; N361-R406 PolarHBondContact OD1-NH1 2.99Å; N361-R406 PolarHBondContact OD1-NH2 3.34Å
362L88.7Confident87.7Confident76 Ų7650.1 Ų50.140%0.39826%0.26SS..Hα-helixtrans-69.6-38.3178.7-172.362.7000112.5F322 H358 L359 A360 L364 S365F322-L362 HydrophobicContact CE1-CD2 3.85Å; F322-L362 HydrophobicContact CE2-CD2 3.61Å; F322-L362 HydrophobicContact CE2-CG 4.23Å; F322-L362 HydrophobicContact CZ-CD2 3.2Å; F322-L362 HydrophobicContact CZ-CG 4.22Å; H358-L362 PolarHBondContact O-N 3.28Å; H358-L362 VanDerWaalsContact O-N 3.15Å; L359-L362 WeakPolarHBondContact O-CB 3.34Å; L359-L362 PolarHBondContact O-N 3.49Å; L359-L362 VanDerWaalsContact O-N 3.13Å; A360-L362 VanDerWaalsContact C-N 3.3Å; A360-L362 PolarHBondContact O-N 3.03Å; L362-L364 VanDerWaalsContact C-N 3.34Å; L362-S365 PolarHBondContact O-N 3.1Å; L362-S365 PolarHBondContact O-OG 3.41Å
363F87.6Confident88.1Confident14 Ų1447.5 Ų47.56%0.06125%0.25CC..Hα-helixtrans-67.9-35.1175-70.2-55.5000112.9L318 F322 F335 Y336 L339 L359 A360L318-F363 HydrophobicContact CD1-CE2 3.93Å; L318-F363 HydrophobicContact CD1-CZ 4.28Å; L318-F363 HydrophobicContact CD2-CE2 4.01Å; L318-F363 HydrophobicContact CG-CE2 3.9Å; L318-F363 HydrophobicContact CG-CZ 4.46Å; F322-F363 HydrophobicContact CB-CE1 4.33Å; F322-F363 HydrophobicContact CB-CZ 3.69Å; F322-F363 HydrophobicContact CD2-CD1 4.27Å; F322-F363 AromaticContact CD2-CE1 3.4Å; F322-F363 HydrophobicContact CD2-CE1 3.4Å; F322-F363 VanDerWaalsContact CD2-CE1 3.4Å; F322-F363 AromaticContact CD2-CZ 3.54Å; F322-F363 HydrophobicContact CD2-CZ 3.54Å; F322-F363 HydrophobicContact CE2-CE1 4.19Å; F322-F363 HydrophobicContact CG-CE1 4.29Å; F322-F363 AromaticContact CG-CZ 4Å; F322-F363 HydrophobicContact CG-CZ 4Å; F335-F363 HydrophobicContact CE1-CB 4.26Å; F335-F363 AromaticContact CE1-CD1 3.66Å; F335-F363 HydrophobicContact CE1-CD1 3.66Å; F335-F363 HydrophobicContact CE1-CD2 4.12Å; F335-F363 AromaticContact CE1-CE1 3.86Å; F335-F363 HydrophobicContact CE1-CE1 3.86Å; F335-F363 HydrophobicContact CE1-CE2 4.37Å; F335-F363 AromaticContact CE1-CG 3.78Å; F335-F363 HydrophobicContact CE1-CG 3.78Å; F335-F363 HydrophobicContact CE1-CZ 4.23Å; F335-F363 HydrophobicContact CE2-CE1 4.27Å; F335-F363 HydrophobicContact CE2-CE2 4.47Å; F335-F363 HydrophobicContact CE2-CZ 4.09Å; F335-F363 AromaticContact CZ-CD1 3.69Å; F335-F363 HydrophobicContact CZ-CD1 3.69Å; F335-F363 AromaticContact CZ-CD2 3.75Å; F335-F363 HydrophobicContact CZ-CD2 3.75Å; F335-F363 AromaticContact CZ-CE1 3.45Å; F335-F363 HydrophobicContact CZ-CE1 3.45Å; F335-F363 VanDerWaalsContact CZ-CE1 3.45Å; F335-F363 AromaticContact CZ-CE2 3.58Å; F335-F363 HydrophobicContact CZ-CE2 3.58Å; F335-F363 AromaticContact CZ-CG 3.82Å; F335-F363 HydrophobicContact CZ-CG 3.82Å; F335-F363 AromaticContact CZ-CZ 3.4Å; F335-F363 HydrophobicContact CZ-CZ 3.4Å; Y336-F363 HydrophobicContact CE1-CB 4.4Å; Y336-F363 PolarHBondContact OH-O 2.89Å; L339-F363 HydrophobicContact CD2-CB 4.19Å; L339-F363 HydrophobicContact CD2-CD2 4.24Å; L339-F363 HydrophobicContact CD2-CG 4.5Å; L359-F363 HydrophobicContact CB-CD2 4.29Å; L359-F363 HydrophobicContact CB-CE2 3.92Å; L359-F363 WeakPolarHBondContact O-CD2 3.31Å; L359-F363 WeakPolarHBondContact O-CG 3.27Å; L359-F363 PolarHBondContact O-N 2.88Å; A360-F363 PolarHBondContact O-N 3.45Å
364L88.6Confident88.4Confident1 Ų145.8 Ų45.81%0.00524%0.242CC..THydrogen-bonded Turntrans-90.72.1179.8-63.6176.3000113.3Y336 A360 N361 L362 S366 L369 F377 F399 L403Y336-L364 HydrophobicContact CD1-CD2 4.4Å; Y336-L364 HydrophobicContact CE1-CD2 4.14Å; A360-L364 WeakPolarHBondContact O-CB 3.23Å; A360-L364 WeakPolarHBondContact O-CG 3.48Å; A360-L364 PolarHBondContact O-N 2.88Å; N361-L364 CarbonylContact O-C 3.57Å; N361-L364 PolarHBondContact O-N 2.84Å; L362-L364 VanDerWaalsContact C-N 3.34Å; L364-S366 VanDerWaalsContact C-N 3.31Å; L364-L369 HydrophobicContact CD2-CD1 4Å; L364-F377 HydrophobicContact CD1-CB 4.12Å; L364-F377 HydrophobicContact CD1-CD1 4.03Å; L364-F377 HydrophobicContact CD1-CD2 4.49Å; L364-F377 HydrophobicContact CD1-CG 3.97Å; L364-F377 HydrophobicContact CD2-CD2 3.83Å; L364-F377 HydrophobicContact CD2-CE2 4.07Å; L364-F377 HydrophobicContact CD2-CG 4.15Å; L364-F399 HydrophobicContact CD1-CE1 3.92Å; L364-F399 HydrophobicContact CD1-CZ 3.93Å; L364-L403 HydrophobicContact CB-CD2 3.66Å; L364-L403 HydrophobicContact CD1-CD1 4.23Å; L364-L403 HydrophobicContact CD1-CD2 3.94Å; L364-L403 HydrophobicContact CG-CD2 4.4Å
365S86.7Confident88.6Confident54 Ų5444.8 Ų44.838%0.37823%0.234SC..THydrogen-bonded Turntrans-86-3.5169.768.60000113N361 L362 S367N361-S365 WeakPolarHBondContact O-CB 3.37Å; N361-S365 PolarHBondContact O-N 3.24Å; L362-S365 PolarHBondContact O-N 3.1Å; L362-S365 PolarHBondContact O-OG 3.41Å; S365-S367 PolarHBondContact O-N 2.84Å
366S85.4Confident89Confident44 Ų4439.6 Ų39.631%0.30821%0.214SC..  trans-65.4130177.7179.60000111.2L364 H368 L369L364-S366 VanDerWaalsContact C-N 3.31Å; S366-H368 PolarHBondContact O-N 3.13Å; S366-L369 WeakPolarHBondContact O-CG 3.34Å
367S80.3Confident89.2Confident98 Ų9839.7 Ų39.769%0.68522%0.215SC*.THydrogen-bonded Turntrans-70.1-19.1-179.754.80000113.8S365 L369S365-S367 PolarHBondContact O-N 2.84Å; S367-L369 VanDerWaalsContact C-N 3.29Å; S367-L369 PolarHBondContact O-N 3.23Å
368H83.1Confident89.4Confident171 Ų17139.7 Ų39.779%0.79222%0.215SC*.THydrogen-bonded Turntrans-88.29.4-175.5-68.3-73.7000113.9S366S366-H368 PolarHBondContact O-N 3.13Å
369L86.9Confident89.6Confident17 Ų1735.1 Ų35.19%0.08919%0.194CC..  trans-79.5132.8-178.7-59.4177.8000111.7Y336 L364 S366 S367 L373 V374Y336-L369 HydrophobicContact CD2-CD2 4.38Å; Y336-L369 HydrophobicContact CE1-CD1 4.28Å; Y336-L369 HydrophobicContact CE1-CD2 3.86Å; Y336-L369 HydrophobicContact CE2-CD2 3.6Å; Y336-L369 VanDerWaalsContact OH-CD2 3.32Å; Y336-L369 WeakPolarHBondContact OH-CD2 3.48Å; L364-L369 HydrophobicContact CD2-CD1 4Å; S366-L369 WeakPolarHBondContact O-CG 3.34Å; S367-L369 VanDerWaalsContact C-N 3.29Å; S367-L369 PolarHBondContact O-N 3.23Å; L369-L373 HydrophobicContact CB-CD2 4.47Å; L369-L373 HydrophobicContact CD2-CD2 3.95Å; L369-V374 HydrophobicContact CB-CG2 4.1Å
370P90.6Very high89.9Confident51 Ų5135.6 Ų35.633%0.33120%0.195SC..  trans-70.7146.9176.330.4-33.7000110.4Y372 L373 V374P370-Y372 VanDerWaalsContact C-N 3.28Å; P370-Y372 HydrophobicContact CB-CD1 3.63Å; P370-Y372 HydrophobicContact CB-CE1 3.33Å; P370-Y372 HydrophobicContact CG-CD1 3.96Å; P370-Y372 HydrophobicContact CG-CE1 3.31Å; P370-Y372 HydrophobicContact CG-CE2 4.25Å; P370-Y372 VanDerWaalsContact CG-CZ 3.47Å; P370-Y372 PolarHBondContact O-N 2.88Å; P370-L373 HydrophobicContact CG-CB 3.92Å; P370-L373 WeakPolarHBondContact O-CB 3.5Å; P370-L373 PolarHBondContact O-N 3.39Å; P370-V374 PolarHBondContact O-N 3.37Å
371V90.6Very high90.1Very high46 Ų4635.4 Ų35.428%0.27919%0.194SC..Hα-helixtrans-59.5-37.6-173.7-177.90000112.5L373 V374 A375 L441V371-L373 PolarHBondContact O-N 3.17Å; V371-V374 PolarHBondContact O-N 2.97Å; V371-A375 WeakPolarHBondContact O-CB 3.37Å; V371-A375 PolarHBondContact O-N 3.02Å; V371-L441 HydrophobicContact CG1-CD2 4.06Å
372Y91.5Very high90.3Very high106 Ų10633.8 Ų33.842%0.41619%0.185SC..Hα-helixtrans-58.7-36.3178.772.8-101.6000112P370 A376 A436P370-Y372 VanDerWaalsContact C-N 3.28Å; P370-Y372 HydrophobicContact CB-CD1 3.63Å; P370-Y372 HydrophobicContact CB-CE1 3.33Å; P370-Y372 HydrophobicContact CG-CD1 3.96Å; P370-Y372 HydrophobicContact CG-CE1 3.31Å; P370-Y372 HydrophobicContact CG-CE2 4.25Å; P370-Y372 VanDerWaalsContact CG-CZ 3.47Å; P370-Y372 PolarHBondContact O-N 2.88Å; Y372-A376 WeakPolarHBondContact O-CB 3.37Å; Y372-A376 PolarHBondContact O-N 3.49Å; Y372-A436 HydrophobicContact CD2-CB 4.07Å; Y372-A436 HydrophobicContact CE2-CB 3.7Å
373L92.5Very high90.6Very high7 Ų732.9 Ų32.94%0.03718%0.176CC..Hα-helixtrans-69.5-48.8-176.9-175.274.8000109.9Y336 L369 P370 V371 A375 A376 F377 P435Y336-L373 HydrophobicContact CD1-CD2 3.82Å; Y336-L373 HydrophobicContact CD2-CD2 4.15Å; Y336-L373 HydrophobicContact CE1-CD2 4.36Å; Y336-L373 HydrophobicContact CG-CD2 3.71Å; L369-L373 HydrophobicContact CB-CD2 4.47Å; L369-L373 HydrophobicContact CD2-CD2 3.95Å; P370-L373 HydrophobicContact CG-CB 3.92Å; P370-L373 WeakPolarHBondContact O-CB 3.5Å; P370-L373 PolarHBondContact O-N 3.39Å; V371-L373 PolarHBondContact O-N 3.17Å; L373-A375 VanDerWaalsContact C-N 3.3Å; L373-A375 PolarHBondContact O-N 3.42Å; L373-A376 WeakPolarHBondContact O-CB 3.3Å; L373-A376 PolarHBondContact O-N 3.26Å; L373-A376 VanDerWaalsContact O-N 3.16Å; L373-F377 HydrophobicContact CD1-CD2 4.32Å; L373-F377 HydrophobicContact CD1-CE2 3.9Å; L373-F377 HydrophobicContact CG-CD2 4.05Å; L373-F377 HydrophobicContact CG-CE2 3.96Å; L373-F377 VanDerWaalsContact O-CD2 3.26Å; L373-F377 WeakPolarHBondContact O-CD2 3.49Å; L373-F377 PolarHBondContact O-N 2.8Å; L373-P435 HydrophobicContact CD1-CB 3.76Å; L373-P435 HydrophobicContact CD1-CG 3.42Å; L373-P435 VanDerWaalsContact CD1-CG 3.42Å
374V92.9Very high90.8Very high0 Ų032.5 Ų32.50%018%0.175CC..Hα-helixtrans-61.3-41.9178.3-179.10000110.7L369 P370 V371 F377 A378 L403 H407L369-V374 HydrophobicContact CB-CG2 4.1Å; P370-V374 PolarHBondContact O-N 3.37Å; V371-V374 PolarHBondContact O-N 2.97Å; V374-F377 PolarHBondContact O-N 3.49Å; V374-A378 WeakPolarHBondContact O-CB 3.49Å; V374-A378 PolarHBondContact O-N 2.68Å; V374-L403 HydrophobicContact CG1-CB 3.99Å; V374-L403 HydrophobicContact CG1-CD2 4.37Å; V374-H407 HydrophobicContact CG1-CB 4.28Å
375A92.8Very high91.1Very high0 Ų032.5 Ų32.50%018%0.175CC..Hα-helixtrans-61.8-42.3175.100000112.3V371 L373 A378 K379 L413 A440 L441V371-A375 WeakPolarHBondContact O-CB 3.37Å; V371-A375 PolarHBondContact O-N 3.02Å; L373-A375 VanDerWaalsContact C-N 3.3Å; L373-A375 PolarHBondContact O-N 3.42Å; A375-A378 PolarHBondContact O-N 3.44Å; A375-K379 VanDerWaalsContact O-CB 3.3Å; A375-K379 WeakPolarHBondContact O-CB 3.31Å; A375-K379 PolarHBondContact O-N 2.94Å; A375-L413 HydrophobicContact CB-CD1 4.08Å; A375-A440 HydrophobicContact CB-CB 4.25Å; A375-L441 HydrophobicContact CB-CD2 3.4Å; A375-L441 VanDerWaalsContact CB-CD2 3.4Å; A375-L441 HydrophobicContact CB-CG 3.8Å
376A94.1Very high91.3Very high0 Ų033.1 Ų33.10%017%0.174CC..Hα-helixtrans-59.1-4817500000111.7Y340 Y372 L373 K379 R380 P435 C438 A440Y340-A376 HydrophobicContact CE2-CB 3.96Å; Y372-A376 WeakPolarHBondContact O-CB 3.37Å; Y372-A376 PolarHBondContact O-N 3.49Å; L373-A376 WeakPolarHBondContact O-CB 3.3Å; L373-A376 PolarHBondContact O-N 3.26Å; L373-A376 VanDerWaalsContact O-N 3.16Å; A376-K379 PolarHBondContact O-N 2.94Å; A376-R380 VanDerWaalsContact O-CB 3.29Å; A376-R380 WeakPolarHBondContact O-CB 3.39Å; A376-R380 PolarHBondContact O-N 3.5Å; A376-P435 HydrophobicContact CB-CB 3.66Å; A376-C438 WeakPolarHBondContact CB-SG 3.38Å; A376-A440 HydrophobicContact CB-CB 4.28Å
