A0A060WAF5_ONCMY Loading...

Transcriptional adaptor 3 (NGG1 homolog, yeast)-like

AlphaFold DB , UniProt , Accession A0A060WAF5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene tada3l, Length 431 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M39.6Very low60.8Low242 Ų242132.7 Ų132.7100%1.19270%0.699SS**  071.60-73.3-140.2-76.400108.9
2S45.1Very low62.2Low115 Ų115139.5 Ų139.580%0.80471%0.711SS**  trans-143.735.3-163.6-43.40000114.1
3E43.5Very low63.5Low190 Ų190135.7 Ų135.789%0.88868%0.684SS**  trans-127.545.1179.6-65.3-157.2160.600113.3
4L50.4Low64.7Low162 Ų162135.4 Ų135.485%0.84869%0.685SS**  trans-117.617.3173.9-127.387.4000113.6
5K55.8Low65.8Low203 Ų203130.9 Ų130.988%0.88366%0.659SS**SBendtrans-93.6-12.1-174-99.5-177.8176.2-178.40115.4
6D60.7Low66.6Low139 Ų139132.4 Ų132.474%0.74366%0.66SS**SBendtrans-110.915.2-171.8-77.3-12000114.2W75D6-W75 WeakPolarHBondContact O-CZ2 3.4Å
7C62.5Low67.3Low96 Ų96130.3 Ų130.365%0.64966%0.658SS**SBendtrans-92139.2175.8-65.80000111.4
8P69.5Low68.3Low25 Ų25125.1 Ų125.116%0.16263%0.634CS.*  trans-59.2140.617222.7-29.9000110L10 I71 L72 W75P8-L10 HydrophobicContact CB-CG 4.33Å; P8-L10 HydrophobicContact CG-CD1 4.37Å; P8-L10 HydrophobicContact CG-CG 4.25Å; P8-L10 PolarHBondContact O-N 2.7Å; P8-I71 HydrophobicContact CB-CG2 4.44Å; P8-L72 HydrophobicContact CB-CD2 4.21Å; P8-L72 HydrophobicContact CG-CD2 3.67Å; P8-W75 HydrophobicContact CB-CB 4.08Å; P8-W75 HydrophobicContact CB-CD2 4.1Å; P8-W75 HydrophobicContact CB-CG 3.78Å; P8-W75 HydrophobicContact CG-CD2 4.15Å; P8-W75 HydrophobicContact CG-CE3 4.35Å; P8-W75 HydrophobicContact CG-CG 4.35Å
9P76.9Confident69.3Low104 Ų104124.5 Ų124.568%0.67563%0.629SS**  trans-76.670.9-177.432.9-35.9000110.6I71P9-I71 HydrophobicContact CG-CG2 4.47Å
10L82.1Confident70.3Confident55 Ų55121.6 Ų121.629%0.28861%0.612SS.*  trans-77.2135.9178-61.6177.1000110.9P8 Q68 I71 L72P8-L10 HydrophobicContact CB-CG 4.33Å; P8-L10 HydrophobicContact CG-CD1 4.37Å; P8-L10 HydrophobicContact CG-CG 4.25Å; P8-L10 PolarHBondContact O-N 2.7Å; L10-Q68 HydrophobicContact CD2-CB 4.32Å; L10-I71 HydrophobicContact CD2-CB 4.47Å; L10-I71 HydrophobicContact CD2-CG2 4.15Å; L10-L72 HydrophobicContact CD1-CD1 4.44Å; L10-L72 HydrophobicContact CD1-CD2 3.86Å; L10-L72 HydrophobicContact CD1-CG 4.31Å; L10-L72 HydrophobicContact CD2-CD1 4.49Å; L10-L72 HydrophobicContact CD2-CD2 3.97Å; L10-L72 HydrophobicContact CD2-CG 3.85Å; L10-L72 HydrophobicContact CG-CD2 4.31Å
11K83.3Confident71.1Confident129 Ų129120.6 Ų120.656%0.56161%0.612SS**  trans-89.9121168.2-67.1178.4-176.4168.20108.7Y13K11-Y13 HydrophobicContact CB-CD2 4.33Å; K11-Y13 HydrophobicContact CB-CE2 3.78Å; K11-Y13 WeakPolarHBondContact O-CD2 3.39Å; K11-Y13 PolarHBondContact O-N 3.38Å
12Y76.8Confident73.4Confident214 Ų214116.5 Ų116.584%0.83959%0.588SS**  trans-80.6110.7169.9-65.7-84.2000108.8
13Y80.1Confident75.5Confident90 Ų90115 Ų11535%0.35357%0.573SS.*  trans-89.3124.6174.9-69.8-87.8000109.8K11 F15 A64 Q68K11-Y13 HydrophobicContact CB-CD2 4.33Å; K11-Y13 HydrophobicContact CB-CE2 3.78Å; K11-Y13 WeakPolarHBondContact O-CD2 3.39Å; K11-Y13 PolarHBondContact O-N 3.38Å; Y13-F15 VanDerWaalsContact CB-CZ 3.4Å; Y13-F15 HydrophobicContact CD1-CE1 4.31Å; Y13-F15 HydrophobicContact CD2-CZ 4.2Å; Y13-F15 AromaticContact CG-CE1 3.99Å; Y13-F15 HydrophobicContact CG-CE1 3.99Å; Y13-F15 AromaticContact CG-CZ 3.83Å; Y13-F15 HydrophobicContact CG-CZ 3.83Å; Y13-F15 PolarHBondContact O-N 2.93Å; Y13-A64 HydrophobicContact CD1-CB 4.41Å; Y13-A64 HydrophobicContact CD2-CB 4.28Å; Y13-A64 HydrophobicContact CE1-CB 4.13Å; Y13-A64 HydrophobicContact CE2-CB 4.01Å; Y13-A64 HydrophobicContact CG-CB 4.48Å; Y13-Q68 HydrophobicContact CD2-CG 4.29Å; Y13-Q68 HydrophobicContact CE2-CG 3.89Å
14D79.1Confident77.8Confident131 Ų131105.9 Ų105.970%0.70153%0.531SS*.  trans-81.894.3164.5-179.821.9000108.8K16D14-K16 PolarHBondContact O-N 3.23Å; D14-K16 VanDerWaalsContact O-N 3.14Å; D14-K16 VanDerWaalsContact OD2-CE 3.29Å; D14-K16 WeakPolarHBondContact OD2-CE 3.34Å
15F81.8Confident79.8Confident68 Ų68101.9 Ų101.930%0.29852%0.515SS..  trans-80.993.7-179.7-67.2-55.3000110.9Y13 R61 A64 L65Y13-F15 VanDerWaalsContact CB-CZ 3.4Å; Y13-F15 HydrophobicContact CD1-CE1 4.31Å; Y13-F15 HydrophobicContact CD2-CZ 4.2Å; Y13-F15 AromaticContact CG-CE1 3.99Å; Y13-F15 HydrophobicContact CG-CE1 3.99Å; Y13-F15 AromaticContact CG-CZ 3.83Å; Y13-F15 HydrophobicContact CG-CZ 3.83Å; Y13-F15 PolarHBondContact O-N 2.93Å; F15-R61 HydrophobicContact CD1-CB 3.92Å; F15-R61 HydrophobicContact CD1-CG 3.39Å; F15-R61 HydrophobicContact CE1-CB 3.78Å; F15-R61 HydrophobicContact CE1-CG 3.7Å; F15-R61 HydrophobicContact CG-CB 4.49Å; F15-R61 HydrophobicContact CG-CG 4.09Å; F15-R61 HydrophobicContact CZ-CB 4.27Å; F15-A64 HydrophobicContact CE1-CB 4.22Å; F15-A64 HydrophobicContact CZ-CB 4.11Å; F15-L65 HydrophobicContact CE2-CD1 4.16Å; F15-L65 HydrophobicContact CE2-CD2 3.74Å; F15-L65 HydrophobicContact CE2-CG 3.79Å; F15-L65 HydrophobicContact CZ-CD2 4.18Å; F15-L65 HydrophobicContact CZ-CG 3.92Å