377F94.3Very high91.6Very high3 Ų335.5 Ų35.51%0.01319%0.187CC..Hα-helixtrans-61.8-47176.7-85.6-79.3000112.3Y336 L339 Y340 L343 L364 L373 V374 K379 R380 L381 L403Y336-F377 HydrophobicContact CD1-CE2 4.23Å; Y336-F377 HydrophobicContact CD1-CZ 4.49Å; L339-F377 HydrophobicContact CB-CZ 4.17Å; L339-F377 HydrophobicContact CD2-CE1 4.25Å; L339-F377 HydrophobicContact CD2-CZ 4.07Å; L339-F377 HydrophobicContact CG-CE1 4.02Å; L339-F377 HydrophobicContact CG-CZ 4.03Å; Y340-F377 HydrophobicContact CD2-CD1 4.28Å; Y340-F377 HydrophobicContact CD2-CE1 4.23Å; Y340-F377 HydrophobicContact CD2-CE2 4.47Å; Y340-F377 HydrophobicContact CD2-CG 4.42Å; Y340-F377 HydrophobicContact CD2-CZ 4.32Å; L343-F377 HydrophobicContact CD1-CD1 3.46Å; L343-F377 VanDerWaalsContact CD1-CD1 3.46Å; L343-F377 HydrophobicContact CD1-CE1 3.7Å; L364-F377 HydrophobicContact CD1-CB 4.12Å; L364-F377 HydrophobicContact CD1-CD1 4.03Å; L364-F377 HydrophobicContact CD1-CD2 4.49Å; L364-F377 HydrophobicContact CD1-CG 3.97Å; L364-F377 HydrophobicContact CD2-CD2 3.83Å; L364-F377 HydrophobicContact CD2-CE2 4.07Å; L364-F377 HydrophobicContact CD2-CG 4.15Å; L373-F377 HydrophobicContact CD1-CD2 4.32Å; L373-F377 HydrophobicContact CD1-CE2 3.9Å; L373-F377 HydrophobicContact CG-CD2 4.05Å; L373-F377 HydrophobicContact CG-CE2 3.96Å; L373-F377 VanDerWaalsContact O-CD2 3.26Å; L373-F377 WeakPolarHBondContact O-CD2 3.49Å; L373-F377 PolarHBondContact O-N 2.8Å; V374-F377 PolarHBondContact O-N 3.49Å; F377-K379 PolarHBondContact O-N 3.24Å; F377-R380 PolarHBondContact O-N 3.39Å; F377-L381 WeakPolarHBondContact O-CB 3.3Å; F377-L381 VanDerWaalsContact O-CG 3.27Å; F377-L381 WeakPolarHBondContact O-CG 3.39Å; F377-L381 PolarHBondContact O-N 2.9Å; F377-L403 HydrophobicContact CB-CD1 4.43Å
378A94.1Very high92.1Very high1 Ų131.4 Ų31.41%0.00816%0.158CC..Hα-helixtrans-60.7-46.2178.800000111.8V374 A375 L381 A382 I400 L403V374-A378 WeakPolarHBondContact O-CB 3.49Å; V374-A378 PolarHBondContact O-N 2.68Å; A375-A378 PolarHBondContact O-N 3.44Å; A378-L381 PolarHBondContact O-N 3.45Å; A378-A382 WeakPolarHBondContact O-CB 3.37Å; A378-A382 PolarHBondContact O-N 3.46Å; A378-I400 HydrophobicContact CB-CG2 4.32Å; A378-L403 HydrophobicContact CB-CD1 4.24Å
379K94.2Very high92.5Very high0 Ų024.8 Ų24.80%013%0.13CC..Hα-helixtrans-67.7-42.1179.2-177.761.4179.3-175.30112.2A375 A376 F377 A382 R383 D426 Y428 A440 S443 S444 L445 E447A375-K379 VanDerWaalsContact O-CB 3.3Å; A375-K379 WeakPolarHBondContact O-CB 3.31Å; A375-K379 PolarHBondContact O-N 2.94Å; A376-K379 PolarHBondContact O-N 2.94Å; F377-K379 PolarHBondContact O-N 3.24Å; K379-A382 PolarHBondContact O-N 3.07Å; K379-R383 PolarHBondContact O-N 3.23Å; K379-D426 IonicContact NZ-OD1 3.6Å; K379-D426 IonicContact NZ-OD2 2.76Å; K379-D426 PolarHBondContact NZ-OD2 3.13Å; K379-Y428 HydrophobicContact CB-CD2 4.34Å; K379-Y428 HydrophobicContact CB-CE2 4.09Å; K379-Y428 HydrophobicContact CD-CD1 4.44Å; K379-Y428 HydrophobicContact CD-CG 4.39Å; K379-Y428 HydrophobicContact CG-CD1 3.8Å; K379-Y428 HydrophobicContact CG-CD2 3.54Å; K379-Y428 HydrophobicContact CG-CE1 3.9Å; K379-Y428 HydrophobicContact CG-CE2 3.62Å; K379-Y428 HydrophobicContact CG-CG 3.62Å; K379-A440 HydrophobicContact CB-CB 4.04Å; K379-A440 HydrophobicContact CG-CB 4.44Å; K379-S443 WeakPolarHBondContact CD-OG 3.45Å; K379-S443 WeakPolarHBondContact CE-OG 3.31Å; K379-S443 PolarHBondContact NZ-OG 3.13Å; K379-S443 VanDerWaalsContact NZ-OG 3.08Å; K379-S444 PolarHBondContact NZ-O 3.29Å; K379-L445 HydrophobicContact CD-CD2 4.14Å; K379-E447 VanDerWaalsContact CE-OE1 3.27Å; K379-E447 WeakPolarHBondContact CE-OE1 3.2Å; K379-E447 VanDerWaalsContact NZ-CD 3.34Å; K379-E447 IonicContact NZ-OE1 2.62Å; K379-E447 PolarHBondContact NZ-OE1 3.33Å; K379-E447 IonicContact NZ-OE2 3.4Å; K379-E447 PolarHBondContact NZ-OE2 3.4Å; K379-E447 VanDerWaalsContact NZ-OE2 3.13Å
380R94.1Very high92.7Very high19 Ų1925 Ų257%0.07213%0.133CC..Hα-helixtrans-61-47175.1-172.8161.3-178.3144.7-3.3111.4Y340 L343 A376 F377 A382 R383 L384 Y428 M430Y340-R380 VanDerWaalsContact CD1-NH1 3.31Å; Y340-R380 HydrophobicContact CD2-CB 4.46Å; Y340-R380 HydrophobicContact CE2-CB 3.63Å; Y340-R380 HydrophobicContact CE2-CG 4.03Å; Y340-R380 PolarHBondContact O-NE 3.37Å; L343-R380 HydrophobicContact CB-CG 4.36Å; L343-R380 PolarHBondContact O-NE 2.93Å; L343-R380 PolarHBondContact O-NH2 3.4Å; A376-R380 VanDerWaalsContact O-CB 3.29Å; A376-R380 WeakPolarHBondContact O-CB 3.39Å; A376-R380 PolarHBondContact O-N 3.5Å; F377-R380 PolarHBondContact O-N 3.39Å; R380-A382 VanDerWaalsContact C-N 3.32Å; R380-A382 PolarHBondContact O-N 2.86Å; R380-R383 PolarHBondContact O-N 3.38Å; R380-L384 HydrophobicContact CG-CD1 4.05Å; R380-L384 HydrophobicContact CG-CG 4.45Å; R380-L384 WeakPolarHBondContact O-CB 3.43Å; R380-L384 VanDerWaalsContact O-CG 3.23Å; R380-L384 WeakPolarHBondContact O-CG 3.25Å; R380-L384 PolarHBondContact O-N 3.33Å; R380-Y428 WeakPolarHBondContact CA-OH 3.36Å; R380-Y428 WeakPolarHBondContact CB-OH 3.33Å; R380-M430 HydrophobicContact CG-CE 3.71Å; R380-M430 HydrophobicContact CG-SD 4.05Å
381L94.1Very high92.6Very high1 Ų122.8 Ų22.81%0.00512%0.118CC..Hα-helixtrans-60.8-41.2175.7-73.6173000112.1L343 F357 F377 A378 L384 A385 V396 F399 I400L343-L381 HydrophobicContact CD1-CD2 4.01Å; L343-L381 HydrophobicContact CD1-CG 4.16Å; L343-L381 HydrophobicContact CD2-CD2 3.88Å; F357-L381 HydrophobicContact CE1-CD2 3.95Å; F357-L381 HydrophobicContact CZ-CD2 4.47Å; F377-L381 WeakPolarHBondContact O-CB 3.3Å; F377-L381 VanDerWaalsContact O-CG 3.27Å; F377-L381 WeakPolarHBondContact O-CG 3.39Å; F377-L381 PolarHBondContact O-N 2.9Å; A378-L381 PolarHBondContact O-N 3.45Å; L381-L384 PolarHBondContact O-N 2.86Å; L381-A385 VanDerWaalsContact O-CB 3.3Å; L381-A385 WeakPolarHBondContact O-CB 3.47Å; L381-A385 PolarHBondContact O-N 3.1Å; L381-V396 HydrophobicContact CB-CG1 4.12Å; L381-F399 HydrophobicContact CD1-CD1 3.47Å; L381-F399 VanDerWaalsContact CD1-CD1 3.47Å; L381-F399 HydrophobicContact CD1-CE1 3.48Å; L381-F399 VanDerWaalsContact CD1-CE1 3.48Å; L381-I400 HydrophobicContact CB-CD1 4.04Å; L381-I400 HydrophobicContact CB-CG1 4.03Å; L381-I400 HydrophobicContact CD1-CG1 4.49Å
382A94.3Very high92.6Very high1 Ų120.6 Ų20.61%0.00811%0.105CC..Hα-helixtrans-63.9-40.7176.400000112.3A378 K379 R380 A385 I400 L445 E447 I448A378-A382 WeakPolarHBondContact O-CB 3.37Å; A378-A382 PolarHBondContact O-N 3.46Å; K379-A382 PolarHBondContact O-N 3.07Å; R380-A382 VanDerWaalsContact C-N 3.32Å; R380-A382 PolarHBondContact O-N 2.86Å; A382-A385 WeakPolarHBondContact O-CB 3.48Å; A382-A385 PolarHBondContact O-N 3.2Å; A382-I400 HydrophobicContact CB-CD1 4.07Å; A382-L445 HydrophobicContact CB-CD2 3.57Å; A382-E447 HydrophobicContact CB-CB 4.16Å; A382-E447 VanDerWaalsContact O-CB 3.31Å; A382-E447 WeakPolarHBondContact O-CB 3.36Å; A382-I448 HydrophobicContact CB-CG1 4.44Å
383R93.7Very high92.7Very high56 Ų5615.6 Ų15.621%0.2119%0.086CC..Hα-helixtrans-63.4-46.7174.4-164.479.298.3-158.69.7111.5K379 R380 A385 L386 D426 M430 E447K379-R383 PolarHBondContact O-N 3.23Å; R380-R383 PolarHBondContact O-N 3.38Å; R383-A385 VanDerWaalsContact C-N 3.28Å; R383-A385 PolarHBondContact O-N 2.99Å; R383-L386 WeakPolarHBondContact O-CB 3.33Å; R383-L386 PolarHBondContact O-N 3.15Å; R383-D426 IonicContact CZ-OD2 3.79Å; R383-D426 IonicContact NH1-OD2 3.02Å; R383-D426 PolarHBondContact NH1-OD2 3.41Å; R383-D426 IonicContact NH2-OD2 2.87Å; R383-D426 PolarHBondContact NH2-OD2 3.44Å; R383-M430 HydrophobicContact CB-SD 4.03Å; R383-M430 HydrophobicContact CG-CG 4.48Å; R383-M430 HydrophobicContact CG-SD 3.98Å; R383-E447 WeakPolarHBondContact CD-OE1 3.39Å; R383-E447 IonicContact CZ-OE1 2.77Å; R383-E447 IonicContact NE-OE1 3.05Å; R383-E447 IonicContact NH1-OE1 3.18Å; R383-E447 PolarHBondContact NH1-OE1 3.21Å
384L93Very high92.6Very high6 Ų616.2 Ų16.23%0.0319%0.089CC..Hα-helixtrans-65.3-32.6178.8-66.6172.8000112.2L343 P345 F348 R380 L381 L386 T387 A388 M430L343-L384 HydrophobicContact CB-CD1 3.88Å; L343-L384 WeakPolarHBondContact O-CD1 3.46Å; P345-L384 HydrophobicContact CB-CD2 4.48Å; P345-L384 HydrophobicContact CG-CD2 3.72Å; F348-L384 HydrophobicContact CE2-CB 3.71Å; F348-L384 HydrophobicContact CZ-CB 4.08Å; R380-L384 HydrophobicContact CG-CD1 4.05Å; R380-L384 HydrophobicContact CG-CG 4.45Å; R380-L384 WeakPolarHBondContact O-CB 3.43Å; R380-L384 VanDerWaalsContact O-CG 3.23Å; R380-L384 WeakPolarHBondContact O-CG 3.25Å; R380-L384 PolarHBondContact O-N 3.33Å; L381-L384 PolarHBondContact O-N 2.86Å; L384-L386 PolarHBondContact O-N 3.13Å; L384-T387 PolarHBondContact O-N 3.01Å; L384-T387 VanDerWaalsContact O-N 3.08Å; L384-T387 PolarHBondContact O-OG1 2.93Å; L384-A388 PolarHBondContact O-N 3.11Å; L384-M430 HydrophobicContact CD2-CE 3.75Å; L384-M430 HydrophobicContact CG-CE 3.98Å
385A93.4Very high92.5Very high1 Ų116.3 Ų16.31%0.0089%0.09CC..Hα-helixtrans-56.8-31.9177.900000112.6L381 A382 R383 T387 A388 L393 V396 L451L381-A385 VanDerWaalsContact O-CB 3.3Å; L381-A385 WeakPolarHBondContact O-CB 3.47Å; L381-A385 PolarHBondContact O-N 3.1Å; A382-A385 WeakPolarHBondContact O-CB 3.48Å; A382-A385 PolarHBondContact O-N 3.2Å; R383-A385 VanDerWaalsContact C-N 3.28Å; R383-A385 PolarHBondContact O-N 2.99Å; A385-T387 PolarHBondContact O-N 3.4Å; A385-T387 VanDerWaalsContact O-N 3.11Å; A385-A388 WeakPolarHBondContact O-CB 3.48Å; A385-A388 PolarHBondContact O-N 3.33Å; A385-L393 HydrophobicContact CB-CD2 3.61Å; A385-L393 WeakPolarHBondContact O-CD2 3.39Å; A385-V396 HydrophobicContact CB-CG1 4.24Å; A385-L451 HydrophobicContact CB-CD1 3.91Å
386L92.1Very high92.5Very high68 Ų6816.3 Ų16.336%0.3569%0.09SC..THydrogen-bonded Turntrans-59-26.6177.5-65.2178.5000113.9R383 L384 W446 E447 L451R383-L386 WeakPolarHBondContact O-CB 3.33Å; R383-L386 PolarHBondContact O-N 3.15Å; L384-L386 PolarHBondContact O-N 3.13Å; L386-W446 HydrophobicContact CD1-CH2 4.2Å; L386-W446 HydrophobicContact CD1-CZ3 4.15Å; L386-E447 HydrophobicContact CD1-CB 4.26Å; L386-E447 HydrophobicContact CD1-CG 3.72Å; L386-E447 HydrophobicContact CD2-CB 3.96Å; L386-E447 HydrophobicContact CD2-CG 4.35Å; L386-E447 HydrophobicContact CG-CB 4.02Å; L386-E447 HydrophobicContact CG-CG 4Å; L386-L451 HydrophobicContact CD2-CG 4.5Å
387T91.3Very high92.4Very high94 Ų9416.3 Ų16.358%0.5779%0.09SC*.THydrogen-bonded Turntrans-103.5-1.9179.3610000113.1L384 A385L384-T387 PolarHBondContact O-N 3.01Å; L384-T387 VanDerWaalsContact O-N 3.08Å; L384-T387 PolarHBondContact O-OG1 2.93Å; A385-T387 PolarHBondContact O-N 3.4Å; A385-T387 VanDerWaalsContact O-N 3.11Å
388A91.8Very high92.3Very high11 Ų1117.2 Ų17.29%0.09110%0.095CC..SBendtrans-83.4148.7-170.600000112.3F348 L384 A385 A392 L393F348-A388 HydrophobicContact CD2-CB 3.62Å; F348-A388 HydrophobicContact CE2-CB 3.68Å; F348-A388 HydrophobicContact CG-CB 4.15Å; F348-A388 HydrophobicContact CZ-CB 4.3Å; L384-A388 PolarHBondContact O-N 3.11Å; A385-A388 WeakPolarHBondContact O-CB 3.48Å; A385-A388 PolarHBondContact O-N 3.33Å; A388-A392 HydrophobicContact CB-CB 4.12Å; A388-L393 HydrophobicContact CB-CD2 4.12Å; A388-L393 HydrophobicContact CB-CG 4.22Å
389P91.4Very high92.2Very high32 Ų3217.2 Ų17.221%0.20810%0.095CC..  trans-67.9158.4172.828.5-34.6000111.7T391 A392 L393P389-T391 PolarHBondContact O-N 3Å; P389-T391 VanDerWaalsContact O-N 3.13Å; P389-A392 HydrophobicContact CG-CB 3.88Å; P389-A392 WeakPolarHBondContact O-CB 3.47Å; P389-A392 PolarHBondContact O-N 3.12Å; P389-L393 PolarHBondContact O-N 3.24Å