16K78.8Confident81.5Confident155 Ų15596.1 Ų96.167%0.67449%0.488SS*.PPolyproline II helixtrans-71.9123.6169.1-62.6-172.8179.9-177.70109.8D14D14-K16 PolarHBondContact O-N 3.23Å; D14-K16 VanDerWaalsContact O-N 3.14Å; D14-K16 VanDerWaalsContact OD2-CE 3.29Å; D14-K16 WeakPolarHBondContact OD2-CE 3.34Å
17P78.7Confident83Confident97 Ų9792.6 Ų92.663%0.6346%0.464SS*.PPolyproline II helixtrans-62.4151.7173.626.5-32.3000109.9E19P17-E19 PolarHBondContact O-N 3.03Å
18V84.9Confident84.5Confident36 Ų3689.8 Ų89.822%0.21844%0.444CS..PPolyproline II helixtrans-66.1124.8171.9-178.20000107.7H20 V23 L54 S57V18-H20 PolarHBondContact O-N 3.5Å; V18-V23 HydrophobicContact CG1-CB 4.16Å; V18-V23 HydrophobicContact CG1-CG1 4.41Å; V18-V23 HydrophobicContact CG1-CG2 4.47Å; V18-L54 HydrophobicContact CB-CD2 3.82Å; V18-L54 HydrophobicContact CG1-CD2 3.86Å; V18-L54 HydrophobicContact CG2-CD2 4.35Å; V18-S57 WeakPolarHBondContact CG2-OG 3.25Å
19E87.8Confident85.5Confident115 Ų11590.9 Ų90.954%0.53746%0.455SS..  trans-7178.7173.2-68.2-175.7-166.400109.5P17 V21 K22 V23P17-E19 PolarHBondContact O-N 3.03Å; E19-V21 PolarHBondContact O-N 3.45Å; E19-V21 VanDerWaalsContact O-N 3.12Å; E19-K22 PolarHBondContact O-N 3.08Å; E19-K22 VanDerWaalsContact OE2-CD 3.23Å; E19-K22 WeakPolarHBondContact OE2-CD 3.46Å; E19-K22 WeakPolarHBondContact OE2-CE 3.42Å; E19-K22 IonicContact OE2-NZ 3.54Å; E19-K22 PolarHBondContact OE2-NZ 3.18Å; E19-V23 PolarHBondContact O-N 3.45Å
20H88Confident86.1Confident66 Ų6687.5 Ų87.531%0.30643%0.432SS..Hα-helixtrans-57.7-29.4-175.666.280.2000112.2V18 K22 C24 Y27 T28 L54V18-H20 PolarHBondContact O-N 3.5Å; H20-K22 PolarHBondContact O-N 3.17Å; H20-C24 HydrophobicContact CB-CB 4.07Å; H20-C24 CarbonylContact O-C 3.58Å; H20-C24 WeakPolarHBondContact O-CA 3.39Å; H20-C24 PolarHBondContact O-N 2.97Å; H20-Y27 HydrophobicContact CB-CD1 4.08Å; H20-Y27 HydrophobicContact CB-CE1 4.27Å; H20-T28 VanDerWaalsContact C-OG1 3.32Å; H20-T28 PolarHBondContact ND1-OG1 3.21Å; H20-T28 PolarHBondContact O-OG1 3.46Å; H20-L54 HydrophobicContact CB-CD2 4.35Å
21V88Confident86.5Confident101 Ų10189.9 Ų89.961%0.61245%0.445SS*.Hα-helixtrans-59.8-30.6175.6-175.90000112.3E19 T28E19-V21 PolarHBondContact O-N 3.45Å; E19-V21 VanDerWaalsContact O-N 3.12Å; V21-T28 HydrophobicContact CG2-CG2 4.3Å
22K87.5Confident86.7Confident156 Ų15687.1 Ų87.168%0.67845%0.453SS*.Hα-helixtrans-99.1-37.6178.6-64.3-174.3-169.7152.20113.1E19 H20E19-K22 PolarHBondContact O-N 3.08Å; E19-K22 VanDerWaalsContact OE2-CD 3.23Å; E19-K22 WeakPolarHBondContact OE2-CD 3.46Å; E19-K22 WeakPolarHBondContact OE2-CE 3.42Å; E19-K22 IonicContact OE2-NZ 3.54Å; E19-K22 PolarHBondContact OE2-NZ 3.18Å; H20-K22 PolarHBondContact O-N 3.17Å
23V88.5Confident87.4Confident82 Ų8281.1 Ų81.150%0.49743%0.429SS..Hα-helixtrans-99.5-20.6-169.2-171.30000112.3V18 E19 T53V18-V23 HydrophobicContact CG1-CB 4.16Å; V18-V23 HydrophobicContact CG1-CG1 4.41Å; V18-V23 HydrophobicContact CG1-CG2 4.47Å; E19-V23 PolarHBondContact O-N 3.45Å; V23-T53 HydrophobicContact CG1-CG2 4.25Å
24C92.7Very high87.6Confident0 Ų079.9 Ų79.90%043%0.434CS..  trans-133.864.6-177-51.80000110.8H20 R26 Y27 T28 E50H20-C24 HydrophobicContact CB-CB 4.07Å; H20-C24 CarbonylContact O-C 3.58Å; H20-C24 WeakPolarHBondContact O-CA 3.39Å; H20-C24 PolarHBondContact O-N 2.97Å; C24-R26 PolarHBondContact O-N 3.47Å; C24-Y27 HydrophobicContact CB-CD1 4.37Å; C24-T28 WeakPolarHBondContact O-CB 3.34Å; C24-T28 PolarHBondContact O-N 3.36Å; C24-T28 PolarHBondContact O-OG1 3.04Å; C24-E50 VanDerWaalsContact CA-CD 3.43Å; C24-E50 WeakPolarHBondContact CA-OE2 3.39Å; C24-E50 HydrophobicContact CB-CB 3.97Å; C24-E50 HydrophobicContact CB-CG 4.18Å; C24-E50 WeakPolarHBondContact CB-OE2 3.49Å
25P91.6Very high87.5Confident78 Ų7883.3 Ų83.351%0.50645%0.445SS..Hα-helixtrans-65-34.5-176.326.6-35.7000113.3T28 A29 E50P25-T28 PolarHBondContact O-N 2.9Å; P25-A29 VanDerWaalsContact O-CB 3.32Å; P25-A29 WeakPolarHBondContact O-CB 3.45Å; P25-A29 PolarHBondContact O-N 3.37Å; P25-E50 WeakPolarHBondContact CD-OE1 3.37Å
26R91.7Very high87.5Confident82 Ų8287.6 Ų87.631%0.30947%0.471SS..Hα-helixtrans-68.9-46.4178.1-175.263.564.1165.93.2111.2C24 T28 A29 V30 E43 T46 L47 E50C24-R26 PolarHBondContact O-N 3.47Å; R26-T28 VanDerWaalsContact C-N 3.3Å; R26-T28 PolarHBondContact O-N 3.43Å; R26-A29 PolarHBondContact O-N 2.9Å; R26-V30 WeakPolarHBondContact O-CG2 3.45Å; R26-V30 PolarHBondContact O-N 3.45Å; R26-E43 IonicContact CZ-OE1 2.96Å; R26-E43 IonicContact NH1-OE1 2.98Å; R26-E43 PolarHBondContact NH1-OE1 3Å; R26-T46 HydrophobicContact CB-CG2 4.02Å; R26-T46 HydrophobicContact CG-CG2 4.41Å; R26-L47 HydrophobicContact CG-CB 4.12Å; R26-L47 HydrophobicContact CG-CD1 4.41Å; R26-E50 WeakPolarHBondContact CA-OE2 3.39Å; R26-E50 VanDerWaalsContact CB-OE1 3.31Å; R26-E50 WeakPolarHBondContact CB-OE1 3.46Å; R26-E50 WeakPolarHBondContact CB-OE2 3.47Å; R26-E50 PolarHBondContact N-OE1 2.91Å; R26-E50 PolarHBondContact N-OE2 3.41Å
27Y92.9Very high87.5Confident65 Ų6585.4 Ų85.426%0.25547%0.467SS..Hα-helixtrans-56.1-47173.1171.7-101.8000110.7H20 C24 A29 V30 L31 L47 E50 L51 L54H20-Y27 HydrophobicContact CB-CD1 4.08Å; H20-Y27 HydrophobicContact CB-CE1 4.27Å; C24-Y27 HydrophobicContact CB-CD1 4.37Å; Y27-A29 VanDerWaalsContact C-N 3.34Å; Y27-A29 PolarHBondContact O-N 3.5Å; Y27-V30 PolarHBondContact O-N 3.07Å; Y27-L31 HydrophobicContact CD1-CD1 4.02Å; Y27-L31 HydrophobicContact CE1-CD1 3.41Å; Y27-L31 VanDerWaalsContact CE1-CD1 3.41Å; Y27-L31 HydrophobicContact CE1-CG 4.17Å; Y27-L31 HydrophobicContact CE2-CD1 4.38Å; Y27-L31 HydrophobicContact CE2-CD2 4.4Å; Y27-L31 HydrophobicContact CE2-CG 4.34Å; Y27-L31 WeakPolarHBondContact O-CG 3.33Å; Y27-L31 PolarHBondContact O-N 3.42Å; Y27-L47 HydrophobicContact CD2-CD1 4.39Å; Y27-E50 WeakPolarHBondContact CB-OE2 3.36Å; Y27-E50 PolarHBondContact N-OE2 3.24Å; Y27-L51 HydrophobicContact CD2-CD2 3.67Å; Y27-L51 HydrophobicContact CE2-CD2 3.87Å; Y27-L54 HydrophobicContact CD1-CD1 3.81Å; Y27-L54 HydrophobicContact CD2-CD1 4.23Å; Y27-L54 HydrophobicContact CE1-CD1 3.81Å; Y27-L54 HydrophobicContact CE2-CD1 4.25Å; Y27-L54 HydrophobicContact CG-CD1 4.01Å
28T93.1Very high87.6Confident37 Ų3782.9 Ų82.923%0.22746%0.458CS..Hα-helixtrans-63.4-39.6178.1-56.50000112H20 V21 C24 P25 R26 L31 G32H20-T28 VanDerWaalsContact C-OG1 3.32Å; H20-T28 PolarHBondContact ND1-OG1 3.21Å; H20-T28 PolarHBondContact O-OG1 3.46Å; V21-T28 HydrophobicContact CG2-CG2 4.3Å; C24-T28 WeakPolarHBondContact O-CB 3.34Å; C24-T28 PolarHBondContact O-N 3.36Å; C24-T28 PolarHBondContact O-OG1 3.04Å; P25-T28 PolarHBondContact O-N 2.9Å; R26-T28 VanDerWaalsContact C-N 3.3Å; R26-T28 PolarHBondContact O-N 3.43Å; T28-L31 PolarHBondContact O-N 3.01Å; T28-G32 PolarHBondContact O-N 3.34Å
29A90.6Very high87.8Confident48 Ų4885.6 Ų85.640%0.39747%0.471SS..Hα-helixtrans-65.9-40.217600000112.2P25 R26 Y27 G32P25-A29 VanDerWaalsContact O-CB 3.32Å; P25-A29 WeakPolarHBondContact O-CB 3.45Å; P25-A29 PolarHBondContact O-N 3.37Å; R26-A29 PolarHBondContact O-N 2.9Å; Y27-A29 VanDerWaalsContact C-N 3.34Å; Y27-A29 PolarHBondContact O-N 3.5Å; A29-G32 PolarHBondContact O-N 3.11Å
30V91Very high87.7Confident32 Ų3281.7 Ų81.719%0.19446%0.461CS..Hα-helixtrans-64.9-39.6176.61710000111.2R26 Y27 G32 R33 I39 L47R26-V30 WeakPolarHBondContact O-CG2 3.45Å; R26-V30 PolarHBondContact O-N 3.45Å; Y27-V30 PolarHBondContact O-N 3.07Å; V30-G32 PolarHBondContact O-N 3.42Å; V30-R33 PolarHBondContact O-N 3.21Å; V30-I39 HydrophobicContact CG1-CD1 4.35Å; V30-I39 HydrophobicContact CG1-CG1 4.28Å; V30-L47 HydrophobicContact CG2-CD1 4.42Å; V30-L47 HydrophobicContact CG2-CD2 4.42Å
31L90.4Very high87.6Confident105 Ų10585.5 Ų85.555%0.5548%0.482SS..Hα-helixtrans-60.9-24.2175.4-73.4179.5000113.9Y27 T28Y27-L31 HydrophobicContact CD1-CD1 4.02Å; Y27-L31 HydrophobicContact CE1-CD1 3.41Å; Y27-L31 VanDerWaalsContact CE1-CD1 3.41Å; Y27-L31 HydrophobicContact CE1-CG 4.17Å; Y27-L31 HydrophobicContact CE2-CD1 4.38Å; Y27-L31 HydrophobicContact CE2-CD2 4.4Å; Y27-L31 HydrophobicContact CE2-CG 4.34Å; Y27-L31 WeakPolarHBondContact O-CG 3.33Å; Y27-L31 PolarHBondContact O-N 3.42Å; T28-L31 PolarHBondContact O-N 3.01Å
32G86.9Confident87.6Confident71 Ų7189 Ų8973%0.73249%0.492SS*.THydrogen-bonded Turntrans-89.60.918000000114.9T28 A29 V30T28-G32 PolarHBondContact O-N 3.34Å; A29-G32 PolarHBondContact O-N 3.11Å; V30-G32 PolarHBondContact O-N 3.42Å
33R91.1Very high87.7Confident89 Ų8982.9 Ų82.934%0.33647%0.466SS..SBendtrans-89.5159.8-177.5-67.2179.7-172.9175.60.6112.3V30 D37 E43V30-R33 PolarHBondContact O-N 3.21Å; R33-D37 HydrophobicContact CB-CB 4.28Å; R33-E43 IonicContact CZ-OE1 3.27Å; R33-E43 IonicContact CZ-OE2 2.72Å; R33-E43 IonicContact NH1-OE1 3.93Å; R33-E43 PolarHBondContact NH1-OE1 2.83Å; R33-E43 IonicContact NH1-OE2 3.27Å; R33-E43 PolarHBondContact NH1-OE2 3.06Å; R33-E43 IonicContact NH2-OE1 3.3Å; R33-E43 PolarHBondContact NH2-OE1 3.38Å; R33-E43 IonicContact NH2-OE2 3.35Å
34S84.2Confident87.9Confident64 Ų6483.2 Ų83.245%0.44846%0.464SS..  trans-73.7154.2169.472.80000110.6D36 D37S34-D36 PolarHBondContact O-N 2.95Å; S34-D36 VanDerWaalsContact O-N 3.13Å; S34-D37 PolarHBondContact O-N 2.77Å; S34-D37 VanDerWaalsContact OG-CG 3.32Å; S34-D37 PolarHBondContact OG-OD2 2.91Å
35E78.3Confident87.7Confident202 Ų20289.3 Ų89.394%0.94450%0.497SS*.THydrogen-bonded Turntrans-60.4-22.6180-65.7-174.3160.800112.8
36D80.4Confident87.7Confident159 Ų15988.5 Ų88.585%0.8549%0.491SS*.THydrogen-bonded Turntrans-80.2-18.9-179.3-66.4-37.2000114S34S34-D36 PolarHBondContact O-N 2.95Å; S34-D36 VanDerWaalsContact O-N 3.13Å
37D80.2Confident87.8Confident109 Ų10985.1 Ų85.158%0.58348%0.479SS*.SBendtrans-80.3-16.4-173.5-75.5-45.5000114R33 S34R33-D37 HydrophobicContact CB-CB 4.28Å; S34-D37 PolarHBondContact O-N 2.77Å; S34-D37 VanDerWaalsContact OG-CG 3.32Å; S34-D37 PolarHBondContact OG-OD2 2.91Å
38G80.9Confident87.8Confident43 Ų4385.8 Ų85.844%0.44348%0.484SS..  trans57.7-171.1177.100000115.5
39I88.1Confident87.9Confident94 Ų9489.2 Ų89.248%0.48250%0.501SS..  trans-117.9121.2177.3-59.2170.6000108.2V30 L47V30-I39 HydrophobicContact CG1-CD1 4.35Å; V30-I39 HydrophobicContact CG1-CG1 4.28Å; I39-L47 HydrophobicContact CD1-CD2 3.91Å; I39-L47 HydrophobicContact CG2-CD2 4.04Å