390P89.9Confident92.1Very high21 Ų2117.2 Ų17.214%0.13610%0.095CC..Hα-helixtrans-53.6-38.5-179.2-26.732.9000114.1A392 L393 L394 Y455 V459 L488P390-A392 VanDerWaalsContact C-N 3.3Å; P390-A392 PolarHBondContact O-N 2.83Å; P390-L393 WeakPolarHBondContact O-CB 3.48Å; P390-L393 PolarHBondContact O-N 3.04Å; P390-L394 WeakPolarHBondContact O-CG 2.94Å; P390-L394 PolarHBondContact O-N 3.23Å; P390-Y455 WeakPolarHBondContact CD-OH 3.29Å; P390-Y455 HydrophobicContact CG-CE1 4.45Å; P390-Y455 HydrophobicContact CG-CE2 4.34Å; P390-Y455 WeakPolarHBondContact CG-OH 3.18Å; P390-V459 HydrophobicContact CB-CG2 4.09Å; P390-L488 HydrophobicContact CB-CD2 4.17Å
391T89.6Confident92Very high5 Ų516.4 Ų16.43%0.0319%0.092CC..Hα-helixtrans-63-36.6177.851.60000112.5P389 L488P389-T391 PolarHBondContact O-N 3Å; P389-T391 VanDerWaalsContact O-N 3.13Å; T391-L488 HydrophobicContact CG2-CB 4.26Å; T391-L488 HydrophobicContact CG2-CD2 3.78Å
392A90.7Very high91.8Very high0 Ų016.3 Ų16.30%09%0.092CC..Hα-helixtrans-75.4-36.7174.300000111.6F348 A388 P389 P390 L394 M395 V396F348-A392 HydrophobicContact CB-CB 3.93Å; F348-A392 HydrophobicContact CD1-CB 3.62Å; F348-A392 HydrophobicContact CE1-CB 4.31Å; F348-A392 HydrophobicContact CG-CB 3.88Å; A388-A392 HydrophobicContact CB-CB 4.12Å; P389-A392 HydrophobicContact CG-CB 3.88Å; P389-A392 WeakPolarHBondContact O-CB 3.47Å; P389-A392 PolarHBondContact O-N 3.12Å; P390-A392 VanDerWaalsContact C-N 3.3Å; P390-A392 PolarHBondContact O-N 2.83Å; A392-L394 VanDerWaalsContact C-N 3.34Å; A392-L394 PolarHBondContact O-N 3.46Å; A392-M395 WeakPolarHBondContact O-CB 3.36Å; A392-M395 PolarHBondContact O-N 3.33Å; A392-M395 VanDerWaalsContact O-N 3.1Å; A392-V396 WeakPolarHBondContact O-CB 3.46Å; A392-V396 VanDerWaalsContact O-CG2 3.25Å; A392-V396 WeakPolarHBondContact O-CG2 3.41Å; A392-V396 PolarHBondContact O-N 2.82Å
393L92.1Very high91.6Very high1 Ų116.3 Ų16.31%0.0059%0.092CC..Hα-helixtrans-60.3-42.5177-72.5175.9000112.7A385 A388 P389 P390 M395 V396 L397 L451 V459A385-L393 HydrophobicContact CB-CD2 3.61Å; A385-L393 WeakPolarHBondContact O-CD2 3.39Å; A388-L393 HydrophobicContact CB-CD2 4.12Å; A388-L393 HydrophobicContact CB-CG 4.22Å; P389-L393 PolarHBondContact O-N 3.24Å; P390-L393 WeakPolarHBondContact O-CB 3.48Å; P390-L393 PolarHBondContact O-N 3.04Å; L393-M395 PolarHBondContact O-N 3.27Å; L393-V396 PolarHBondContact O-N 3.43Å; L393-L397 WeakPolarHBondContact O-CB 3.22Å; L393-L397 WeakPolarHBondContact O-CG 3.32Å; L393-L397 PolarHBondContact O-N 2.88Å; L393-L451 HydrophobicContact CD1-CD2 4.09Å; L393-L451 HydrophobicContact CD2-CD1 3.9Å; L393-L451 HydrophobicContact CD2-CD2 4.16Å; L393-V459 HydrophobicContact CB-CG1 3.9Å; L393-V459 HydrophobicContact CB-CG2 4.18Å; L393-V459 HydrophobicContact CD1-CG1 3.77Å; L393-V459 HydrophobicContact CG-CG1 4.41Å
394L91Very high91.4Very high21 Ų2113.6 Ų13.611%0.118%0.082CC..Hα-helixtrans-61.1-26.8176.5-69175.6000112.7P390 A392 P398 D458 V459 A462 V480 L488P390-L394 WeakPolarHBondContact O-CG 2.94Å; P390-L394 PolarHBondContact O-N 3.23Å; A392-L394 VanDerWaalsContact C-N 3.34Å; A392-L394 PolarHBondContact O-N 3.46Å; L394-P398 WeakPolarHBondContact O-CD 3.39Å; L394-P398 WeakPolarHBondContact O-CG 3.23Å; L394-D458 HydrophobicContact CD2-CB 4.25Å; L394-V459 HydrophobicContact CD2-CG2 3.89Å; L394-V459 HydrophobicContact CG-CG2 4.02Å; L394-A462 HydrophobicContact CD2-CB 4.5Å; L394-V480 HydrophobicContact CB-CG1 3.97Å; L394-V480 WeakPolarHBondContact O-CG1 3.33Å; L394-L488 HydrophobicContact CD1-CD1 4.03Å; L394-L488 HydrophobicContact CD1-CD2 4.49Å
395M91.1Very high91.2Very high2 Ų215.2 Ų15.21%0.019%0.087CC..Hα-helixtrans-85.2-45.5175.3179-164.9-50.300112.3F357 A392 L393 P398 F399 I477 V480 L481F357-M395 HydrophobicContact CB-SD 3.62Å; F357-M395 HydrophobicContact CD1-SD 4.29Å; F357-M395 HydrophobicContact CD2-SD 3.39Å; F357-M395 WeakPolarHBondContact CD2-SD 3.33Å; F357-M395 HydrophobicContact CE2-SD 4.15Å; F357-M395 HydrophobicContact CG-SD 3.49Å; F357-M395 WeakPolarHBondContact CG-SD 3.21Å; A392-M395 WeakPolarHBondContact O-CB 3.36Å; A392-M395 PolarHBondContact O-N 3.33Å; A392-M395 VanDerWaalsContact O-N 3.1Å; L393-M395 PolarHBondContact O-N 3.27Å; M395-P398 WeakPolarHBondContact O-CD 3.43Å; M395-F399 WeakPolarHBondContact O-CB 3.13Å; M395-F399 PolarHBondContact O-N 3.34Å; M395-I477 HydrophobicContact CG-CG2 4.1Å; M395-V480 HydrophobicContact CB-CG1 4.3Å; M395-L481 HydrophobicContact CE-CD2 4.04Å; M395-L481 WeakPolarHBondContact CE-O 3.39Å; M395-L481 HydrophobicContact CG-CD2 3.73Å; M395-L481 HydrophobicContact SD-CD2 3.51Å; M395-L481 VanDerWaalsContact SD-CD2 3.51Å
396V92.6Very high90.9Very high0 Ų017.6 Ų17.60%010%0.096CC..Hα-helixtrans-70.2-36.1-173.5171.60000111.9F348 F357 L381 A385 A392 L393 F399 I400F348-V396 HydrophobicContact CD1-CG2 4.37Å; F348-V396 HydrophobicContact CE1-CG2 3.38Å; F348-V396 HydrophobicContact CZ-CG2 3.8Å; F357-V396 HydrophobicContact CE1-CG2 4.49Å; F357-V396 HydrophobicContact CZ-CG2 4.48Å; L381-V396 HydrophobicContact CB-CG1 4.12Å; A385-V396 HydrophobicContact CB-CG1 4.24Å; A392-V396 WeakPolarHBondContact O-CB 3.46Å; A392-V396 VanDerWaalsContact O-CG2 3.25Å; A392-V396 WeakPolarHBondContact O-CG2 3.41Å; A392-V396 PolarHBondContact O-N 2.82Å; L393-V396 PolarHBondContact O-N 3.43Å; V396-F399 WeakPolarHBondContact O-CB 3.33Å; V396-F399 PolarHBondContact O-N 2.87Å; V396-I400 HydrophobicContact CG1-CD1 3.67Å; V396-I400 HydrophobicContact CG1-CG1 4.19Å; V396-I400 VanDerWaalsContact O-CG1 3.32Å; V396-I400 WeakPolarHBondContact O-CG1 3.19Å; V396-I400 PolarHBondContact O-N 3.47Å
397L92.6Very high90.7Very high0 Ų015.5 Ų15.50%08%0.084CC..Hα-helixtrans-63.6-54.2-179.6-71.5169.8000112.1L393 F399 I400 Y401 I448 L451 V459 A462 A463L393-L397 WeakPolarHBondContact O-CB 3.22Å; L393-L397 WeakPolarHBondContact O-CG 3.32Å; L393-L397 PolarHBondContact O-N 2.88Å; L397-F399 PolarHBondContact O-N 3.24Å; L397-I400 PolarHBondContact O-N 3.12Å; L397-Y401 HydrophobicContact CB-CE2 4.3Å; L397-Y401 WeakPolarHBondContact O-CD2 3.38Å; L397-Y401 PolarHBondContact O-N 3.48Å; L397-I448 HydrophobicContact CD2-CG1 4.43Å; L397-I448 HydrophobicContact CD2-CG2 4.19Å; L397-L451 HydrophobicContact CD2-CD1 4.16Å; L397-V459 HydrophobicContact CD1-CG1 4.24Å; L397-A462 HydrophobicContact CD1-CB 3.91Å; L397-A463 HydrophobicContact CD1-CB 4.1Å
398P91.1Very high90.5Very high21 Ų2114.5 Ų14.514%0.1368%0.079CC..Hα-helixtrans-57.2-36.9171.5-25.334.6000113.1L394 M395 Y401 N402 I477L394-P398 WeakPolarHBondContact O-CD 3.39Å; L394-P398 WeakPolarHBondContact O-CG 3.23Å; M395-P398 WeakPolarHBondContact O-CD 3.43Å; P398-Y401 PolarHBondContact O-N 3.5Å; P398-N402 WeakPolarHBondContact O-CB 3.26Å; P398-N402 PolarHBondContact O-N 3.37Å; P398-I477 HydrophobicContact CB-CG1 4.42Å
399F92Very high90.3Very high2 Ų217.4 Ų17.41%0.00910%0.099CC..Hα-helixtrans-59.9-49.2176.3-168.9-78000111.9F357 A360 N361 L364 L381 M395 V396 L397 Y401 N402 L403 I477F357-F399 HydrophobicContact CD1-CD2 4.39Å; F357-F399 HydrophobicContact CD1-CE2 4.31Å; A360-F399 HydrophobicContact CB-CE2 4.31Å; A360-F399 HydrophobicContact CB-CZ 4.06Å; N361-F399 HydrophobicContact CB-CD2 4.23Å; N361-F399 HydrophobicContact CB-CE2 3.61Å; N361-F399 HydrophobicContact CB-CZ 4.42Å; L364-F399 HydrophobicContact CD1-CE1 3.92Å; L364-F399 HydrophobicContact CD1-CZ 3.93Å; L381-F399 HydrophobicContact CD1-CD1 3.47Å; L381-F399 VanDerWaalsContact CD1-CD1 3.47Å; L381-F399 HydrophobicContact CD1-CE1 3.48Å; L381-F399 VanDerWaalsContact CD1-CE1 3.48Å; M395-F399 WeakPolarHBondContact O-CB 3.13Å; M395-F399 PolarHBondContact O-N 3.34Å; V396-F399 WeakPolarHBondContact O-CB 3.33Å; V396-F399 PolarHBondContact O-N 2.87Å; L397-F399 PolarHBondContact O-N 3.24Å; F399-Y401 VanDerWaalsContact C-N 3.3Å; F399-Y401 PolarHBondContact O-N 3.46Å; F399-N402 PolarHBondContact O-N 3.13Å; F399-L403 HydrophobicContact CD1-CD1 4.01Å; F399-L403 HydrophobicContact CD1-CG 4.15Å; F399-L403 HydrophobicContact CE1-CD1 3.78Å; F399-L403 HydrophobicContact CE1-CD2 4.28Å; F399-L403 HydrophobicContact CE1-CG 4.05Å; F399-L403 WeakPolarHBondContact O-CG 3.36Å; F399-L403 PolarHBondContact O-N 2.87Å; F399-I477 HydrophobicContact CB-CD1 4.02Å; F399-I477 HydrophobicContact CD2-CD1 3.85Å; F399-I477 HydrophobicContact CG-CD1 4.28Å
400I92.9Very high90.2Very high0 Ų015.9 Ų15.90%09%0.089CC..Hα-helixtrans-62-40.4176.4-66.1164.7000110.4A378 L381 A382 V396 L397 L403 I404 I448A378-I400 HydrophobicContact CB-CG2 4.32Å; L381-I400 HydrophobicContact CB-CD1 4.04Å; L381-I400 HydrophobicContact CB-CG1 4.03Å; L381-I400 HydrophobicContact CD1-CG1 4.49Å; A382-I400 HydrophobicContact CB-CD1 4.07Å; V396-I400 HydrophobicContact CG1-CD1 3.67Å; V396-I400 HydrophobicContact CG1-CG1 4.19Å; V396-I400 VanDerWaalsContact O-CG1 3.32Å; V396-I400 WeakPolarHBondContact O-CG1 3.19Å; V396-I400 PolarHBondContact O-N 3.47Å; L397-I400 PolarHBondContact O-N 3.12Å; I400-L403 WeakPolarHBondContact O-CB 3.38Å; I400-L403 PolarHBondContact O-N 3.19Å; I400-I404 HydrophobicContact CG2-CD1 3.9Å; I400-I404 WeakPolarHBondContact O-CG1 3.39Å; I400-I404 PolarHBondContact O-N 3.14Å; I400-I404 VanDerWaalsContact O-N 3.09Å; I400-I448 HydrophobicContact CD1-CD1 4.49Å; I400-I448 HydrophobicContact CG2-CD1 3.98Å
401Y91.3Very high90Very high1 Ų120.8 Ų20.80%0.00411%0.105CC..Hα-helixtrans-64.1-43.1177.7-59-23.7000112.2L397 P398 F399 L403 I404 R405 I448 A462 A463 L465 I466 M470L397-Y401 HydrophobicContact CB-CE2 4.3Å; L397-Y401 WeakPolarHBondContact O-CD2 3.38Å; L397-Y401 PolarHBondContact O-N 3.48Å; P398-Y401 PolarHBondContact O-N 3.5Å; F399-Y401 VanDerWaalsContact C-N 3.3Å; F399-Y401 PolarHBondContact O-N 3.46Å; Y401-L403 VanDerWaalsContact C-N 3.31Å; Y401-L403 PolarHBondContact O-N 3.32Å; Y401-I404 PolarHBondContact O-N 3.48Å; Y401-R405 WeakPolarHBondContact O-CB 3.4Å; Y401-R405 VanDerWaalsContact O-CG 3.28Å; Y401-R405 WeakPolarHBondContact O-CG 3.4Å; Y401-R405 PolarHBondContact O-N 2.89Å; Y401-I448 HydrophobicContact CE1-CD1 4.39Å; Y401-A462 VanDerWaalsContact CE2-O 3.24Å; Y401-A462 WeakPolarHBondContact CE2-O 3.29Å; Y401-A462 PolarHBondContact OH-O 3.05Å; Y401-A463 VanDerWaalsContact OH-CA 3.29Å; Y401-A463 WeakPolarHBondContact OH-CA 3.3Å; Y401-A463 PolarHBondContact OH-O 2.97Å; Y401-L465 HydrophobicContact CE2-CB 4.01Å; Y401-I466 HydrophobicContact CE1-CB 3.86Å; Y401-I466 HydrophobicContact CE1-CD1 4.08Å; Y401-I466 HydrophobicContact CE1-CG1 4.04Å; Y401-M470 HydrophobicContact CD1-CE 4.05Å
402N90.8Very high90Very high0 Ų024 Ų240%012%0.124CC..Hα-helixtrans-62.5-38.9176.1-73.8-10.8000111.4P398 F399 I404 R405 R406 D475 I477P398-N402 WeakPolarHBondContact O-CB 3.26Å; P398-N402 PolarHBondContact O-N 3.37Å; F399-N402 PolarHBondContact O-N 3.13Å; N402-I404 PolarHBondContact O-N 3.14Å; N402-R405 PolarHBondContact O-N 3.48Å; N402-R406 WeakPolarHBondContact O-CB 3.45Å; N402-R406 VanDerWaalsContact O-CG 3.25Å; N402-R406 WeakPolarHBondContact O-CG 3.35Å; N402-R406 PolarHBondContact O-N 3.16Å; N402-D475 PolarHBondContact ND2-O 2.93Å; N402-D475 PolarHBondContact OD1-N 2.91Å; N402-D475 VanDerWaalsContact OD1-N 3.17Å; N402-I477 WeakPolarHBondContact ND2-CD1 3.33Å
403L89.9Confident89.8Confident0 Ų024 Ų240%013%0.125CC..Hα-helixtrans-59.8-43.5173-67.8-176.7000112.6L364 V374 F377 A378 F399 I400 Y401 H407L364-L403 HydrophobicContact CB-CD2 3.66Å; L364-L403 HydrophobicContact CD1-CD1 4.23Å; L364-L403 HydrophobicContact CD1-CD2 3.94Å; L364-L403 HydrophobicContact CG-CD2 4.4Å; V374-L403 HydrophobicContact CG1-CB 3.99Å; V374-L403 HydrophobicContact CG1-CD2 4.37Å; F377-L403 HydrophobicContact CB-CD1 4.43Å; A378-L403 HydrophobicContact CB-CD1 4.24Å; F399-L403 HydrophobicContact CD1-CD1 4.01Å; F399-L403 HydrophobicContact CD1-CG 4.15Å; F399-L403 HydrophobicContact CE1-CD1 3.78Å; F399-L403 HydrophobicContact CE1-CD2 4.28Å; F399-L403 HydrophobicContact CE1-CG 4.05Å; F399-L403 WeakPolarHBondContact O-CG 3.36Å; F399-L403 PolarHBondContact O-N 2.87Å; I400-L403 WeakPolarHBondContact O-CB 3.38Å; I400-L403 PolarHBondContact O-N 3.19Å; Y401-L403 VanDerWaalsContact C-N 3.31Å; Y401-L403 PolarHBondContact O-N 3.32Å; L403-H407 PolarHBondContact O-N 3.47Å
404I89.3Confident89.6Confident0 Ų027.3 Ų27.30%014%0.141CC..Hα-helixtrans-73-34.2-179.9-62.3170.1000111.3I400 Y401 N402 H407 C410 R411 I414 L445 M470I400-I404 HydrophobicContact CG2-CD1 3.9Å; I400-I404 WeakPolarHBondContact O-CG1 3.39Å; I400-I404 PolarHBondContact O-N 3.14Å; I400-I404 VanDerWaalsContact O-N 3.09Å; Y401-I404 PolarHBondContact O-N 3.48Å; N402-I404 PolarHBondContact O-N 3.14Å; I404-H407 CarbonylContact O-C 3.28Å; I404-H407 VanDerWaalsContact O-C 3.28Å; I404-H407 PolarHBondContact O-N 3.24Å; I404-C410 HydrophobicContact CG1-CB 4.35Å; I404-R411 HydrophobicContact CG2-CG 3.94Å; I404-I414 HydrophobicContact CD1-CD1 3.92Å; I404-I414 HydrophobicContact CD1-CG1 4.24Å; I404-I414 HydrophobicContact CG2-CD1 4.03Å; I404-L445 HydrophobicContact CD1-CD1 3.72Å; I404-M470 HydrophobicContact CG2-SD 4.14Å
405R88.3Confident89.4Confident39 Ų3932.7 Ų32.715%0.14717%0.166CC..Hα-helixtrans-63.5-45.4173.5-72.9177.9-163173.916110.8Y401 N402 H407 M470 T471 Q473 D475Y401-R405 WeakPolarHBondContact O-CB 3.4Å; Y401-R405 VanDerWaalsContact O-CG 3.28Å; Y401-R405 WeakPolarHBondContact O-CG 3.4Å; Y401-R405 PolarHBondContact O-N 2.89Å; N402-R405 PolarHBondContact O-N 3.48Å; R405-H407 PolarHBondContact O-N 3Å; R405-M470 HydrophobicContact CG-CB 4.29Å; R405-M470 HydrophobicContact CG-SD 4.17Å; R405-T471 WeakPolarHBondContact CD-O 2.96Å; R405-Q473 PolarHBondContact NH1-O 2.91Å; R405-D475 IonicContact CZ-OD1 3.67Å; R405-D475 IonicContact CZ-OD2 3.41Å; R405-D475 IonicContact NH1-OD1 2.81Å; R405-D475 PolarHBondContact NH1-OD1 2.68Å; R405-D475 IonicContact NH1-OD2 3.26Å; R405-D475 PolarHBondContact NH1-OD2 2.9Å; R405-D475 IonicContact NH2-OD1 3.56Å; R405-D475 IonicContact NH2-OD2 2.8Å; R405-D475 PolarHBondContact NH2-OD2 3.1Å
406R87.3Confident88.9Confident52 Ų5235.5 Ų35.520%0.19618%0.178CC..Hα-helixtrans-64.8-36.3177-71.8173.9-173162.89.2113.3N361 N402 P408 E474N361-R406 PolarHBondContact O-NH1 3.4Å; N361-R406 PolarHBondContact OD1-NH1 2.99Å; N361-R406 PolarHBondContact OD1-NH2 3.34Å; N402-R406 WeakPolarHBondContact O-CB 3.45Å; N402-R406 VanDerWaalsContact O-CG 3.25Å; N402-R406 WeakPolarHBondContact O-CG 3.35Å; N402-R406 PolarHBondContact O-N 3.16Å; R406-P408 WeakPolarHBondContact O-CD 3.27Å; R406-E474 WeakPolarHBondContact CG-OE1 3.27Å; R406-E474 IonicContact CZ-OE1 3.84Å; R406-E474 IonicContact CZ-OE2 2.82Å; R406-E474 IonicContact NE-OE1 3.38Å; R406-E474 PolarHBondContact NE-OE1 3.25Å; R406-E474 IonicContact NE-OE2 2.68Å; R406-E474 PolarHBondContact NE-OE2 2.9Å; R406-E474 IonicContact NH2-OE1 3.48Å; R406-E474 IonicContact NH2-OE2 3.49Å; R406-E474 PolarHBondContact NH2-OE2 3.41Å
407H88.3Confident88Confident24 Ų2440.1 Ų40.111%0.11121%0.208CC..  trans-122.685.9-177.8-61.9-87.2000111.4V374 L403 I404 R405 S409 C410V374-H407 HydrophobicContact CG1-CB 4.28Å; L403-H407 PolarHBondContact O-N 3.47Å; I404-H407 CarbonylContact O-C 3.28Å; I404-H407 VanDerWaalsContact O-C 3.28Å; I404-H407 PolarHBondContact O-N 3.24Å; R405-H407 PolarHBondContact O-N 3Å; H407-S409 PolarHBondContact O-N 2.85Å; H407-C410 WeakPolarHBondContact O-CB 3.44Å; H407-C410 PolarHBondContact O-N 3.2Å
408P87.4Confident86.7Confident72 Ų7245.3 Ų45.347%0.46824%0.244SC..G310 helixtrans-56.5-26.3-177.6-27.534.8000114.7R406 C410 R411R406-P408 WeakPolarHBondContact O-CD 3.27Å; P408-C410 PolarHBondContact O-N 3.02Å; P408-R411 WeakPolarHBondContact O-CB 3.36Å; P408-R411 WeakPolarHBondContact O-CG 3.37Å; P408-R411 PolarHBondContact O-N 3.45Å
409S86.8Confident85.2Confident73 Ų7346.7 Ų46.751%0.5125%0.254SS..G310 helixtrans-60.9-22.7174.4-52.50000113.1H407 R411H407-S409 PolarHBondContact O-N 2.85Å; S409-R411 PolarHBondContact O-N 2.94Å
410C88.4Confident83.8Confident0 Ų055.4 Ų55.40%030%0.295CS..G310 helixtrans-75.9-7.4174.1-61.20000113.2I404 H407 P408 V412 L413I404-C410 HydrophobicContact CG1-CB 4.35Å; H407-C410 WeakPolarHBondContact O-CB 3.44Å; H407-C410 PolarHBondContact O-N 3.2Å; P408-C410 PolarHBondContact O-N 3.02Å; C410-V412 PolarHBondContact O-N 3.08Å; C410-V412 VanDerWaalsContact O-N 3.15Å; C410-L413 HydrophobicContact CB-CD1 4.34Å; C410-L413 VanDerWaalsContact O-CB 3.25Å; C410-L413 WeakPolarHBondContact O-CB 3.32Å; C410-L413 VanDerWaalsContact O-CG 3.31Å; C410-L413 WeakPolarHBondContact O-CG 3.39Å; C410-L413 PolarHBondContact O-N 2.73Å
411R87.6Confident82Confident124 Ų12463.2 Ų63.247%0.46834%0.337SS..G310 helixtrans-61.6-21.1175.8-69.4174.9-177-171.31.4112.9I404 P408 S409 L413 I414 H415I404-R411 HydrophobicContact CG2-CG 3.94Å; P408-R411 WeakPolarHBondContact O-CB 3.36Å; P408-R411 WeakPolarHBondContact O-CG 3.37Å; P408-R411 PolarHBondContact O-N 3.45Å; S409-R411 PolarHBondContact O-N 2.94Å; R411-L413 PolarHBondContact O-N 3.13Å; R411-L413 VanDerWaalsContact O-N 3.15Å; R411-I414 PolarHBondContact O-N 2.76Å; R411-H415 PolarHBondContact O-N 3.26Å
412V88.8Confident80.6Confident71 Ų7170 Ų7043%0.4337%0.368SS..G310 helixtrans-55.1-26.7170.4176.30000111.7C410 I414 K416C410-V412 PolarHBondContact O-N 3.08Å; C410-V412 VanDerWaalsContact O-N 3.15Å; V412-I414 VanDerWaalsContact C-N 3.3Å; V412-I414 PolarHBondContact O-N 3.45Å; V412-K416 HydrophobicContact CG1-CD 4.42Å; V412-K416 HydrophobicContact CG1-CG 4.11Å; V412-K416 VanDerWaalsContact O-CE 3.27Å; V412-K416 WeakPolarHBondContact O-CE 3.36Å; V412-K416 WeakPolarHBondContact O-CG 3.39Å
413L86.9Confident79.1Confident2 Ų278 Ų781%0.0141%0.41CS..G310 helixtrans-71.9-22.9175.9-60.2177.3000113.8A375 C410 R411 A440 S443 S444 L445A375-L413 HydrophobicContact CB-CD1 4.08Å; C410-L413 HydrophobicContact CB-CD1 4.34Å; C410-L413 VanDerWaalsContact O-CB 3.25Å; C410-L413 WeakPolarHBondContact O-CB 3.32Å; C410-L413 VanDerWaalsContact O-CG 3.31Å; C410-L413 WeakPolarHBondContact O-CG 3.39Å; C410-L413 PolarHBondContact O-N 2.73Å; R411-L413 PolarHBondContact O-N 3.13Å; R411-L413 VanDerWaalsContact O-N 3.15Å; L413-A440 WeakPolarHBondContact CD2-O 3.15Å; L413-S443 WeakPolarHBondContact CD2-O 3.43Å; L413-S444 WeakPolarHBondContact O-CA 3.25Å; L413-L445 HydrophobicContact CB-CD1 3.66Å; L413-L445 HydrophobicContact CB-CG 3.83Å; L413-L445 HydrophobicContact CD1-CD1 4.1Å; L413-L445 HydrophobicContact CD1-CG 4.35Å; L413-L445 PolarHBondContact O-N 3.24Å
414I87.4Confident78.2Confident69 Ų6986.6 Ų86.635%0.35446%0.455SS..THydrogen-bonded Turntrans-94-45.8-179.7-54.9-180000110.1I404 R411 V412 L445 I466 M470I404-I414 HydrophobicContact CD1-CD1 3.92Å; I404-I414 HydrophobicContact CD1-CG1 4.24Å; I404-I414 HydrophobicContact CG2-CD1 4.03Å; R411-I414 PolarHBondContact O-N 2.76Å; V412-I414 VanDerWaalsContact C-N 3.3Å; V412-I414 PolarHBondContact O-N 3.45Å; I414-L445 HydrophobicContact CG1-CD1 4.41Å; I414-I466 HydrophobicContact CD1-CD1 3.88Å; I414-I466 HydrophobicContact CD1-CG1 3.73Å; I414-I466 HydrophobicContact CG1-CD1 3.98Å; I414-I466 HydrophobicContact CG1-CG1 4.27Å; I414-I466 HydrophobicContact CG2-CD1 4.35Å; I414-I466 HydrophobicContact CG2-CG1 4.16Å; I414-M470 HydrophobicContact CD1-CE 3.57Å
415H85.8Confident77.6Confident135 Ų13594.6 Ų94.663%0.62549%0.493SS*.  trans-134.8114.3-175.1-175.467.4000110.6R411R411-H415 PolarHBondContact O-N 3.26Å
416K81.4Confident77.4Confident60 Ų6095 Ų9526%0.26150%0.498SS..  trans-109.4108.1171.8-65.2-168.2179.9-167.40108.9V412 S418 S419 L441 E442 S443V412-K416 HydrophobicContact CG1-CD 4.42Å; V412-K416 HydrophobicContact CG1-CG 4.11Å; V412-K416 VanDerWaalsContact O-CE 3.27Å; V412-K416 WeakPolarHBondContact O-CE 3.36Å; V412-K416 WeakPolarHBondContact O-CG 3.39Å; K416-S418 VanDerWaalsContact C-N 3.26Å; K416-S418 PolarHBondContact O-N 2.91Å; K416-S419 WeakPolarHBondContact CB-OG 3.49Å; K416-S419 PolarHBondContact O-OG 3.49Å; K416-L441 PolarHBondContact NZ-O 3.14Å; K416-L441 VanDerWaalsContact NZ-O 3.15Å; K416-E442 PolarHBondContact NZ-O 3.13Å; K416-S443 WeakPolarHBondContact CE-O 3.39Å; K416-S443 PolarHBondContact NZ-O 3.33Å
417P73.2Confident77.4Confident97 Ų9795 Ų9563%0.6350%0.504SS*.THydrogen-bonded Turntrans-76.4-10.2-179.628.8-33.6000113.7
418S65.7Low77.6Confident110 Ų11094.3 Ų94.377%0.76950%0.501SS*.THydrogen-bonded Turntrans-107.33.9-169.6-58.10000115.4K416K416-S418 VanDerWaalsContact C-N 3.26Å; K416-S418 PolarHBondContact O-N 2.91Å
419S60.8Low77.8Confident49 Ų4994.1 Ų94.134%0.34350%0.498SS..  trans-105.230.9-168.351.20000114.4K416 D421K416-S419 WeakPolarHBondContact CB-OG 3.49Å; K416-S419 PolarHBondContact O-OG 3.49Å; S419-D421 VanDerWaalsContact C-N 3.26Å; S419-D421 PolarHBondContact O-N 2.94Å
420E60.6Low77.8Confident185 Ų18592.7 Ų92.786%0.86448%0.484SS*.SBendtrans-69.2-22.5178.4-65.9-172.6169.500112.9
421D57Low77.8Confident165 Ų165100.8 Ų100.888%0.88252%0.522SS*.SBendtrans-120.55.2-173-70.3-38.7000115S419S419-D421 VanDerWaalsContact C-N 3.26Å; S419-D421 PolarHBondContact O-N 2.94Å
422E61.1Low78Confident143 Ų14397.9 Ų97.967%0.66851%0.514SS*.SBendtrans-90146.8-178-73.4-178.8165.900112.9L424E422-L424 PolarHBondContact O-N 3.39Å
423L59.4Low78Confident167 Ų16797.9 Ų97.987%0.87451%0.514SS*.  trans-58.8126.2173.1-70.5166000109.8E425L423-E425 PolarHBondContact O-N 2.85Å
424L69.9Low78.1Confident182 Ų18299.9 Ų99.995%0.95352%0.524SS*.  trans-70.722-174.1-71.2162.3000115E422E422-L424 PolarHBondContact O-N 3.39Å
425E77.8Confident78.2Confident168 Ų16896.9 Ų96.979%0.78551%0.509SS*.  trans-82.8124.8-179.5-163.3165-163.800110.1L423 P427L423-E425 PolarHBondContact O-N 2.85Å; E425-P427 VanDerWaalsContact O-CD 3.23Å; E425-P427 WeakPolarHBondContact O-CD 3.37Å
426D84.6Confident78.4Confident47 Ų4792.8 Ų92.825%0.25150%0.499SS..  trans-72.8110.8-179.2-176.27000109.4K379 R383 Y428 S443 W446K379-D426 IonicContact NZ-OD1 3.6Å; K379-D426 IonicContact NZ-OD2 2.76Å; K379-D426 PolarHBondContact NZ-OD2 3.13Å; R383-D426 IonicContact CZ-OD2 3.79Å; R383-D426 IonicContact NH1-OD2 3.02Å; R383-D426 PolarHBondContact NH1-OD2 3.41Å; R383-D426 IonicContact NH2-OD2 2.87Å; R383-D426 PolarHBondContact NH2-OD2 3.44Å; D426-Y428 PolarHBondContact O-N 3.4Å; D426-Y428 WeakPolarHBondContact OD1-CB 3.42Å; D426-Y428 PolarHBondContact OD1-N 2.92Å; D426-S443 WeakPolarHBondContact OD1-CB 3.42Å; D426-S443 PolarHBondContact OD1-OG 3.46Å; D426-W446 PolarHBondContact OD2-NE1 3.15Å