40G86Confident88.1Confident33 Ų3387.8 Ų87.834%0.3449%0.486SS..  trans-72.1147.4177.900000112.1E42 E43G40-E42 PolarHBondContact O-N 3.36Å; G40-E43 PolarHBondContact N-OE2 3.23Å; G40-E43 WeakPolarHBondContact O-CB 3.32Å; G40-E43 PolarHBondContact O-N 2.85Å
41I85.8Confident88.2Confident145 Ų14590 Ų9074%0.74450%0.496SS*.Hα-helixtrans-61.8-32.8-179.3-158.9163.7000112.7E43 L44I41-E43 PolarHBondContact O-N 3.41Å; I41-L44 WeakPolarHBondContact O-CB 3.38Å; I41-L44 PolarHBondContact O-N 3.12Å
42E87.8Confident88.4Confident176 Ų17688.6 Ų88.682%0.82249%0.487SS*.Hα-helixtrans-64.1-23.7176.4-55.3-84.5169.100112.5G40G40-E42 PolarHBondContact O-N 3.36Å
43E90.4Very high88.6Confident27 Ų2788 Ų8813%0.12647%0.469CS..Hα-helixtrans-95-14.3-174.7-53-177.5116.300112.4R26 R33 G40 I41 T46 L47R26-E43 IonicContact CZ-OE1 2.96Å; R26-E43 IonicContact NH1-OE1 2.98Å; R26-E43 PolarHBondContact NH1-OE1 3Å; R33-E43 IonicContact CZ-OE1 3.27Å; R33-E43 IonicContact CZ-OE2 2.72Å; R33-E43 IonicContact NH1-OE1 3.93Å; R33-E43 PolarHBondContact NH1-OE1 2.83Å; R33-E43 IonicContact NH1-OE2 3.27Å; R33-E43 PolarHBondContact NH1-OE2 3.06Å; R33-E43 IonicContact NH2-OE1 3.3Å; R33-E43 PolarHBondContact NH2-OE1 3.38Å; R33-E43 IonicContact NH2-OE2 3.35Å; G40-E43 PolarHBondContact N-OE2 3.23Å; G40-E43 WeakPolarHBondContact O-CB 3.32Å; G40-E43 PolarHBondContact O-N 2.85Å; I41-E43 PolarHBondContact O-N 3.41Å; E43-T46 PolarHBondContact O-N 3.49Å; E43-L47 VanDerWaalsContact O-CB 3.28Å; E43-L47 WeakPolarHBondContact O-CB 3.22Å; E43-L47 PolarHBondContact O-N 2.94Å
44L91.1Very high88.6Confident88 Ų8885.5 Ų85.546%0.46146%0.462SS..Hα-helixtrans-65.4-44.5-168.4-170.363.9000112.2I41 T46 L47 Q48I41-L44 WeakPolarHBondContact O-CB 3.38Å; I41-L44 PolarHBondContact O-N 3.12Å; L44-T46 PolarHBondContact O-N 2.94Å; L44-L47 PolarHBondContact O-N 3.22Å; L44-Q48 WeakPolarHBondContact O-CB 3.5Å; L44-Q48 PolarHBondContact O-N 3.29Å
45D90.2Very high89.1Confident128 Ų12887.7 Ų87.768%0.68447%0.468SS*.Hα-helixtrans-63.8-41.6-179.6-70.8-16.4000111.8L49D45-L49 PolarHBondContact O-N 3.22Å
46T91.7Very high89.7Confident62 Ų6281.2 Ų81.238%0.3845%0.445SS..Hα-helixtrans-69.6-43.4178-56.10000110.8R26 E43 L44 Q48 L49 E50R26-T46 HydrophobicContact CB-CG2 4.02Å; R26-T46 HydrophobicContact CG-CG2 4.41Å; E43-T46 PolarHBondContact O-N 3.49Å; L44-T46 PolarHBondContact O-N 2.94Å; T46-Q48 VanDerWaalsContact C-N 3.33Å; T46-Q48 PolarHBondContact O-N 3.45Å; T46-L49 PolarHBondContact O-N 3.08Å; T46-E50 WeakPolarHBondContact O-CG 3.49Å; T46-E50 PolarHBondContact O-N 2.87Å; T46-E50 VanDerWaalsContact O-N 3.12Å
47L93.4Very high90.1Very high11 Ų1175 Ų756%0.05841%0.414CS..Hα-helixtrans-62.5-41.1177.3-178.962.5000111.4R26 Y27 V30 I39 E43 L44 L49 E50 L51R26-L47 HydrophobicContact CG-CB 4.12Å; R26-L47 HydrophobicContact CG-CD1 4.41Å; Y27-L47 HydrophobicContact CD2-CD1 4.39Å; V30-L47 HydrophobicContact CG2-CD1 4.42Å; V30-L47 HydrophobicContact CG2-CD2 4.42Å; I39-L47 HydrophobicContact CD1-CD2 3.91Å; I39-L47 HydrophobicContact CG2-CD2 4.04Å; E43-L47 VanDerWaalsContact O-CB 3.28Å; E43-L47 WeakPolarHBondContact O-CB 3.22Å; E43-L47 PolarHBondContact O-N 2.94Å; L44-L47 PolarHBondContact O-N 3.22Å; L47-L49 PolarHBondContact O-N 2.69Å; L47-E50 PolarHBondContact O-N 3.44Å; L47-L51 HydrophobicContact CD1-CD1 4.37Å; L47-L51 HydrophobicContact CD1-CG 4.35Å; L47-L51 HydrophobicContact CG-CD1 4.03Å; L47-L51 HydrophobicContact CG-CG 4.45Å; L47-L51 WeakPolarHBondContact O-CB 3.08Å; L47-L51 VanDerWaalsContact O-CG 3.27Å; L47-L51 WeakPolarHBondContact O-CG 3.48Å; L47-L51 PolarHBondContact O-N 3.38Å
48Q93.4Very high90.6Very high78 Ų7871.6 Ų71.636%0.36440%0.401SS..Hα-helixtrans-59.7-47176.4-173.2-174.3-48.800111.1L44 T46 E50 L51 E52 N148L44-Q48 WeakPolarHBondContact O-CB 3.5Å; L44-Q48 PolarHBondContact O-N 3.29Å; T46-Q48 VanDerWaalsContact C-N 3.33Å; T46-Q48 PolarHBondContact O-N 3.45Å; Q48-E50 VanDerWaalsContact C-N 3.33Å; Q48-E50 PolarHBondContact O-N 2.88Å; Q48-L51 PolarHBondContact O-N 3.42Å; Q48-E52 PolarHBondContact NE2-OE1 3.23Å; Q48-E52 WeakPolarHBondContact O-CB 3.33Å; Q48-E52 WeakPolarHBondContact O-CG 3.38Å; Q48-E52 PolarHBondContact O-N 3.43Å; Q48-N148 PolarHBondContact NE2-ND2 2.86Å
49L93.6Very high91.1Very high110 Ų11071.3 Ų71.358%0.57639%0.392SS*.Hα-helixtrans-60.9-41.5179.1-177.865.2000112.5D45 T46 L47 E52 T53D45-L49 PolarHBondContact O-N 3.22Å; T46-L49 PolarHBondContact O-N 3.08Å; L47-L49 PolarHBondContact O-N 2.69Å; L49-E52 PolarHBondContact O-N 3.36Å; L49-T53 PolarHBondContact O-N 3.32Å; L49-T53 PolarHBondContact O-OG1 3.45Å
50E95.1Very high91Very high17 Ų1775.3 Ų75.38%0.07940%0.401CS..Hα-helixtrans-68.1-39.8177.6-70.8-176.5-17100112C24 P25 R26 Y27 T46 L47 Q48 T53 L54C24-E50 VanDerWaalsContact CA-CD 3.43Å; C24-E50 WeakPolarHBondContact CA-OE2 3.39Å; C24-E50 HydrophobicContact CB-CB 3.97Å; C24-E50 HydrophobicContact CB-CG 4.18Å; C24-E50 WeakPolarHBondContact CB-OE2 3.49Å; P25-E50 WeakPolarHBondContact CD-OE1 3.37Å; R26-E50 WeakPolarHBondContact CA-OE2 3.39Å; R26-E50 VanDerWaalsContact CB-OE1 3.31Å; R26-E50 WeakPolarHBondContact CB-OE1 3.46Å; R26-E50 WeakPolarHBondContact CB-OE2 3.47Å; R26-E50 PolarHBondContact N-OE1 2.91Å; R26-E50 PolarHBondContact N-OE2 3.41Å; Y27-E50 WeakPolarHBondContact CB-OE2 3.36Å; Y27-E50 PolarHBondContact N-OE2 3.24Å; T46-E50 WeakPolarHBondContact O-CG 3.49Å; T46-E50 PolarHBondContact O-N 2.87Å; T46-E50 VanDerWaalsContact O-N 3.12Å; L47-E50 PolarHBondContact O-N 3.44Å; Q48-E50 VanDerWaalsContact C-N 3.33Å; Q48-E50 PolarHBondContact O-N 2.88Å; E50-T53 VanDerWaalsContact O-CB 3.31Å; E50-T53 WeakPolarHBondContact O-CB 3.47Å; E50-T53 PolarHBondContact O-N 3.15Å; E50-L54 WeakPolarHBondContact O-CG 3.4Å; E50-L54 PolarHBondContact O-N 2.98Å