427P87.1Confident78.8Confident51 Ų5194.7 Ų94.733%0.33151%0.512SS..  trans-73.8-6.1-17631.3-35.5000113.1E425 V429 H439 E442E425-P427 VanDerWaalsContact O-CD 3.23Å; E425-P427 WeakPolarHBondContact O-CD 3.37Å; P427-V429 PolarHBondContact O-N 2.89Å; P427-H439 HydrophobicContact CB-CB 4.42Å; P427-E442 HydrophobicContact CB-CB 4.46Å; P427-E442 HydrophobicContact CG-CB 3.64Å
428Y90.9Very high79.6Confident11 Ų1190.1 Ų90.14%0.04348%0.482CS..  trans-70.4121.9-174.4175.8-102.5000113.3Y340 K379 R380 D426 M430 C438 A440Y340-Y428 PolarHBondContact OH-OH 3.32Å; K379-Y428 HydrophobicContact CB-CD2 4.34Å; K379-Y428 HydrophobicContact CB-CE2 4.09Å; K379-Y428 HydrophobicContact CD-CD1 4.44Å; K379-Y428 HydrophobicContact CD-CG 4.39Å; K379-Y428 HydrophobicContact CG-CD1 3.8Å; K379-Y428 HydrophobicContact CG-CD2 3.54Å; K379-Y428 HydrophobicContact CG-CE1 3.9Å; K379-Y428 HydrophobicContact CG-CE2 3.62Å; K379-Y428 HydrophobicContact CG-CG 3.62Å; R380-Y428 WeakPolarHBondContact CA-OH 3.36Å; R380-Y428 WeakPolarHBondContact CB-OH 3.33Å; D426-Y428 PolarHBondContact O-N 3.4Å; D426-Y428 WeakPolarHBondContact OD1-CB 3.42Å; D426-Y428 PolarHBondContact OD1-N 2.92Å; Y428-M430 HydrophobicContact CE1-CB 3.98Å; Y428-M430 HydrophobicContact CE1-SD 3.8Å; Y428-M430 PolarHBondContact OH-SD 3.26Å; Y428-C438 WeakPolarHBondContact CA-O 3.39Å; Y428-C438 HydrophobicContact CD2-CB 4.18Å; Y428-C438 WeakPolarHBondContact CD2-O 3.37Å; Y428-C438 HydrophobicContact CE2-CB 3.83Å; Y428-A440 HydrophobicContact CD2-CB 3.9Å; Y428-A440 HydrophobicContact CE2-CB 4.08Å
429V91.8Very high80.6Confident67 Ų6789 Ų8941%0.40646%0.464SS..  trans-97.1110.9177.5-174.90000110.2P427 E432 C438P427-V429 PolarHBondContact O-N 2.89Å; V429-E432 HydrophobicContact CB-CB 4.23Å; V429-E432 HydrophobicContact CG1-CB 4.02Å; V429-C438 PolarHBondContact N-O 3.29Å
430M87.6Confident82.1Confident43 Ų4386.9 Ų86.921%0.21245%0.449CS..THydrogen-bonded Turntrans-74.3-33.5-177.2-177.264.8-164.800113.7R380 R383 L384 Y428 E432R380-M430 HydrophobicContact CG-CE 3.71Å; R380-M430 HydrophobicContact CG-SD 4.05Å; R383-M430 HydrophobicContact CB-SD 4.03Å; R383-M430 HydrophobicContact CG-CG 4.48Å; R383-M430 HydrophobicContact CG-SD 3.98Å; L384-M430 HydrophobicContact CD2-CE 3.75Å; L384-M430 HydrophobicContact CG-CE 3.98Å; Y428-M430 HydrophobicContact CE1-CB 3.98Å; Y428-M430 HydrophobicContact CE1-SD 3.8Å; Y428-M430 PolarHBondContact OH-SD 3.26Å; M430-E432 PolarHBondContact O-N 3.07Å
431E88.5Confident83.4Confident171 Ų17181 Ų8180%0.79942%0.424SS*.THydrogen-bonded Turntrans-79-6-177-59.2-56.3147.100113.2
432E91.7Very high84.7Confident63 Ų6378.8 Ų78.829%0.29441%0.408SS..  trans-68136.1-178.6-173.150-118.600110.5Y340 V429 M430 D434 L437 C438Y340-E432 WeakPolarHBondContact CE1-O 3.42Å; V429-E432 HydrophobicContact CB-CB 4.23Å; V429-E432 HydrophobicContact CG1-CB 4.02Å; M430-E432 PolarHBondContact O-N 3.07Å; E432-D434 WeakPolarHBondContact CG-O 3.18Å; E432-D434 PolarHBondContact OE1-N 3.2Å; E432-L437 HydrophobicContact CG-CB 3.85Å; E432-C438 HydrophobicContact CB-CB 4.34Å
433V88.1Confident86.1Confident71 Ų7172.1 Ų72.143%0.4338%0.377SS..SBendtrans-85.9-31.4-176-179.60000110K337 N341K337-V433 HydrophobicContact CG-CG1 4.46Å; K337-V433 WeakPolarHBondContact CG-O 3.41Å; N341-V433 WeakPolarHBondContact ND2-CG1 3.48Å; N341-V433 WeakPolarHBondContact OD1-CA 3.49Å; N341-V433 PolarHBondContact OD1-O 2.98Å
434D89.8Confident87.5Confident43 Ų4366.7 Ų66.723%0.2335%0.353CS..  trans-92.5117.3179.6-152.8-47000111.9K337 E432 A436 L437 C438K337-D434 IonicContact NZ-OD2 3.62Å; K337-D434 PolarHBondContact NZ-OD2 3.23Å; E432-D434 WeakPolarHBondContact CG-O 3.18Å; E432-D434 PolarHBondContact OE1-N 3.2Å; D434-A436 PolarHBondContact O-N 3.11Å; D434-A436 VanDerWaalsContact O-N 3.1Å; D434-A436 WeakPolarHBondContact OD1-CB 3.16Å; D434-A436 PolarHBondContact OD1-N 3.07Å; D434-L437 HydrophobicContact CB-CB 4.35Å; D434-L437 HydrophobicContact CB-CD1 4.1Å; D434-L437 HydrophobicContact CB-CG 4.17Å; D434-L437 PolarHBondContact O-N 3.48Å; D434-C438 PolarHBondContact O-N 3Å
435P90.3Very high88.6Confident6 Ų658.5 Ų58.54%0.03931%0.31CS..THydrogen-bonded Turntrans-63.5-18.5178.326.8-35.2000113.2Y340 L373 A376 L437 C438Y340-P435 HydrophobicContact CD1-CB 4.25Å; Y340-P435 HydrophobicContact CD2-CB 4.21Å; Y340-P435 HydrophobicContact CE1-CB 4.45Å; Y340-P435 HydrophobicContact CE2-CB 4.43Å; Y340-P435 HydrophobicContact CG-CB 4.11Å; L373-P435 HydrophobicContact CD1-CB 3.76Å; L373-P435 HydrophobicContact CD1-CG 3.42Å; L373-P435 VanDerWaalsContact CD1-CG 3.42Å; A376-P435 HydrophobicContact CB-CB 3.66Å; P435-L437 VanDerWaalsContact C-N 3.32Å; P435-C438 PolarHBondContact O-SG 3.37Å
436A89.4Confident89.2Confident50 Ų5055.6 Ų55.641%0.41329%0.292SS..THydrogen-bonded Turntrans-72.1-25.5174.700000113.3Y372 D434Y372-A436 HydrophobicContact CD2-CB 4.07Å; Y372-A436 HydrophobicContact CE2-CB 3.7Å; D434-A436 PolarHBondContact O-N 3.11Å; D434-A436 VanDerWaalsContact O-N 3.1Å; D434-A436 WeakPolarHBondContact OD1-CB 3.16Å; D434-A436 PolarHBondContact OD1-N 3.07Å
437L90.6Very high89.7Confident100 Ų10053.4 Ų53.452%0.52428%0.28SS..THydrogen-bonded Turntrans-103.3-1.7-173.1-60.6177.3000113.4E432 D434 P435 H439E432-L437 HydrophobicContact CG-CB 3.85Å; D434-L437 HydrophobicContact CB-CB 4.35Å; D434-L437 HydrophobicContact CB-CD1 4.1Å; D434-L437 HydrophobicContact CB-CG 4.17Å; D434-L437 PolarHBondContact O-N 3.48Å; P435-L437 VanDerWaalsContact C-N 3.32Å; L437-H439 PolarHBondContact O-CD2 3.19Å; L437-H439 PolarHBondContact O-N 3.4Å
438C87.9Confident89.9Confident1 Ų151 Ų511%0.00727%0.265CS..SBendtrans-76.7-3.6-177.4710000114.6A376 Y428 V429 E432 D434 P435 A440A376-C438 WeakPolarHBondContact CB-SG 3.38Å; Y428-C438 WeakPolarHBondContact CA-O 3.39Å; Y428-C438 HydrophobicContact CD2-CB 4.18Å; Y428-C438 WeakPolarHBondContact CD2-O 3.37Å; Y428-C438 HydrophobicContact CE2-CB 3.83Å; V429-C438 PolarHBondContact N-O 3.29Å; E432-C438 HydrophobicContact CB-CB 4.34Å; D434-C438 PolarHBondContact O-N 3Å; P435-C438 PolarHBondContact O-SG 3.37Å; C438-A440 PolarHBondContact O-N 3.09Å; C438-A440 VanDerWaalsContact O-N 3.14Å
439H88.8Confident90Very high87 Ų8756.5 Ų56.540%0.40329%0.289SS..  trans52.830.9-178.7-65-81.1000115.1P427 L437 L441 E442 S443P427-H439 HydrophobicContact CB-CB 4.42Å; L437-H439 PolarHBondContact O-CD2 3.19Å; L437-H439 PolarHBondContact O-N 3.4Å; H439-L441 VanDerWaalsContact C-N 3.32Å; H439-L441 PolarHBondContact O-N 3.32Å; H439-E442 IonicContact CE1-OE1 4Å; H439-E442 IonicContact CG-OE2 2.69Å; H439-E442 IonicContact ND1-OE1 2.65Å; H439-E442 PolarHBondContact ND1-OE1 2.9Å; H439-E442 IonicContact ND1-OE2 3.8Å; H439-E442 PolarHBondContact ND1-OE2 3.22Å; H439-E442 PolarHBondContact O-N 3.23Å; H439-E442 VanDerWaalsContact O-N 3.14Å; H439-S443 PolarHBondContact O-N 3.06Å
440A90.4Very high90Very high3 Ų357 Ų573%0.02529%0.292CS..G310 helixtrans-60.6-33.8-175.600000114.7A375 A376 K379 L413 Y428 C438 E442 S443A375-A440 HydrophobicContact CB-CB 4.25Å; A376-A440 HydrophobicContact CB-CB 4.28Å; K379-A440 HydrophobicContact CB-CB 4.04Å; K379-A440 HydrophobicContact CG-CB 4.44Å; L413-A440 WeakPolarHBondContact CD2-O 3.15Å; Y428-A440 HydrophobicContact CD2-CB 3.9Å; Y428-A440 HydrophobicContact CE2-CB 4.08Å; C438-A440 PolarHBondContact O-N 3.09Å; C438-A440 VanDerWaalsContact O-N 3.14Å; A440-E442 VanDerWaalsContact C-N 3.3Å; A440-E442 PolarHBondContact O-N 3.21Å; A440-S443 WeakPolarHBondContact O-CB 3.08Å; A440-S443 PolarHBondContact O-N 3.4Å
441L87.9Confident90.3Very high63 Ų6355.5 Ų55.533%0.3329%0.285SS..G310 helixtrans-67.2-30.6178.5-72.7173.2000113.2V371 A375 K416 H439 S443V371-L441 HydrophobicContact CG1-CD2 4.06Å; A375-L441 HydrophobicContact CB-CD2 3.4Å; A375-L441 VanDerWaalsContact CB-CD2 3.4Å; A375-L441 HydrophobicContact CB-CG 3.8Å; K416-L441 PolarHBondContact NZ-O 3.14Å; K416-L441 VanDerWaalsContact NZ-O 3.15Å; H439-L441 VanDerWaalsContact C-N 3.32Å; H439-L441 PolarHBondContact O-N 3.32Å; L441-S443 PolarHBondContact O-N 3.35Å
442E86Confident90.5Very high118 Ų11848.2 Ų48.255%0.55125%0.251SS*.G310 helixtrans-77.9-13.6178.2-63.9166.6-146.700111.3K416 P427 H439 A440K416-E442 PolarHBondContact NZ-O 3.13Å; P427-E442 HydrophobicContact CB-CB 4.46Å; P427-E442 HydrophobicContact CG-CB 3.64Å; H439-E442 IonicContact CE1-OE1 4Å; H439-E442 IonicContact CG-OE2 2.69Å; H439-E442 IonicContact ND1-OE1 2.65Å; H439-E442 PolarHBondContact ND1-OE1 2.9Å; H439-E442 IonicContact ND1-OE2 3.8Å; H439-E442 PolarHBondContact ND1-OE2 3.22Å; H439-E442 PolarHBondContact O-N 3.23Å; H439-E442 VanDerWaalsContact O-N 3.14Å; A440-E442 VanDerWaalsContact C-N 3.3Å; A440-E442 PolarHBondContact O-N 3.21Å
443S89.5Confident90.5Very high2 Ų254.5 Ų54.51%0.01428%0.277CS..SBendtrans-89.1176.4175.8154.20000113.5K379 L413 K416 D426 H439 A440 L441K379-S443 WeakPolarHBondContact CD-OG 3.45Å; K379-S443 WeakPolarHBondContact CE-OG 3.31Å; K379-S443 PolarHBondContact NZ-OG 3.13Å; K379-S443 VanDerWaalsContact NZ-OG 3.08Å; L413-S443 WeakPolarHBondContact CD2-O 3.43Å; K416-S443 WeakPolarHBondContact CE-O 3.39Å; K416-S443 PolarHBondContact NZ-O 3.33Å; D426-S443 WeakPolarHBondContact OD1-CB 3.42Å; D426-S443 PolarHBondContact OD1-OG 3.46Å; H439-S443 PolarHBondContact O-N 3.06Å; A440-S443 WeakPolarHBondContact O-CB 3.08Å; A440-S443 PolarHBondContact O-N 3.4Å; L441-S443 PolarHBondContact O-N 3.35Å
444S89.9Confident90.8Very high53 Ų5352.9 Ų52.937%0.37127%0.265SS..  trans-123.9161.9172.463.50000112.1K379 L413 W446K379-S444 PolarHBondContact NZ-O 3.29Å; L413-S444 WeakPolarHBondContact O-CA 3.25Å; S444-W446 PolarHBondContact O-N 3.33Å
445L91.6Very high90.8Very high11 Ų1159.4 Ų59.46%0.05829%0.288CS..  trans-92.557.1178.9-70.2165.1000112.7K379 A382 I404 L413 I414 E447 I448K379-L445 HydrophobicContact CD-CD2 4.14Å; A382-L445 HydrophobicContact CB-CD2 3.57Å; I404-L445 HydrophobicContact CD1-CD1 3.72Å; L413-L445 HydrophobicContact CB-CD1 3.66Å; L413-L445 HydrophobicContact CB-CG 3.83Å; L413-L445 HydrophobicContact CD1-CD1 4.1Å; L413-L445 HydrophobicContact CD1-CG 4.35Å; L413-L445 PolarHBondContact O-N 3.24Å; I414-L445 HydrophobicContact CG1-CD1 4.41Å; L445-E447 PolarHBondContact O-N 3.35Å; L445-I448 HydrophobicContact CB-CD1 4.14Å; L445-I448 HydrophobicContact CB-CG1 4.45Å; L445-I448 HydrophobicContact CD1-CD1 4.17Å; L445-I448 PolarHBondContact O-N 3.02Å
446W91.3Very high90.8Very high107 Ų10759.8 Ų59.841%0.40529%0.289SS..Hα-helixtrans-66.3-19.9179.961.7-99.4000113.5L386 D426 S444 I448 K449 T450L386-W446 HydrophobicContact CD1-CH2 4.2Å; L386-W446 HydrophobicContact CD1-CZ3 4.15Å; D426-W446 PolarHBondContact OD2-NE1 3.15Å; S444-W446 PolarHBondContact O-N 3.33Å; W446-I448 VanDerWaalsContact C-N 3.35Å; W446-I448 PolarHBondContact O-N 2.62Å; W446-K449 WeakPolarHBondContact O-CB 3.43Å; W446-K449 PolarHBondContact O-N 3.46Å; W446-T450 PolarHBondContact O-N 3.45Å; W446-T450 VanDerWaalsContact O-N 3.07Å; W446-T450 PolarHBondContact O-OG1 3.46Å; W446-T450 VanDerWaalsContact O-OG1 3.07Å