51L94.1Very high91.2Very high79 Ų7978 Ų7841%0.41440%0.401SS..Hα-helixtrans-64.4-39.8173.7-72.2172.7000112Y27 L47 Q48 T53 L54 L55Y27-L51 HydrophobicContact CD2-CD2 3.67Å; Y27-L51 HydrophobicContact CE2-CD2 3.87Å; L47-L51 HydrophobicContact CD1-CD1 4.37Å; L47-L51 HydrophobicContact CD1-CG 4.35Å; L47-L51 HydrophobicContact CG-CD1 4.03Å; L47-L51 HydrophobicContact CG-CG 4.45Å; L47-L51 WeakPolarHBondContact O-CB 3.08Å; L47-L51 VanDerWaalsContact O-CG 3.27Å; L47-L51 WeakPolarHBondContact O-CG 3.48Å; L47-L51 PolarHBondContact O-N 3.38Å; Q48-L51 PolarHBondContact O-N 3.42Å; L51-T53 VanDerWaalsContact C-N 3.26Å; L51-T53 PolarHBondContact O-N 3.48Å; L51-L54 HydrophobicContact CD2-CD1 4.5Å; L51-L54 PolarHBondContact O-N 3.14Å; L51-L55 VanDerWaalsContact O-CB 3.3Å; L51-L55 WeakPolarHBondContact O-CB 3.4Å; L51-L55 PolarHBondContact O-N 3.5Å
52E93.9Very high91.5Very high76 Ų7675.7 Ų75.736%0.35539%0.39SS..Hα-helixtrans-62.1-34.9173.3-75.4176.5-168.500111.7Q48 L49 S56Q48-E52 PolarHBondContact NE2-OE1 3.23Å; Q48-E52 WeakPolarHBondContact O-CB 3.33Å; Q48-E52 WeakPolarHBondContact O-CG 3.38Å; Q48-E52 PolarHBondContact O-N 3.43Å; L49-E52 PolarHBondContact O-N 3.36Å; E52-S56 VanDerWaalsContact O-CB 3.22Å; E52-S56 WeakPolarHBondContact O-CB 3.44Å; E52-S56 PolarHBondContact O-N 3.2Å; E52-S56 PolarHBondContact O-OG 2.98Å
53T90.8Very high91.6Very high57 Ų5774.6 Ų74.635%0.3538%0.378SS..Hα-helixtrans-65.5-46.6174.5-60.70000111.4V23 L49 E50 L51 S56 S57V23-T53 HydrophobicContact CG1-CG2 4.25Å; L49-T53 PolarHBondContact O-N 3.32Å; L49-T53 PolarHBondContact O-OG1 3.45Å; E50-T53 VanDerWaalsContact O-CB 3.31Å; E50-T53 WeakPolarHBondContact O-CB 3.47Å; E50-T53 PolarHBondContact O-N 3.15Å; L51-T53 VanDerWaalsContact C-N 3.26Å; L51-T53 PolarHBondContact O-N 3.48Å; T53-S56 PolarHBondContact O-N 2.86Å; T53-S57 PolarHBondContact O-N 3.47Å; T53-S57 VanDerWaalsContact O-N 3.11Å
54L91.8Very high91.5Very high38 Ų3873.9 Ų73.920%0.19938%0.377CS..Hα-helixtrans-62.5-45.2175.5-67.3174.1000111.5V18 H20 Y27 E50 L51 S56 S57 A58V18-L54 HydrophobicContact CB-CD2 3.82Å; V18-L54 HydrophobicContact CG1-CD2 3.86Å; V18-L54 HydrophobicContact CG2-CD2 4.35Å; H20-L54 HydrophobicContact CB-CD2 4.35Å; Y27-L54 HydrophobicContact CD1-CD1 3.81Å; Y27-L54 HydrophobicContact CD2-CD1 4.23Å; Y27-L54 HydrophobicContact CE1-CD1 3.81Å; Y27-L54 HydrophobicContact CE2-CD1 4.25Å; Y27-L54 HydrophobicContact CG-CD1 4.01Å; E50-L54 WeakPolarHBondContact O-CG 3.4Å; E50-L54 PolarHBondContact O-N 2.98Å; L51-L54 HydrophobicContact CD2-CD1 4.5Å; L51-L54 PolarHBondContact O-N 3.14Å; L54-S56 VanDerWaalsContact C-N 3.35Å; L54-S56 PolarHBondContact O-N 3.07Å; L54-S57 PolarHBondContact O-N 2.95Å; L54-A58 PolarHBondContact O-N 3.14Å
55L93.1Very high91.4Very high110 Ų11074.1 Ų74.158%0.57638%0.378SS*.Hα-helixtrans-62.7-40.7178.1-179.361.9000111.8L51 S57 A58 S59L51-L55 VanDerWaalsContact O-CB 3.3Å; L51-L55 WeakPolarHBondContact O-CB 3.4Å; L51-L55 PolarHBondContact O-N 3.5Å; L55-S57 VanDerWaalsContact C-N 3.33Å; L55-S57 PolarHBondContact O-N 3.11Å; L55-A58 PolarHBondContact O-N 3.07Å; L55-S59 VanDerWaalsContact O-CB 3.28Å; L55-S59 WeakPolarHBondContact O-CB 3.45Å; L55-S59 PolarHBondContact O-N 2.96Å; L55-S59 PolarHBondContact O-OG 2.88Å
56S91.5Very high91.5Very high65 Ų6571.6 Ų71.646%0.45536%0.363SS..Hα-helixtrans-63.9-39177.3-67.80000111.9E52 T53 L54 R60E52-S56 VanDerWaalsContact O-CB 3.22Å; E52-S56 WeakPolarHBondContact O-CB 3.44Å; E52-S56 PolarHBondContact O-N 3.2Å; E52-S56 PolarHBondContact O-OG 2.98Å; T53-S56 PolarHBondContact O-N 2.86Å; L54-S56 VanDerWaalsContact C-N 3.35Å; L54-S56 PolarHBondContact O-N 3.07Å; S56-R60 WeakPolarHBondContact O-CB 3.42Å; S56-R60 PolarHBondContact O-N 2.74Å; S56-R60 VanDerWaalsContact O-N 3.13Å
57S89.4Confident91.4Very high28 Ų2873.3 Ų73.320%0.19637%0.366CS..Hα-helixtrans-67.1-47.7174.1-177.50000111.8V18 T53 L54 L55 S59 R60 R61V18-S57 WeakPolarHBondContact CG2-OG 3.25Å; T53-S57 PolarHBondContact O-N 3.47Å; T53-S57 VanDerWaalsContact O-N 3.11Å; L54-S57 PolarHBondContact O-N 2.95Å; L55-S57 VanDerWaalsContact C-N 3.33Å; L55-S57 PolarHBondContact O-N 3.11Å; S57-S59 PolarHBondContact O-N 3.43Å; S57-R60 PolarHBondContact O-N 2.79Å; S57-R61 WeakPolarHBondContact O-CG 3.42Å; S57-R61 PolarHBondContact O-N 3.15Å; S57-R61 VanDerWaalsContact O-N 3.14Å
58A90.2Very high91.1Very high39 Ų3973.6 Ų73.632%0.32237%0.367SS..Hα-helixtrans-59.4-45.8176.300000112.4L54 L55 R60 R61 L62L54-A58 PolarHBondContact O-N 3.14Å; L55-A58 PolarHBondContact O-N 3.07Å; A58-R60 VanDerWaalsContact C-N 3.29Å; A58-R60 PolarHBondContact O-N 2.97Å; A58-R61 PolarHBondContact O-N 3.35Å; A58-R61 VanDerWaalsContact O-N 3.13Å; A58-L62 PolarHBondContact O-N 3.42Å