447E94.4Very high90.8Very high0 Ų061.2 Ų61.20%029%0.294CS..Hα-helixtrans-63.8-41.8177.7-59.690164.500111.4K379 A382 R383 L386 L445 K449 T450 L451K379-E447 VanDerWaalsContact CE-OE1 3.27Å; K379-E447 WeakPolarHBondContact CE-OE1 3.2Å; K379-E447 VanDerWaalsContact NZ-CD 3.34Å; K379-E447 IonicContact NZ-OE1 2.62Å; K379-E447 PolarHBondContact NZ-OE1 3.33Å; K379-E447 IonicContact NZ-OE2 3.4Å; K379-E447 PolarHBondContact NZ-OE2 3.4Å; K379-E447 VanDerWaalsContact NZ-OE2 3.13Å; A382-E447 HydrophobicContact CB-CB 4.16Å; A382-E447 VanDerWaalsContact O-CB 3.31Å; A382-E447 WeakPolarHBondContact O-CB 3.36Å; R383-E447 WeakPolarHBondContact CD-OE1 3.39Å; R383-E447 IonicContact CZ-OE1 2.77Å; R383-E447 IonicContact NE-OE1 3.05Å; R383-E447 IonicContact NH1-OE1 3.18Å; R383-E447 PolarHBondContact NH1-OE1 3.21Å; L386-E447 HydrophobicContact CD1-CB 4.26Å; L386-E447 HydrophobicContact CD1-CG 3.72Å; L386-E447 HydrophobicContact CD2-CB 3.96Å; L386-E447 HydrophobicContact CD2-CG 4.35Å; L386-E447 HydrophobicContact CG-CB 4.02Å; L386-E447 HydrophobicContact CG-CG 4Å; L445-E447 PolarHBondContact O-N 3.35Å; E447-K449 VanDerWaalsContact C-N 3.27Å; E447-K449 PolarHBondContact O-N 3.19Å; E447-T450 WeakPolarHBondContact O-CB 3.44Å; E447-T450 PolarHBondContact O-N 3.46Å; E447-T450 VanDerWaalsContact O-N 3.11Å; E447-L451 WeakPolarHBondContact O-CG 3.5Å; E447-L451 PolarHBondContact O-N 3.43Å
448I92.6Very high90.8Very high1 Ų158.4 Ų58.41%0.00528%0.279CS..Hα-helixtrans-64.6-37.3176.5-56.4177.7000109.9A382 L397 I400 Y401 L445 W446 T450 L451 Q452 A463 I466A382-I448 HydrophobicContact CB-CG1 4.44Å; L397-I448 HydrophobicContact CD2-CG1 4.43Å; L397-I448 HydrophobicContact CD2-CG2 4.19Å; I400-I448 HydrophobicContact CD1-CD1 4.49Å; I400-I448 HydrophobicContact CG2-CD1 3.98Å; Y401-I448 HydrophobicContact CE1-CD1 4.39Å; L445-I448 HydrophobicContact CB-CD1 4.14Å; L445-I448 HydrophobicContact CB-CG1 4.45Å; L445-I448 HydrophobicContact CD1-CD1 4.17Å; L445-I448 PolarHBondContact O-N 3.02Å; W446-I448 VanDerWaalsContact C-N 3.35Å; W446-I448 PolarHBondContact O-N 2.62Å; I448-T450 VanDerWaalsContact C-N 3.25Å; I448-T450 PolarHBondContact O-N 3.05Å; I448-L451 PolarHBondContact O-N 3.31Å; I448-Q452 PolarHBondContact O-N 3.46Å; I448-A463 HydrophobicContact CG2-CB 4.43Å; I448-I466 HydrophobicContact CB-CD1 4.24Å; I448-I466 HydrophobicContact CD1-CD1 3.73Å; I448-I466 HydrophobicContact CG2-CB 4.36Å; I448-I466 HydrophobicContact CG2-CD1 3.87Å; I448-I466 HydrophobicContact CG2-CG2 4.04Å
449K91.6Very high90.9Very high126 Ų12658.4 Ų58.455%0.54828%0.279SS..Hα-helixtrans-61.7-36.8175.4-172.262.1178.7175.70111.9W446 E447 Q452W446-K449 WeakPolarHBondContact O-CB 3.43Å; W446-K449 PolarHBondContact O-N 3.46Å; E447-K449 VanDerWaalsContact C-N 3.27Å; E447-K449 PolarHBondContact O-N 3.19Å; K449-Q452 WeakPolarHBondContact O-CB 3.44Å; K449-Q452 PolarHBondContact O-N 2.91Å
450T92.5Very high91.1Very high78 Ų7854.8 Ų54.848%0.47927%0.265SS..Hα-helixtrans-68.4-42.6175.7-52.20000110.9W446 E447 I448 Q452 K453W446-T450 PolarHBondContact O-N 3.45Å; W446-T450 VanDerWaalsContact O-N 3.07Å; W446-T450 PolarHBondContact O-OG1 3.46Å; W446-T450 VanDerWaalsContact O-OG1 3.07Å; E447-T450 WeakPolarHBondContact O-CB 3.44Å; E447-T450 PolarHBondContact O-N 3.46Å; E447-T450 VanDerWaalsContact O-N 3.11Å; I448-T450 VanDerWaalsContact C-N 3.25Å; I448-T450 PolarHBondContact O-N 3.05Å; T450-Q452 PolarHBondContact O-N 3.26Å; T450-Q452 VanDerWaalsContact O-N 3.14Å; T450-K453 PolarHBondContact O-N 3.25Å; T450-K453 VanDerWaalsContact O-N 3.09Å
451L92.9Very high91.2Very high12 Ų1260.9 Ų60.96%0.06329%0.291CS..Hα-helixtrans-64.2-15.9177-67.8173.2000114A385 L386 L393 L397 E447 I448 K453 H454 A463A385-L451 HydrophobicContact CB-CD1 3.91Å; L386-L451 HydrophobicContact CD2-CG 4.5Å; L393-L451 HydrophobicContact CD1-CD2 4.09Å; L393-L451 HydrophobicContact CD2-CD1 3.9Å; L393-L451 HydrophobicContact CD2-CD2 4.16Å; L397-L451 HydrophobicContact CD2-CD1 4.16Å; E447-L451 WeakPolarHBondContact O-CG 3.5Å; E447-L451 PolarHBondContact O-N 3.43Å; I448-L451 PolarHBondContact O-N 3.31Å; L451-K453 PolarHBondContact O-N 2.89Å; L451-H454 WeakPolarHBondContact O-CB 3.4Å; L451-H454 PolarHBondContact O-N 2.7Å; L451-H454 VanDerWaalsContact O-N 3.13Å; L451-A463 HydrophobicContact CB-CB 4Å
452Q93.3Very high91.3Very high17 Ų1758.6 Ų58.68%0.07928%0.281CS..THydrogen-bonded Turntrans-62.9-20.3171.7-66.4178.77.900113I448 K449 T450 A463 M464 I466 N467I448-Q452 PolarHBondContact O-N 3.46Å; K449-Q452 WeakPolarHBondContact O-CB 3.44Å; K449-Q452 PolarHBondContact O-N 2.91Å; T450-Q452 PolarHBondContact O-N 3.26Å; T450-Q452 VanDerWaalsContact O-N 3.14Å; Q452-A463 HydrophobicContact CG-CB 3.95Å; Q452-A463 PolarHBondContact NE2-O 3.38Å; Q452-M464 HydrophobicContact CB-CG 4.25Å; Q452-M464 HydrophobicContact CG-CG 4.09Å; Q452-M464 WeakPolarHBondContact O-CE 3.45Å; Q452-I466 VanDerWaalsContact NE2-CG2 3.34Å; Q452-N467 PolarHBondContact NE2-ND2 2.92Å; Q452-N467 VanDerWaalsContact NE2-ND2 3.2Å; Q452-N467 PolarHBondContact NE2-OD1 3.2Å; Q452-N467 VanDerWaalsContact NE2-OD1 3.09Å; Q452-N467 PolarHBondContact OE1-ND2 3.42Å
453K92.1Very high91.6Very high196 Ų19653 Ų5385%0.85226%0.255SS*.THydrogen-bonded Turntrans-105.127.7175.4-62.9-176.4179.6179.90112.5T450 L451T450-K453 PolarHBondContact O-N 3.25Å; T450-K453 VanDerWaalsContact O-N 3.09Å; L451-K453 PolarHBondContact O-N 2.89Å
454H93.1Very high91.7Very high37 Ų3757.3 Ų57.317%0.17128%0.276CS..  trans-69.9147.2179.7-173.5-92.4000111.9L451 H456 V459L451-H454 WeakPolarHBondContact O-CB 3.4Å; L451-H454 PolarHBondContact O-N 2.7Å; L451-H454 VanDerWaalsContact O-N 3.13Å; H454-H456 VanDerWaalsContact C-N 3.29Å; H454-H456 WeakPolarHBondContact ND1-CB 3.24Å; H454-H456 PolarHBondContact ND1-N 3.2Å; H454-H456 PolarHBondContact O-N 3.46Å; H454-V459 HydrophobicContact CB-CB 4.37Å; H454-V459 HydrophobicContact CB-CG1 3.95Å
455Y90.6Very high91.6Very high179 Ų17958.8 Ų58.870%0.70228%0.279SS*.SBendtrans-63-33.6-17769.5-94.4000113.2P390P390-Y455 WeakPolarHBondContact CD-OH 3.29Å; P390-Y455 HydrophobicContact CG-CE1 4.45Å; P390-Y455 HydrophobicContact CG-CE2 4.34Å; P390-Y455 WeakPolarHBondContact CG-OH 3.18Å
456H89.9Confident91.4Very high15 Ų1559.1 Ų59.17%0.06928%0.28CS..SBendtrans-82.1122.5177.2-169.6-69.9000110.4H454 D458 V459 A460 D492H454-H456 VanDerWaalsContact C-N 3.29Å; H454-H456 WeakPolarHBondContact ND1-CB 3.24Å; H454-H456 PolarHBondContact ND1-N 3.2Å; H454-H456 PolarHBondContact O-N 3.46Å; H456-D458 IonicContact CE1-OD2 2.74Å; H456-D458 PolarHBondContact ND1-N 2.9Å; H456-D458 VanDerWaalsContact ND1-N 3.19Å; H456-D458 PolarHBondContact O-N 3.45Å; H456-V459 HydrophobicContact CB-CB 4.29Å; H456-V459 HydrophobicContact CB-CG2 4.04Å; H456-V459 PolarHBondContact O-N 3.15Å; H456-A460 PolarHBondContact O-N 3Å; H456-A460 VanDerWaalsContact O-N 3.13Å; H456-D492 IonicContact NE2-OD2 3.63Å; H456-D492 PolarHBondContact NE2-OD2 3.35Å
457P89.7Confident91.2Very high79 Ų7958.7 Ų58.751%0.51329%0.286SS..Hα-helixtrans-62.9-39.4-171.823.7-33.8000113V459 A460 K461P457-V459 VanDerWaalsContact C-N 3.34Å; P457-V459 PolarHBondContact O-N 3.45Å; P457-A460 PolarHBondContact O-N 3.3Å; P457-K461 WeakPolarHBondContact O-CG 2.96Å; P457-K461 PolarHBondContact O-N 3.04Å
458D90.3Very high90.7Very high42 Ų4262.3 Ų62.323%0.22531%0.308CS..Hα-helixtrans-70.5-31.1-178.6-61-24000113.4L394 H456 K461 A462 R491L394-D458 HydrophobicContact CD2-CB 4.25Å; H456-D458 IonicContact CE1-OD2 2.74Å; H456-D458 PolarHBondContact ND1-N 2.9Å; H456-D458 VanDerWaalsContact ND1-N 3.19Å; H456-D458 PolarHBondContact O-N 3.45Å; D458-K461 IonicContact OD1-NZ 2.97Å; D458-A462 VanDerWaalsContact O-CB 3.3Å; D458-A462 WeakPolarHBondContact O-CB 3.2Å; D458-A462 PolarHBondContact O-N 3.43Å; D458-R491 IonicContact OD2-CZ 2.75Å; D458-R491 IonicContact OD2-NH2 3.55Å; D458-R491 PolarHBondContact OD2-NH2 3.17Å
459V91.7Very high90.1Very high0 Ų068.2 Ų68.20%035%0.347CS..Hα-helixtrans-68.1-43.8173.1174.90000109.6P390 L393 L394 L397 H454 H456 P457 K461 A462 A463P390-V459 HydrophobicContact CB-CG2 4.09Å; L393-V459 HydrophobicContact CB-CG1 3.9Å; L393-V459 HydrophobicContact CB-CG2 4.18Å; L393-V459 HydrophobicContact CD1-CG1 3.77Å; L393-V459 HydrophobicContact CG-CG1 4.41Å; L394-V459 HydrophobicContact CD2-CG2 3.89Å; L394-V459 HydrophobicContact CG-CG2 4.02Å; L397-V459 HydrophobicContact CD1-CG1 4.24Å; H454-V459 HydrophobicContact CB-CB 4.37Å; H454-V459 HydrophobicContact CB-CG1 3.95Å; H456-V459 HydrophobicContact CB-CB 4.29Å; H456-V459 HydrophobicContact CB-CG2 4.04Å; H456-V459 PolarHBondContact O-N 3.15Å; P457-V459 VanDerWaalsContact C-N 3.34Å; P457-V459 PolarHBondContact O-N 3.45Å; V459-K461 PolarHBondContact O-N 3Å; V459-A462 PolarHBondContact O-N 2.93Å; V459-A463 WeakPolarHBondContact O-CB 3.36Å; V459-A463 PolarHBondContact O-N 2.76Å
460A92.8Very high89.3Confident12 Ų1264.2 Ų64.210%0.09933%0.331CS..Hα-helixtrans-60.7-45175.900000111.5H456 P457 A463 M464H456-A460 PolarHBondContact O-N 3Å; H456-A460 VanDerWaalsContact O-N 3.13Å; P457-A460 PolarHBondContact O-N 3.3Å; A460-A463 PolarHBondContact O-N 2.94Å; A460-M464 VanDerWaalsContact O-CG 3.26Å; A460-M464 WeakPolarHBondContact O-CG 3.33Å; A460-M464 PolarHBondContact O-N 3Å
461K91.3Very high88.5Confident131 Ų13165.2 Ų65.257%0.5734%0.337SS*.Hα-helixtrans-59.6-47.7174.1-71.8172.3-171.21660111.8P457 D458 V459 A463 M464 L465P457-K461 WeakPolarHBondContact O-CG 2.96Å; P457-K461 PolarHBondContact O-N 3.04Å; D458-K461 IonicContact OD1-NZ 2.97Å; V459-K461 PolarHBondContact O-N 3Å; K461-A463 VanDerWaalsContact C-N 3.31Å; K461-A463 PolarHBondContact O-N 3.21Å; K461-M464 PolarHBondContact O-N 3.43Å; K461-M464 VanDerWaalsContact O-N 3.1Å; K461-L465 PolarHBondContact O-N 3.22Å
462A90.3Very high87.4Confident15 Ų1573.7 Ų73.712%0.12438%0.376CS..Hα-helixtrans-59.8-41.5176.700000111.5L394 L397 Y401 D458 V459 M464 L465L394-A462 HydrophobicContact CD2-CB 4.5Å; L397-A462 HydrophobicContact CD1-CB 3.91Å; Y401-A462 VanDerWaalsContact CE2-O 3.24Å; Y401-A462 WeakPolarHBondContact CE2-O 3.29Å; Y401-A462 PolarHBondContact OH-O 3.05Å; D458-A462 VanDerWaalsContact O-CB 3.3Å; D458-A462 WeakPolarHBondContact O-CB 3.2Å; D458-A462 PolarHBondContact O-N 3.43Å; V459-A462 PolarHBondContact O-N 2.93Å; A462-M464 VanDerWaalsContact C-N 3.32Å; A462-M464 PolarHBondContact O-N 3.25Å; A462-L465 WeakPolarHBondContact O-CB 3.44Å; A462-L465 PolarHBondContact O-N 3.3Å
463A92.4Very high86.7Confident0 Ų080.2 Ų80.20%041%0.407CS..Hα-helixtrans-67.6-29.3175.700000112.9L397 Y401 I448 L451 Q452 V459 A460 K461 L465 I466L397-A463 HydrophobicContact CD1-CB 4.1Å; Y401-A463 VanDerWaalsContact OH-CA 3.29Å; Y401-A463 WeakPolarHBondContact OH-CA 3.3Å; Y401-A463 PolarHBondContact OH-O 2.97Å; I448-A463 HydrophobicContact CG2-CB 4.43Å; L451-A463 HydrophobicContact CB-CB 4Å; Q452-A463 HydrophobicContact CG-CB 3.95Å; Q452-A463 PolarHBondContact NE2-O 3.38Å; V459-A463 WeakPolarHBondContact O-CB 3.36Å; V459-A463 PolarHBondContact O-N 2.76Å; A460-A463 PolarHBondContact O-N 2.94Å; K461-A463 VanDerWaalsContact C-N 3.31Å; K461-A463 PolarHBondContact O-N 3.21Å; A463-L465 VanDerWaalsContact C-N 3.33Å; A463-I466 WeakPolarHBondContact O-CG2 3.26Å