59S90.8Very high90.9Very high37 Ų3777 Ų7726%0.25938%0.377SS..Hα-helixtrans-62.1-35.7178.7-59.60000112.5L55 S57 R63L55-S59 VanDerWaalsContact O-CB 3.28Å; L55-S59 WeakPolarHBondContact O-CB 3.45Å; L55-S59 PolarHBondContact O-N 2.96Å; L55-S59 PolarHBondContact O-OG 2.88Å; S57-S59 PolarHBondContact O-N 3.43Å; S59-R63 WeakPolarHBondContact O-CG 3.4Å; S59-R63 PolarHBondContact O-N 2.82Å
60R87.4Confident90.7Very high177 Ų17776.3 Ų76.367%0.66837%0.371SS*.Hα-helixtrans-65.9-42.4174.9-168.9-173.7-49.8-114.2-0.5111.6S56 S57 A58 A64S56-R60 WeakPolarHBondContact O-CB 3.42Å; S56-R60 PolarHBondContact O-N 2.74Å; S56-R60 VanDerWaalsContact O-N 3.13Å; S57-R60 PolarHBondContact O-N 2.79Å; A58-R60 VanDerWaalsContact C-N 3.29Å; A58-R60 PolarHBondContact O-N 2.97Å; R60-A64 PolarHBondContact O-N 3.3Å; R60-A64 VanDerWaalsContact O-N 3.11Å
61R89.8Confident90.3Very high89 Ų8977.7 Ų77.734%0.33638%0.378SS..Hα-helixtrans-65.2-43176.2-63.8-172.9-76.8160.5-0.2111.5F15 S57 A58 A64 L65F15-R61 HydrophobicContact CD1-CB 3.92Å; F15-R61 HydrophobicContact CD1-CG 3.39Å; F15-R61 HydrophobicContact CE1-CB 3.78Å; F15-R61 HydrophobicContact CE1-CG 3.7Å; F15-R61 HydrophobicContact CG-CB 4.49Å; F15-R61 HydrophobicContact CG-CG 4.09Å; F15-R61 HydrophobicContact CZ-CB 4.27Å; S57-R61 WeakPolarHBondContact O-CG 3.42Å; S57-R61 PolarHBondContact O-N 3.15Å; S57-R61 VanDerWaalsContact O-N 3.14Å; A58-R61 PolarHBondContact O-N 3.35Å; A58-R61 VanDerWaalsContact O-N 3.13Å; R61-A64 PolarHBondContact O-N 3.47Å; R61-L65 WeakPolarHBondContact O-CG 3.46Å; R61-L65 PolarHBondContact O-N 2.87Å
62L91.6Very high89.9Confident97 Ų9777.4 Ų77.451%0.50838%0.376SS..Hα-helixtrans-59-51.2176.4-178.362.3000111.2A58 A64 L65 E66A58-L62 PolarHBondContact O-N 3.42Å; L62-A64 VanDerWaalsContact C-N 3.3Å; L62-A64 PolarHBondContact O-N 2.93Å; L62-L65 PolarHBondContact O-N 3.3Å; L62-L65 VanDerWaalsContact O-N 3.11Å; L62-E66 HydrophobicContact CD1-CG 4.28Å; L62-E66 HydrophobicContact CG-CG 4.36Å; L62-E66 WeakPolarHBondContact O-CG 3.46Å; L62-E66 PolarHBondContact O-N 3.23Å
63R90.2Very high89.5Confident153 Ų15376.3 Ų76.358%0.57738%0.375SS*.Hα-helixtrans-58.4-40.8177.6-75.1-170.7-66.7-1092.3112.9S59 E66 E67S59-R63 WeakPolarHBondContact O-CG 3.4Å; S59-R63 PolarHBondContact O-N 2.82Å; R63-E66 PolarHBondContact O-N 3.02Å; R63-E67 PolarHBondContact O-N 3.18Å
64A87.6Confident89.3Confident12 Ų1276.9 Ų76.910%0.09938%0.376CS..Hα-helixtrans-63-41.9176.800000111.8Y13 F15 R60 R61 L62 E67 Q68Y13-A64 HydrophobicContact CD1-CB 4.41Å; Y13-A64 HydrophobicContact CD2-CB 4.28Å; Y13-A64 HydrophobicContact CE1-CB 4.13Å; Y13-A64 HydrophobicContact CE2-CB 4.01Å; Y13-A64 HydrophobicContact CG-CB 4.48Å; F15-A64 HydrophobicContact CE1-CB 4.22Å; F15-A64 HydrophobicContact CZ-CB 4.11Å; R60-A64 PolarHBondContact O-N 3.3Å; R60-A64 VanDerWaalsContact O-N 3.11Å; R61-A64 PolarHBondContact O-N 3.47Å; L62-A64 VanDerWaalsContact C-N 3.3Å; L62-A64 PolarHBondContact O-N 2.93Å; A64-E67 PolarHBondContact O-N 3.33Å; A64-Q68 WeakPolarHBondContact O-CG 3.43Å; A64-Q68 PolarHBondContact O-N 2.87Å; A64-Q68 VanDerWaalsContact O-N 3.17Å
65L89.6Confident88.9Confident93 Ų9379.1 Ų79.149%0.48738%0.382SS..Hα-helixtrans-67.6-39.5175.2-74.4174.5000112.6F15 R61 L62 E67 Q68 R69F15-L65 HydrophobicContact CE2-CD1 4.16Å; F15-L65 HydrophobicContact CE2-CD2 3.74Å; F15-L65 HydrophobicContact CE2-CG 3.79Å; F15-L65 HydrophobicContact CZ-CD2 4.18Å; F15-L65 HydrophobicContact CZ-CG 3.92Å; R61-L65 WeakPolarHBondContact O-CG 3.46Å; R61-L65 PolarHBondContact O-N 2.87Å; L62-L65 PolarHBondContact O-N 3.3Å; L62-L65 VanDerWaalsContact O-N 3.11Å; L65-E67 VanDerWaalsContact C-N 3.33Å; L65-E67 PolarHBondContact O-N 3.21Å; L65-Q68 PolarHBondContact O-N 3Å; L65-R69 WeakPolarHBondContact O-CB 3.43Å; L65-R69 PolarHBondContact O-N 3.07Å
66E91.8Very high88.2Confident76 Ų7680.2 Ų80.236%0.35538%0.384SS..Hα-helixtrans-63.1-39.6176.2-72.2176.1151.600111.7L62 R63 R69 Q70L62-E66 HydrophobicContact CD1-CG 4.28Å; L62-E66 HydrophobicContact CG-CG 4.36Å; L62-E66 WeakPolarHBondContact O-CG 3.46Å; L62-E66 PolarHBondContact O-N 3.23Å; R63-E66 PolarHBondContact O-N 3.02Å; E66-R69 PolarHBondContact O-N 3.34Å; E66-Q70 WeakPolarHBondContact O-CB 3.32Å; E66-Q70 PolarHBondContact O-N 2.88Å
67E89.9Confident87.6Confident98 Ų9882.1 Ų82.146%0.45839%0.389SS..Hα-helixtrans-60.8-45.4172.7-172.4-176.3169.800111.1R63 A64 L65 R69 Q70 I71R63-E67 PolarHBondContact O-N 3.18Å; A64-E67 PolarHBondContact O-N 3.33Å; L65-E67 VanDerWaalsContact C-N 3.33Å; L65-E67 PolarHBondContact O-N 3.21Å; E67-R69 PolarHBondContact O-N 3.26Å; E67-Q70 PolarHBondContact O-N 3.37Å; E67-I71 HydrophobicContact CG-CD1 4.49Å; E67-I71 WeakPolarHBondContact O-CG1 3.33Å; E67-I71 PolarHBondContact O-N 3.11Å
68Q88.4Confident86.9Confident16 Ų1688.6 Ų88.68%0.07541%0.414CS..Hα-helixtrans-65.7-38.3176.5-62.1-40.9-71.200112.3L10 Y13 A64 L65 Q70 I71 L72L10-Q68 HydrophobicContact CD2-CB 4.32Å; Y13-Q68 HydrophobicContact CD2-CG 4.29Å; Y13-Q68 HydrophobicContact CE2-CG 3.89Å; A64-Q68 WeakPolarHBondContact O-CG 3.43Å; A64-Q68 PolarHBondContact O-N 2.87Å; A64-Q68 VanDerWaalsContact O-N 3.17Å; L65-Q68 PolarHBondContact O-N 3Å; Q68-Q70 VanDerWaalsContact C-N 3.34Å; Q68-I71 PolarHBondContact O-N 3.28Å; Q68-L72 PolarHBondContact O-N 2.77Å; Q68-L72 VanDerWaalsContact O-N 3.09Å
69R88.3Confident85.6Confident150 Ų15092.3 Ų92.357%0.56642%0.423SS*.Hα-helixtrans-61.9-42.6174.1-174.5-17667.2-158.3-3.9110.9L65 E66 E67 L72 T73L65-R69 WeakPolarHBondContact O-CB 3.43Å; L65-R69 PolarHBondContact O-N 3.07Å; E66-R69 PolarHBondContact O-N 3.34Å; E67-R69 PolarHBondContact O-N 3.26Å; R69-L72 WeakPolarHBondContact O-CB 3.44Å; R69-L72 PolarHBondContact O-N 3.07Å; R69-T73 PolarHBondContact O-N 2.93Å; R69-T73 PolarHBondContact O-OG1 3.46Å; R69-T73 VanDerWaalsContact O-OG1 3.11Å
70Q89.4Confident83.9Confident96 Ų9693.9 Ų93.945%0.44944%0.444SS..Hα-helixtrans-64-41.5177.5-169.461.844.400111.6E66 E67 Q68 L72 T73 D74E66-Q70 WeakPolarHBondContact O-CB 3.32Å; E66-Q70 PolarHBondContact O-N 2.88Å; E67-Q70 PolarHBondContact O-N 3.37Å; Q68-Q70 VanDerWaalsContact C-N 3.34Å; Q70-L72 VanDerWaalsContact C-N 3.26Å; Q70-L72 PolarHBondContact O-N 2.8Å; Q70-T73 PolarHBondContact O-N 3.13Å; Q70-D74 PolarHBondContact NE2-OD1 2.91Å; Q70-D74 WeakPolarHBondContact O-CB 3.33Å; Q70-D74 VanDerWaalsContact O-CG 3.28Å; Q70-D74 PolarHBondContact O-N 2.99Å
71I87.8Confident82.2Confident45 Ų4590.5 Ų90.523%0.23144%0.44CS..Hα-helixtrans-58.9-39.3174.8-68.3166.7000111.1P8 P9 L10 E67 Q68 W75P8-I71 HydrophobicContact CB-CG2 4.44Å; P9-I71 HydrophobicContact CG-CG2 4.47Å; L10-I71 HydrophobicContact CD2-CB 4.47Å; L10-I71 HydrophobicContact CD2-CG2 4.15Å; E67-I71 HydrophobicContact CG-CD1 4.49Å; E67-I71 WeakPolarHBondContact O-CG1 3.33Å; E67-I71 PolarHBondContact O-N 3.11Å; Q68-I71 PolarHBondContact O-N 3.28Å; I71-W75 WeakPolarHBondContact O-CB 3.45Å; I71-W75 PolarHBondContact O-N 3.13Å
72L84.8Confident80.4Confident73 Ų7394 Ų9438%0.38246%0.457SS..Hα-helixtrans-65.3-45.7175.2-75.4175.6000112.4P8 L10 Q68 R69 Q70 W75 Q76P8-L72 HydrophobicContact CB-CD2 4.21Å; P8-L72 HydrophobicContact CG-CD2 3.67Å; L10-L72 HydrophobicContact CD1-CD1 4.44Å; L10-L72 HydrophobicContact CD1-CD2 3.86Å; L10-L72 HydrophobicContact CD1-CG 4.31Å; L10-L72 HydrophobicContact CD2-CD1 4.49Å; L10-L72 HydrophobicContact CD2-CD2 3.97Å; L10-L72 HydrophobicContact CD2-CG 3.85Å; L10-L72 HydrophobicContact CG-CD2 4.31Å; Q68-L72 PolarHBondContact O-N 2.77Å; Q68-L72 VanDerWaalsContact O-N 3.09Å; R69-L72 WeakPolarHBondContact O-CB 3.44Å; R69-L72 PolarHBondContact O-N 3.07Å; Q70-L72 VanDerWaalsContact C-N 3.26Å; Q70-L72 PolarHBondContact O-N 2.8Å; L72-W75 PolarHBondContact O-N 2.78Å; L72-Q76 WeakPolarHBondContact O-CB 3.43Å; L72-Q76 PolarHBondContact O-N 3.18Å
73T86.4Confident78.2Confident54 Ų54100.2 Ų100.233%0.33147%0.474SS..Hα-helixtrans-60.3-51.3177.3-53.90000110.9R69 Q70 W75 Q76 D77R69-T73 PolarHBondContact O-N 2.93Å; R69-T73 PolarHBondContact O-OG1 3.46Å; R69-T73 VanDerWaalsContact O-OG1 3.11Å; Q70-T73 PolarHBondContact O-N 3.13Å; T73-W75 PolarHBondContact O-N 2.72Å; T73-Q76 WeakPolarHBondContact O-CB 3.37Å; T73-Q76 PolarHBondContact O-N 3.35Å; T73-Q76 VanDerWaalsContact O-N 3.09Å; T73-D77 PolarHBondContact O-N 2.64Å
74D85.3Confident75.8Confident68 Ų68101.5 Ų101.536%0.36448%0.484SS..Hα-helixtrans-61.5-35.2179.6-67.6-4.6000111.9Q70 K78Q70-D74 PolarHBondContact NE2-OD1 2.91Å; Q70-D74 WeakPolarHBondContact O-CB 3.33Å; Q70-D74 VanDerWaalsContact O-CG 3.28Å; Q70-D74 PolarHBondContact O-N 2.99Å; D74-K78 WeakPolarHBondContact O-CB 3.44Å; D74-K78 VanDerWaalsContact O-CG 3.27Å; D74-K78 WeakPolarHBondContact O-CG 3.41Å; D74-K78 PolarHBondContact O-N 3.39Å; D74-K78 VanDerWaalsContact O-N 3.12Å
75W84.3Confident73.6Confident85 Ų85108.8 Ų108.832%0.32252%0.52SS..Hα-helixtrans-71-38.6176.2-177.586.5000112D6 P8 I71 L72 T73 K78 K79D6-W75 WeakPolarHBondContact O-CZ2 3.4Å; P8-W75 HydrophobicContact CB-CB 4.08Å; P8-W75 HydrophobicContact CB-CD2 4.1Å; P8-W75 HydrophobicContact CB-CG 3.78Å; P8-W75 HydrophobicContact CG-CD2 4.15Å; P8-W75 HydrophobicContact CG-CE3 4.35Å; P8-W75 HydrophobicContact CG-CG 4.35Å; I71-W75 WeakPolarHBondContact O-CB 3.45Å; I71-W75 PolarHBondContact O-N 3.13Å; L72-W75 PolarHBondContact O-N 2.78Å; T73-W75 PolarHBondContact O-N 2.72Å; W75-K78 PolarHBondContact O-N 3.01Å; W75-K79 HydrophobicContact CH2-CD 3.68Å; W75-K79 HydrophobicContact CZ2-CD 4.13Å; W75-K79 HydrophobicContact CZ3-CD 4.03Å; W75-K79 WeakPolarHBondContact O-CB 3.4Å; W75-K79 PolarHBondContact O-N 3.45Å
76Q78.8Confident71Confident134 Ų134114 Ų11463%0.62654%0.539SS*.Hα-helixtrans-63.7-44.3175-177.8171.9600111.5L72 T73 K78 K79 G80L72-Q76 WeakPolarHBondContact O-CB 3.43Å; L72-Q76 PolarHBondContact O-N 3.18Å; T73-Q76 WeakPolarHBondContact O-CB 3.37Å; T73-Q76 PolarHBondContact O-N 3.35Å; T73-Q76 VanDerWaalsContact O-N 3.09Å; Q76-K78 VanDerWaalsContact C-N 3.35Å; Q76-K78 PolarHBondContact O-N 3.34Å; Q76-K79 PolarHBondContact O-N 2.85Å; Q76-K79 VanDerWaalsContact O-N 3.11Å; Q76-G80 PolarHBondContact O-N 3.18Å