464M90.9Very high86.1Confident93 Ų9375 Ų7546%0.45839%0.385SS..Hα-helixtrans-74.3-20.5176.9-74.6179.7-169.800113.4Q452 A460 K461 A462 I466 N467Q452-M464 HydrophobicContact CB-CG 4.25Å; Q452-M464 HydrophobicContact CG-CG 4.09Å; Q452-M464 WeakPolarHBondContact O-CE 3.45Å; A460-M464 VanDerWaalsContact O-CG 3.26Å; A460-M464 WeakPolarHBondContact O-CG 3.33Å; A460-M464 PolarHBondContact O-N 3Å; K461-M464 PolarHBondContact O-N 3.43Å; K461-M464 VanDerWaalsContact O-N 3.1Å; A462-M464 VanDerWaalsContact C-N 3.32Å; A462-M464 PolarHBondContact O-N 3.25Å; M464-I466 PolarHBondContact O-N 3.22Å; M464-I466 VanDerWaalsContact O-N 3.13Å; M464-N467 WeakPolarHBondContact O-CB 3.4Å; M464-N467 PolarHBondContact O-N 3.31Å
465L88.3Confident85.5Confident83 Ų8376.2 Ų76.244%0.43539%0.393SS..G310 helixtrans-57.9-25.8176.5-67174.5000112.7Y401 K461 A462 A463 N467 T468Y401-L465 HydrophobicContact CE2-CB 4.01Å; K461-L465 PolarHBondContact O-N 3.22Å; A462-L465 WeakPolarHBondContact O-CB 3.44Å; A462-L465 PolarHBondContact O-N 3.3Å; A463-L465 VanDerWaalsContact C-N 3.33Å; L465-N467 PolarHBondContact O-N 2.82Å; L465-T468 PolarHBondContact O-N 3.32Å; L465-T468 VanDerWaalsContact O-N 3.09Å; L465-T468 PolarHBondContact O-OG1 2.83Å
466I87.6Confident85.1Confident18 Ų1872.7 Ų72.79%0.09239%0.386CS..G310 helixtrans-62.1-24.6175.2-156.9171.1000113.3Y401 I414 I448 Q452 A463 M464 T468 M470Y401-I466 HydrophobicContact CE1-CB 3.86Å; Y401-I466 HydrophobicContact CE1-CD1 4.08Å; Y401-I466 HydrophobicContact CE1-CG1 4.04Å; I414-I466 HydrophobicContact CD1-CD1 3.88Å; I414-I466 HydrophobicContact CD1-CG1 3.73Å; I414-I466 HydrophobicContact CG1-CD1 3.98Å; I414-I466 HydrophobicContact CG1-CG1 4.27Å; I414-I466 HydrophobicContact CG2-CD1 4.35Å; I414-I466 HydrophobicContact CG2-CG1 4.16Å; I448-I466 HydrophobicContact CB-CD1 4.24Å; I448-I466 HydrophobicContact CD1-CD1 3.73Å; I448-I466 HydrophobicContact CG2-CB 4.36Å; I448-I466 HydrophobicContact CG2-CD1 3.87Å; I448-I466 HydrophobicContact CG2-CG2 4.04Å; Q452-I466 VanDerWaalsContact NE2-CG2 3.34Å; A463-I466 WeakPolarHBondContact O-CG2 3.26Å; M464-I466 PolarHBondContact O-N 3.22Å; M464-I466 VanDerWaalsContact O-N 3.13Å; I466-T468 VanDerWaalsContact C-N 3.33Å; I466-M470 HydrophobicContact CG1-CE 3.88Å
467N86.2Confident84.7Confident98 Ų9872.1 Ų72.152%0.52438%0.384SS..G310 helixtrans-81.7-16.2179.1-56.6-34.6000112Q452 M464 L465Q452-N467 PolarHBondContact NE2-ND2 2.92Å; Q452-N467 VanDerWaalsContact NE2-ND2 3.2Å; Q452-N467 PolarHBondContact NE2-OD1 3.2Å; Q452-N467 VanDerWaalsContact NE2-OD1 3.09Å; Q452-N467 PolarHBondContact OE1-ND2 3.42Å; M464-N467 WeakPolarHBondContact O-CB 3.4Å; M464-N467 PolarHBondContact O-N 3.31Å; L465-N467 PolarHBondContact O-N 2.82Å
468T85.6Confident84.3Confident76 Ų7671.1 Ų71.147%0.46638%0.378SS..SBendtrans-88.5149.7176.254.30000110.6L465 I466 M470L465-T468 PolarHBondContact O-N 3.32Å; L465-T468 VanDerWaalsContact O-N 3.09Å; L465-T468 PolarHBondContact O-OG1 2.83Å; I466-T468 VanDerWaalsContact C-N 3.33Å; T468-M470 PolarHBondContact O-N 3.32Å; T468-M470 VanDerWaalsContact O-N 3.16Å
469P79.1Confident83.7Confident126 Ų12676.8 Ų76.882%0.81840%0.404SS*.PPolyproline II helixtrans-59.4122.7176.825.2-33.3000109.6T471P469-T471 PolarHBondContact O-N 3.32Å
470M74.3Confident83.2Confident41 Ų4178.4 Ų78.420%0.20241%0.413CS..PPolyproline II helixtrans-70.9121.9-178.9-65.2-175.5179.500110.3Y401 I404 R405 I414 I466 T468Y401-M470 HydrophobicContact CD1-CE 4.05Å; I404-M470 HydrophobicContact CG2-SD 4.14Å; R405-M470 HydrophobicContact CG-CB 4.29Å; R405-M470 HydrophobicContact CG-SD 4.17Å; I414-M470 HydrophobicContact CD1-CE 3.57Å; I466-M470 HydrophobicContact CG1-CE 3.88Å; T468-M470 PolarHBondContact O-N 3.32Å; T468-M470 VanDerWaalsContact O-N 3.16Å
471T75.6Confident82.6Confident100 Ų10078.4 Ų78.461%0.61341%0.412SS*.PPolyproline II helixtrans-65.6154.4168.2-47.20000110.4R405 P469 Q473R405-T471 WeakPolarHBondContact CD-O 2.96Å; P469-T471 PolarHBondContact O-N 3.32Å; T471-Q473 VanDerWaalsContact C-N 3.29Å; T471-Q473 HydrophobicContact CG2-CB 4.32Å; T471-Q473 PolarHBondContact O-N 2.68Å
472E69.6Low82.1Confident189 Ų18979.5 Ų79.588%0.88342%0.419SS*.SBendtrans-71.1-21.5177.1-64.6-174.3166.600113.6
473Q78.6Confident81.8Confident154 Ų15480.9 Ų80.972%0.7242%0.424SS*.SBendtrans-71.5133.5179.4-172.3171.4-1.700111R405 T471R405-Q473 PolarHBondContact NH1-O 2.91Å; T471-Q473 VanDerWaalsContact C-N 3.29Å; T471-Q473 HydrophobicContact CG2-CB 4.32Å; T471-Q473 PolarHBondContact O-N 2.68Å
474E80.9Confident81.4Confident86 Ų8684 Ų8440%0.40244%0.443SS..PPolyproline II helixtrans-76.2145.6175.4-64.5-171.3-178.100111.7R406R406-E474 WeakPolarHBondContact CG-OE1 3.27Å; R406-E474 IonicContact CZ-OE1 3.84Å; R406-E474 IonicContact CZ-OE2 2.82Å; R406-E474 IonicContact NE-OE1 3.38Å; R406-E474 PolarHBondContact NE-OE1 3.25Å; R406-E474 IonicContact NE-OE2 2.68Å; R406-E474 PolarHBondContact NE-OE2 2.9Å; R406-E474 IonicContact NH2-OE1 3.48Å; R406-E474 IonicContact NH2-OE2 3.49Å; R406-E474 PolarHBondContact NH2-OE2 3.41Å
475D80.4Confident81.1Confident64 Ų6483.4 Ų83.434%0.34245%0.448SS..PPolyproline II helixtrans-81.5131.8171.2-58.3-24.9000108.7N402 R405 I477N402-D475 PolarHBondContact ND2-O 2.93Å; N402-D475 PolarHBondContact OD1-N 2.91Å; N402-D475 VanDerWaalsContact OD1-N 3.17Å; R405-D475 IonicContact CZ-OD1 3.67Å; R405-D475 IonicContact CZ-OD2 3.41Å; R405-D475 IonicContact NH1-OD1 2.81Å; R405-D475 PolarHBondContact NH1-OD1 2.68Å; R405-D475 IonicContact NH1-OD2 3.26Å; R405-D475 PolarHBondContact NH1-OD2 2.9Å; R405-D475 IonicContact NH2-OD1 3.56Å; R405-D475 IonicContact NH2-OD2 2.8Å; R405-D475 PolarHBondContact NH2-OD2 3.1Å; D475-I477 PolarHBondContact O-N 3.45Å
476D82.1Confident81.1Confident104 Ų10486.7 Ų86.756%0.55646%0.455SS*.PPolyproline II helixtrans-72116.2173.4-171.63.7000109.7S478D476-S478 VanDerWaalsContact C-N 3.32Å; D476-S478 WeakPolarHBondContact OD1-CB 3.27Å; D476-S478 PolarHBondContact OD1-N 3.49Å; D476-S478 PolarHBondContact OD1-OG 3.29Å
477I81.3Confident81Confident4 Ų490.3 Ų90.32%0.02147%0.472CS..  trans-82.3-18.1-178.9-48.9171.2000110.1M395 P398 F399 N402 D475 E479 V480 L481M395-I477 HydrophobicContact CG-CG2 4.1Å; P398-I477 HydrophobicContact CB-CG1 4.42Å; F399-I477 HydrophobicContact CB-CD1 4.02Å; F399-I477 HydrophobicContact CD2-CD1 3.85Å; F399-I477 HydrophobicContact CG-CD1 4.28Å; N402-I477 WeakPolarHBondContact ND2-CD1 3.33Å; D475-I477 PolarHBondContact O-N 3.45Å; I477-E479 VanDerWaalsContact C-N 3.31Å; I477-E479 PolarHBondContact O-N 3.27Å; I477-V480 WeakPolarHBondContact O-CA 3.3Å; I477-V480 PolarHBondContact O-N 2.84Å; I477-L481 HydrophobicContact CG2-CD2 3.94Å; I477-L481 HydrophobicContact CG2-CG 4.08Å; I477-L481 WeakPolarHBondContact O-CG 3.03Å; I477-L481 PolarHBondContact O-N 3.41Å
478S80.6Confident81Confident57 Ų5786.1 Ų86.140%0.39945%0.45SS..Hα-helixtrans-57.1-41.1-169.3-51.40000112.9D476 V480 L481D476-S478 VanDerWaalsContact C-N 3.32Å; D476-S478 WeakPolarHBondContact OD1-CB 3.27Å; D476-S478 PolarHBondContact OD1-N 3.49Å; D476-S478 PolarHBondContact OD1-OG 3.29Å; S478-V480 VanDerWaalsContact C-N 3.25Å; S478-V480 PolarHBondContact O-N 3.34Å; S478-L481 PolarHBondContact O-N 2.88Å
479E77.6Confident81.1Confident162 Ų16287.3 Ų87.376%0.75745%0.451SS*.Hα-helixtrans-66-28.1177.5-60.1-173.1167.800112.9I477I477-E479 VanDerWaalsContact C-N 3.31Å; I477-E479 PolarHBondContact O-N 3.27Å
480V81.8Confident81.5Confident33 Ų3385.2 Ų85.220%0.243%0.431CS..Hα-helixtrans-90.7-19.6-176.3-168.80000111.9L394 M395 I477 S478 E482 I483L394-V480 HydrophobicContact CB-CG1 3.97Å; L394-V480 WeakPolarHBondContact O-CG1 3.33Å; M395-V480 HydrophobicContact CB-CG1 4.3Å; I477-V480 WeakPolarHBondContact O-CA 3.3Å; I477-V480 PolarHBondContact O-N 2.84Å; S478-V480 VanDerWaalsContact C-N 3.25Å; S478-V480 PolarHBondContact O-N 3.34Å; V480-E482 VanDerWaalsContact C-N 3.29Å; V480-E482 PolarHBondContact O-N 2.88Å; V480-I483 HydrophobicContact CB-CD1 4.42Å; V480-I483 HydrophobicContact CG1-CD1 4.1Å
481L80.9Confident82Confident12 Ų1288.7 Ų88.76%0.06344%0.441CS..Hα-helixtrans-61.6-35.5-177.2-73.8177.5000113.2A354 F357 H358 M395 I477 S478A354-L481 HydrophobicContact CB-CB 4.12Å; A354-L481 WeakPolarHBondContact CB-O 3.43Å; F357-L481 HydrophobicContact CB-CD2 3.62Å; H358-L481 HydrophobicContact CB-CD1 3.79Å; M395-L481 HydrophobicContact CE-CD2 4.04Å; M395-L481 WeakPolarHBondContact CE-O 3.39Å; M395-L481 HydrophobicContact CG-CD2 3.73Å; M395-L481 HydrophobicContact SD-CD2 3.51Å; M395-L481 VanDerWaalsContact SD-CD2 3.51Å; I477-L481 HydrophobicContact CG2-CD2 3.94Å; I477-L481 HydrophobicContact CG2-CG 4.08Å; I477-L481 WeakPolarHBondContact O-CG 3.03Å; I477-L481 PolarHBondContact O-N 3.41Å; S478-L481 PolarHBondContact O-N 2.88Å
482E80.6Confident82.3Confident155 Ų15587.9 Ų87.972%0.72443%0.433SS*.THydrogen-bonded Turntrans-96.9-5.8-170.6-59.8-166.2157.700114A354 V480 T484A354-E482 HydrophobicContact CB-CG 4.44Å; V480-E482 VanDerWaalsContact C-N 3.29Å; V480-E482 PolarHBondContact O-N 2.88Å; E482-T484 PolarHBondContact O-N 3.28Å; E482-T484 VanDerWaalsContact O-N 3.11Å
483I83.3Confident83Confident43 Ų4385 Ų8522%0.22142%0.423CS..  trans-60.9118.7-175.6-58.8178.8000110.6V480 L488V480-I483 HydrophobicContact CB-CD1 4.42Å; V480-I483 HydrophobicContact CG1-CD1 4.1Å; I483-L488 HydrophobicContact CG2-CB 4.29Å
484T84.6Confident83.1Confident65 Ų6583.6 Ų83.640%0.39942%0.415SS..  trans-86.9156.7174.765.10000111.2E482 Y486 E487 L488E482-T484 PolarHBondContact O-N 3.28Å; E482-T484 VanDerWaalsContact O-N 3.11Å; T484-Y486 PolarHBondContact O-N 3.19Å; T484-E487 PolarHBondContact N-OE2 2.89Å; T484-E487 PolarHBondContact O-N 2.75Å; T484-E487 VanDerWaalsContact OG1-CG 3.27Å; T484-E487 WeakPolarHBondContact OG1-CG 3.37Å; T484-E487 PolarHBondContact OG1-N 3.31Å; T484-E487 PolarHBondContact OG1-OE2 3.34Å; T484-L488 PolarHBondContact O-N 3.34Å
485S84.9Confident82.2Confident81 Ų8185.5 Ų85.557%0.56643%0.434SS*.Hα-helixtrans-61.4-27.6175.6-53.10000112.1M489S485-M489 WeakPolarHBondContact O-CB 3.46Å; S485-M489 PolarHBondContact O-N 3.42Å; S485-M489 VanDerWaalsContact O-N 3.1Å
486Y86.8Confident81.4Confident152 Ų15287.4 Ų87.460%0.59645%0.449SS*.Hα-helixtrans-68.7-49.2175.6178.5-92000111.4T484 L488 M489 E490T484-Y486 PolarHBondContact O-N 3.19Å; Y486-L488 VanDerWaalsContact C-N 3.31Å; Y486-L488 PolarHBondContact O-N 3.4Å; Y486-M489 HydrophobicContact CD2-CE 4.24Å; Y486-M489 HydrophobicContact CE2-CE 4.47Å; Y486-M489 PolarHBondContact O-N 3.05Å; Y486-E490 WeakPolarHBondContact CE1-OE2 3.14Å; Y486-E490 WeakPolarHBondContact O-CB 3.25Å; Y486-E490 PolarHBondContact O-N 2.93Å
487E86.4Confident80.3Confident94 Ų9491.9 Ų91.944%0.43947%0.466SS..Hα-helixtrans-63.9-37.3177.6-71.3158.7161.900112T484 E490 R491T484-E487 PolarHBondContact N-OE2 2.89Å; T484-E487 PolarHBondContact O-N 2.75Å; T484-E487 VanDerWaalsContact OG1-CG 3.27Å; T484-E487 WeakPolarHBondContact OG1-CG 3.37Å; T484-E487 PolarHBondContact OG1-N 3.31Å; T484-E487 PolarHBondContact OG1-OE2 3.34Å; E487-E490 PolarHBondContact O-N 3.15Å; E487-R491 WeakPolarHBondContact O-CB 3.44Å; E487-R491 PolarHBondContact O-N 3.35Å
488L86.4Confident79.3Confident11 Ų1194.7 Ų94.76%0.05849%0.486CS..Hα-helixtrans-60.3-49.1174.5-175.763.2000110.6P390 T391 L394 I483 T484 Y486 E490 R491 D492P390-L488 HydrophobicContact CB-CD2 4.17Å; T391-L488 HydrophobicContact CG2-CB 4.26Å; T391-L488 HydrophobicContact CG2-CD2 3.78Å; L394-L488 HydrophobicContact CD1-CD1 4.03Å; L394-L488 HydrophobicContact CD1-CD2 4.49Å; I483-L488 HydrophobicContact CG2-CB 4.29Å; T484-L488 PolarHBondContact O-N 3.34Å; Y486-L488 VanDerWaalsContact C-N 3.31Å; Y486-L488 PolarHBondContact O-N 3.4Å; L488-E490 PolarHBondContact O-N 2.96Å; L488-R491 WeakPolarHBondContact O-CB 3.28Å; L488-R491 PolarHBondContact O-N 3.04Å; L488-D492 PolarHBondContact O-N 3.38Å
489M86.8Confident78.3Confident100 Ų100102.1 Ų102.149%0.49351%0.511SS..Hα-helixtrans-62.4-41176.2-177.2-178.776.200112S485 Y486 R491 D492 L493S485-M489 WeakPolarHBondContact O-CB 3.46Å; S485-M489 PolarHBondContact O-N 3.42Å; S485-M489 VanDerWaalsContact O-N 3.1Å; Y486-M489 HydrophobicContact CD2-CE 4.24Å; Y486-M489 HydrophobicContact CE2-CE 4.47Å; Y486-M489 PolarHBondContact O-N 3.05Å; M489-R491 VanDerWaalsContact C-N 3.33Å; M489-R491 PolarHBondContact O-N 3.49Å; M489-D492 PolarHBondContact O-N 3.46Å; M489-L493 HydrophobicContact CE-CD1 4.5Å; M489-L493 HydrophobicContact CG-CD1 3.93Å; M489-L493 HydrophobicContact CG-CG 4.34Å; M489-L493 WeakPolarHBondContact O-CB 3.16Å; M489-L493 VanDerWaalsContact O-CG 3.22Å; M489-L493 WeakPolarHBondContact O-CG 3.19Å; M489-L493 PolarHBondContact O-N 3.09Å
490E87.8Confident78Confident83 Ų8399.3 Ų99.339%0.38851%0.509SS..Hα-helixtrans-63.3-40.3177.2-170.4-175.116300111.6Y486 E487 L488 D492 L493 K494Y486-E490 WeakPolarHBondContact CE1-OE2 3.14Å; Y486-E490 WeakPolarHBondContact O-CB 3.25Å; Y486-E490 PolarHBondContact O-N 2.93Å; E487-E490 PolarHBondContact O-N 3.15Å; L488-E490 PolarHBondContact O-N 2.96Å; E490-D492 VanDerWaalsContact C-N 3.31Å; E490-D492 PolarHBondContact O-N 3.15Å; E490-L493 PolarHBondContact O-N 3.44Å; E490-K494 WeakPolarHBondContact O-CG 3.47Å; E490-K494 PolarHBondContact O-N 2.82Å; E490-K494 VanDerWaalsContact O-N 3.12Å
491R85.2Confident77.8Confident113 Ų113105.2 Ų105.243%0.42653%0.533SS..Hα-helixtrans-62.5-40.1175.1-170.8-175.167.5161.75.1111.5D458 E487 L488 M489 K494D458-R491 IonicContact OD2-CZ 2.75Å; D458-R491 IonicContact OD2-NH2 3.55Å; D458-R491 PolarHBondContact OD2-NH2 3.17Å; E487-R491 WeakPolarHBondContact O-CB 3.44Å; E487-R491 PolarHBondContact O-N 3.35Å; L488-R491 WeakPolarHBondContact O-CB 3.28Å; L488-R491 PolarHBondContact O-N 3.04Å; M489-R491 VanDerWaalsContact C-N 3.33Å; M489-R491 PolarHBondContact O-N 3.49Å; R491-K494 PolarHBondContact O-N 3.06Å
492D82Confident77.7Confident84 Ų84110.7 Ų110.745%0.44957%0.569SS.*Hα-helixtrans-75.2-27.8179.5-61.8-14.9000112.5H456 L488 M489 E490H456-D492 IonicContact NE2-OD2 3.63Å; H456-D492 PolarHBondContact NE2-OD2 3.35Å; L488-D492 PolarHBondContact O-N 3.38Å; M489-D492 PolarHBondContact O-N 3.46Å; E490-D492 VanDerWaalsContact C-N 3.31Å; E490-D492 PolarHBondContact O-N 3.15Å
493L83.6Confident77.8Confident127 Ų127111.1 Ų111.167%0.66558%0.575SS**Hα-helixtrans-78.1-18.4175.1-73.9172.3000113.3M489 E490M489-L493 HydrophobicContact CE-CD1 4.5Å; M489-L493 HydrophobicContact CG-CD1 3.93Å; M489-L493 HydrophobicContact CG-CG 4.34Å; M489-L493 WeakPolarHBondContact O-CB 3.16Å; M489-L493 VanDerWaalsContact O-CG 3.22Å; M489-L493 WeakPolarHBondContact O-CG 3.19Å; M489-L493 PolarHBondContact O-N 3.09Å; E490-L493 PolarHBondContact O-N 3.44Å
494K80.9Confident77.7Confident125 Ų125116.5 Ų116.554%0.54360%0.6SS.*SBendtrans-61.6128.6174.9-78.8171.4-172.8176.30108.4E490 R491 T496E490-K494 WeakPolarHBondContact O-CG 3.47Å; E490-K494 PolarHBondContact O-N 2.82Å; E490-K494 VanDerWaalsContact O-N 3.12Å; R491-K494 PolarHBondContact O-N 3.06Å; K494-T496 PolarHBondContact O-N 3.5Å
495P62.3Low77.4Confident126 Ų126122.8 Ų122.882%0.81862%0.622SS**  trans-62.4109.1-174.523.9-32.2000109.4
496T62.7Low77Confident104 Ų104125 Ų12564%0.63862%0.623SS**  trans-61.8138.2160.333.30000108K494 S498K494-T496 PolarHBondContact O-N 3.5Å; T496-S498 PolarHBondContact O-N 2.94Å
497E61Low76.2Confident199 Ų199123.7 Ų123.793%0.9363%0.631SS**SBendtrans-60.34.9-174-62.4-176152.900115.2K499E497-K499 PolarHBondContact O-N 2.75Å
498S60Low75.3Confident62 Ų62122.6 Ų122.643%0.43464%0.638SS.*  trans-77.6104.4177.855.30000112.1T496 S500T496-S498 PolarHBondContact O-N 2.94Å; S498-S500 VanDerWaalsContact C-N 3.29Å; S498-S500 PolarHBondContact O-N 3.38Å
499K58.2Low74.4Confident214 Ų214125.4 Ų125.493%0.9366%0.663SS**  trans-76.8-1.1-179-74.9177.4176.6173.90115.6E497E497-K499 PolarHBondContact O-N 2.75Å
500S71.8Confident73.5Confident102 Ų102126.1 Ų126.171%0.71367%0.665SS**  trans-132.2110.6-176.8-176.10000110.3S498S498-S500 VanDerWaalsContact C-N 3.29Å; S498-S500 PolarHBondContact O-N 3.38Å
501F77.6Confident72.3Confident158 Ų158126.6 Ų126.669%0.69367%0.67SS**  trans-88126.4171.3-62.5-79.7000108.7L503F501-L503 PolarHBondContact O-N 3.17Å
502P79.7Confident71.4Confident127 Ų127129.3 Ų129.383%0.82569%0.692SS**  trans-63.9135.2175.326.8-32.4000109.7
503L81.6Confident70.5Confident164 Ų164131.5 Ų131.586%0.85970%0.699SS**  trans-104.1146.9174.8-65.7172.7000109.5F501 F505F501-L503 PolarHBondContact O-N 3.17Å; L503-F505 PolarHBondContact O-N 3.09Å
504E81.3Confident69.2Low156 Ų156129 Ų12973%0.72970%0.704SS**  trans-64.6130.1174-165.860-140.200109.8
505F78.3Confident67.8Low196 Ų196133.4 Ų133.486%0.8672%0.718SS**SBendtrans-73.3-33.4-179.8180-100.7000111.8L503 T507L503-F505 PolarHBondContact O-N 3.09Å; F505-T507 PolarHBondContact O-N 3.2Å
506E76.3Confident67.4Low127 Ų127130.6 Ų130.659%0.59371%0.711SS**SBendtrans-82.9111.4178.1-63.9-172.1172.400110.6A508 H522E506-A508 PolarHBondContact O-N 3.21Å; E506-H522 IonicContact OE2-CE1 3.59Å
507T71Confident67Low125 Ų125133.4 Ų133.477%0.76772%0.717SS**  trans-81.6119.7177.353.50000110.6F505 A509F505-T507 PolarHBondContact O-N 3.2Å; T507-A509 VanDerWaalsContact C-N 3.27Å; T507-A509 PolarHBondContact O-N 2.96Å
508A67.6Low66.6Low71 Ų71127.7 Ų127.759%0.58770%0.695SS**  trans-76.475.2177.400000111.4E506 H510 L511E506-A508 PolarHBondContact O-N 3.21Å; A508-H510 VanDerWaalsContact C-N 3.26Å; A508-H510 PolarHBondContact O-N 3.13Å; A508-L511 HydrophobicContact CB-CB 4.15Å; A508-L511 HydrophobicContact CB-CD1 4.2Å
509A67.3Low66.2Low71 Ų71129 Ų12959%0.58770%0.697SS**THydrogen-bonded Turntrans-63.4-27.6-177.300000113.8T507T507-A509 VanDerWaalsContact C-N 3.27Å; T507-A509 PolarHBondContact O-N 2.96Å
510H67.4Low65.9Low115 Ų115120.9 Ų120.953%0.53268%0.675SS.*THydrogen-bonded Turntrans-108.414.2-173.3-57.7-62.9000114.4A508 L512 E513A508-H510 VanDerWaalsContact C-N 3.26Å; A508-H510 PolarHBondContact O-N 3.13Å; H510-L512 VanDerWaalsContact C-N 3.25Å; H510-L512 PolarHBondContact O-N 3.09Å; H510-E513 HydrophobicContact CB-CB 4.5Å; H510-E513 IonicContact CE1-OE2 3.49Å; H510-E513 IonicContact CG-OE2 3.68Å; H510-E513 IonicContact ND1-OE2 3.64Å; H510-E513 PolarHBondContact ND1-OE2 2.8Å; H510-E513 PolarHBondContact O-N 2.68Å
511L62.4Low64.9Low93 Ų93126.5 Ų126.549%0.48768%0.68SS.*THydrogen-bonded Turntrans-61.7-31.6-173.8-160.182.2000113.4A508 L519 F523A508-L511 HydrophobicContact CB-CB 4.15Å; A508-L511 HydrophobicContact CB-CD1 4.2Å; L511-L519 HydrophobicContact CD1-CD2 4.47Å; L511-F523 HydrophobicContact CD1-CE2 4Å
512L66.7Low63.7Low169 Ų169124.9 Ų124.989%0.88568%0.675SS**THydrogen-bonded Turntrans-105.7-4.7-178.9-63.8171.8000112.9H510 G514H510-L512 VanDerWaalsContact C-N 3.25Å; H510-L512 PolarHBondContact O-N 3.09Å; L512-G514 PolarHBondContact O-N 3.26Å
513E62Low62.3Low130 Ų130125.6 Ų125.661%0.60767%0.665SS**SBendtrans-91.383.9179.5-67.7-174.9163.400108.7H510 R515H510-E513 HydrophobicContact CB-CB 4.5Å; H510-E513 IonicContact CE1-OE2 3.49Å; H510-E513 IonicContact CG-OE2 3.68Å; H510-E513 IonicContact ND1-OE2 3.64Å; H510-E513 PolarHBondContact ND1-OE2 2.8Å; H510-E513 PolarHBondContact O-N 2.68Å; E513-R515 PolarHBondContact O-N 2.81Å
514G56.9Low60.2Low75 Ų75122.3 Ų122.377%0.77366%0.655SS**SBendtrans-48.2116.7-16900000116.1L512L512-G514 PolarHBondContact O-N 3.26Å
515R51.1Low58Low218 Ų218123.5 Ų123.582%0.82367%0.665SS**  -159.4123.6124.6-95.1174-165.6-156.93.6105E513 E517E513-R515 PolarHBondContact O-N 2.81Å; R515-E517 PolarHBondContact O-N 3.23Å
516G54.7Low55.9Low66 Ų66122.3 Ų122.368%0.6869%0.691SS**THydrogen-bonded Turntrans-62.121.7-168.200000117.7
517E54.7Low54.9Low163 Ų163122.1 Ų122.176%0.76270%0.696SS**THydrogen-bonded Turntrans-78.3-28.5177.5-68.8-178.117400112.8R515R515-E517 PolarHBondContact O-N 3.23Å
518V51.4Low54.1Low79 Ų79121.9 Ų121.948%0.47969%0.693SS.*THydrogen-bonded Turntrans-82.6-31.9-177.6-173.20000112.6G520 R521V518-G520 PolarHBondContact O-N 3.26Å; V518-R521 PolarHBondContact O-N 3.42Å
519L51.9Low53.3Low89 Ų89124.7 Ų124.747%0.46670%0.698SS.*Hα-helixtrans-62-31.4175.9-83.3153.1000112.2L511 R521 F523L511-L519 HydrophobicContact CD1-CD2 4.47Å; L519-R521 VanDerWaalsContact C-N 3.3Å; L519-R521 PolarHBondContact O-N 2.97Å; L519-F523 HydrophobicContact CD2-CD2 3.87Å; L519-F523 HydrophobicContact CD2-CE2 4.46Å; L519-F523 HydrophobicContact CD2-CG 4.39Å; L519-F523 WeakPolarHBondContact O-CB 3.38Å; L519-F523 PolarHBondContact O-N 2.7Å
520G51.9Low52.5Low45 Ų45127.9 Ų127.946%0.46471%0.705SS.*Hα-helixtrans-74.6-8.2178.100000115.5V518 C524V518-G520 PolarHBondContact O-N 3.26Å; G520-C524 PolarHBondContact O-SG 3.46Å
521R51.6Low51.6Low219 Ų219128.7 Ų128.783%0.82672%0.716SS**Hα-helixtrans-96-27.9175.5-81.5-174.7175.9171.10.5113.9V518 L519V518-R521 PolarHBondContact O-N 3.42Å; L519-R521 VanDerWaalsContact C-N 3.3Å; L519-R521 PolarHBondContact O-N 2.97Å
522H51.9Low50.8Low124 Ų124131.1 Ų131.157%0.57473%0.731SS**Hα-helixtrans-117.6-18.4-173.3-63.5-84.7000114E506E506-H522 IonicContact OE2-CE1 3.59Å
523F49.6Very low49.7Very low142 Ų142128.4 Ų128.462%0.62372%0.72SS**  trans-121.435.1-179.4-68.5-86000112.8L511 L519 L525L511-F523 HydrophobicContact CD1-CE2 4Å; L519-F523 HydrophobicContact CD2-CD2 3.87Å; L519-F523 HydrophobicContact CD2-CE2 4.46Å; L519-F523 HydrophobicContact CD2-CG 4.39Å; L519-F523 WeakPolarHBondContact O-CB 3.38Å; L519-F523 PolarHBondContact O-N 2.7Å; F523-L525 PolarHBondContact O-N 3.16Å
524C38.7Very low48.8Very low96 Ų96128.2 Ų128.265%0.64973%0.729SS**  trans-69.7114.1164.3-79.20000109.1G520 A526G520-C524 PolarHBondContact O-SG 3.46Å; C524-A526 PolarHBondContact O-N 3.36Å; C524-A526 VanDerWaalsContact O-N 3.12Å
525L34.5Very low48.1Very low180 Ų180132.7 Ų132.794%0.94273%0.725SS**  trans-54.6113.1160-81.8149.7000107.7F523F523-L525 PolarHBondContact O-N 3.16Å
526A34.9Very low47.8Very low171 Ų171124.9 Ų124.9100%1.41372%0.716SS**  trans-79.50171.500000110.9C524C524-A526 PolarHBondContact O-N 3.36Å; C524-A526 VanDerWaalsContact O-N 3.12Å

Retrieved 526 of 526 residues in 163.4 ms (Link to these results)