77D78.9Confident68.2Low104 Ų104118.6 Ų118.656%0.55657%0.565SS**Hα-helixtrans-62.6-42.7177.6-69.9-19000111.2T73 K79 G80 D81T73-D77 PolarHBondContact O-N 2.64Å; D77-K79 VanDerWaalsContact C-N 3.29Å; D77-K79 PolarHBondContact O-N 3.48Å; D77-G80 PolarHBondContact O-N 3.05Å; D77-D81 PolarHBondContact O-N 3.16Å
78K72.8Confident65.5Low164 Ų164117.2 Ų117.271%0.71358%0.578SS**Hα-helixtrans-64.7-30.1174-75.2173.7-178173.90113.4D74 W75 Q76D74-K78 WeakPolarHBondContact O-CB 3.44Å; D74-K78 VanDerWaalsContact O-CG 3.27Å; D74-K78 WeakPolarHBondContact O-CG 3.41Å; D74-K78 PolarHBondContact O-N 3.39Å; D74-K78 VanDerWaalsContact O-N 3.12Å; W75-K78 PolarHBondContact O-N 3.01Å; Q76-K78 VanDerWaalsContact C-N 3.35Å; Q76-K78 PolarHBondContact O-N 3.34Å
79K64.4Low63Low118 Ų118125.1 Ų125.151%0.51361%0.612SS.*Hα-helixtrans-77.1-25.9175.7-157.1-169.9-172.8-174.50112.3W75 Q76 D77 D81W75-K79 HydrophobicContact CH2-CD 3.68Å; W75-K79 HydrophobicContact CZ2-CD 4.13Å; W75-K79 HydrophobicContact CZ3-CD 4.03Å; W75-K79 WeakPolarHBondContact O-CB 3.4Å; W75-K79 PolarHBondContact O-N 3.45Å; Q76-K79 PolarHBondContact O-N 2.85Å; Q76-K79 VanDerWaalsContact O-N 3.11Å; D77-K79 VanDerWaalsContact C-N 3.29Å; D77-K79 PolarHBondContact O-N 3.48Å; K79-D81 VanDerWaalsContact C-N 3.33Å
80G54.4Low60.4Low69 Ų69124.6 Ų124.671%0.71162%0.62SS**Hα-helixtrans-72.1-25.117400000113.5Q76 D77 K82Q76-G80 PolarHBondContact O-N 3.18Å; D77-G80 PolarHBondContact O-N 3.05Å; G80-K82 VanDerWaalsContact C-N 3.28Å; G80-K82 PolarHBondContact O-N 2.98Å; G80-K82 VanDerWaalsContact O-N 3.15Å
81D51.7Low57.6Low107 Ų107125.2 Ų125.257%0.57264%0.641SS**  trans-90.241.8-175.7-148.18.2000113.8D77 K79 R83D77-D81 PolarHBondContact O-N 3.16Å; K79-D81 VanDerWaalsContact C-N 3.33Å; D81-R83 PolarHBondContact O-N 3.46Å
82K52.1Low54.8Low163 Ų163130.1 Ų130.171%0.70967%0.668SS**THydrogen-bonded Turntrans-72.129.6173.6-73.3-175.1179.3-171.50113.7G80G80-K82 VanDerWaalsContact C-N 3.28Å; G80-K82 PolarHBondContact O-N 2.98Å; G80-K82 VanDerWaalsContact O-N 3.15Å
83R45.4Very low52.6Low227 Ų227133.9 Ų133.986%0.85769%0.688SS**THydrogen-bonded Turntrans-110.28.2171.3-79-166.2-74.5-166.7-4.3114.5D81D81-R83 PolarHBondContact O-N 3.46Å
84F39.8Very low50Low180 Ų180137.1 Ų137.179%0.78971%0.713SS**  trans-131.277.2170.1-95.1-87.7000112.1
85L40.7Very low47.4Very low165 Ų165138.6 Ų138.686%0.86474%0.735SS**  trans-134.881.1160.9-73.3177000110.4
86K35.7Very low45.1Very low202 Ų202140.3 Ų140.388%0.87876%0.759SS**  trans-166.693.3142.5-139.2168.4-177.8174.60113.9
87L33Very low42.9Very low172 Ų172138.5 Ų138.590%0.90176%0.762SS**  trans-177.4105133.6-133.160.3000106.2
88G32.6Very low40.8Very low70 Ų70144.9 Ų144.972%0.72278%0.778SS**  70.97581.700000109.2
89K36.7Very low38.8Very low182 Ų182145.6 Ų145.679%0.79178%0.784SS**  79.812292.6-172.4161.7-179.5177.40114.1
90D34.2Very low37.3Very low139 Ų139149.4 Ų149.474%0.74380%0.8SS**  trans74.2105.9164.2-56.5-28.2000119.6
91A29.9Very low36.3Very low108 Ų108152.4 Ų152.489%0.89381%0.807SS**  trans-161.9145.213500000110.5
92D29.9Very low35.2Very low148 Ų148157.1 Ų157.179%0.79182%0.822SS**  trans-82.2176.5-156.5-136.1-32.6000115.3
93L38.1Very low34.3Very low152 Ų152159.3 Ų159.380%0.79683%0.832SS**  trans-42.3156.8178.8-64.6157.2000117.6
94S32.3Very low33.7Very low122 Ų122157.7 Ų157.785%0.85383%0.834SS**  trans93.2102.7157.781.40000118
95A29.7Very low33.3Very low100 Ų100157.3 Ų157.383%0.82683%0.832SS**  trans-173.6113.1132.500000110.1
96S36.9Very low32.8Very low120 Ų120157.6 Ų157.684%0.83983%0.833SS**  trans-65.6126.6163.5-155.60000108.9
97S31.5Very low32.5Very low97 Ų97154.1 Ų154.168%0.67883%0.825SS**  trans-141.3108.5163.3-167.70000111.4
98R34.3Very low32.4Very low238 Ų238149.7 Ų149.790%0.89882%0.82SS**  trans-70.4127.2170-62.3173.3-164.3177.71.6108.6
99H32.1Very low32.5Very low179 Ų179157 Ų15783%0.82983%0.832SS**  trans-114.4117.8163.7-94.7-77.8000111.4
100K31.8Very low32Very low198 Ų198151.6 Ų151.686%0.86183%0.828SS**PPolyproline II helixtrans-69.6148.3167.8-79177172175.40110.7
101P33.6Very low31.8Very low131 Ų131149.4 Ų149.485%0.85182%0.824SS**PPolyproline II helixtrans-81.7139.6167.732.5-30.3000111.5
102K29.7Very low32Very low207 Ų207153 Ų15390%0.982%0.822SS**PPolyproline II helixtrans-89.1117.9-172-167.3166.1-179.3175.40110
103K32.8Very low32.1Very low209 Ų209149.3 Ų149.391%0.90982%0.819SS**PPolyproline II helixtrans-74.4126.5167-88.2-176.2172.7179.20109.6
104Q33.3Very low32.3Very low193 Ų193148.8 Ų148.890%0.90283%0.825SS**PPolyproline II helixtrans-92132168.2-124.9170.9-15.600108.9
105K29.9Very low32.2Very low172 Ų172146.3 Ų146.375%0.74882%0.818SS**  trans-115.8132.3179.8-179-178.6175.8-173.50107.5D107K105-D107 WeakPolarHBondContact CE-OD2 3.41Å; K105-D107 IonicContact NZ-OD2 3.57Å
106L31.1Very low33.2Very low170 Ų170148.3 Ų148.389%0.8982%0.823SS**  trans-143.3112.2166-100.1154000107.7
107D29.6Very low32.8Very low130 Ų130146.1 Ų146.170%0.69582%0.819SS**  trans-91.6126.7163.7-75.6-69.7000106.8K105K105-D107 WeakPolarHBondContact CE-OD2 3.41Å; K105-D107 IonicContact NZ-OD2 3.57Å
108G31.5Very low33.3Very low78 Ų78147.9 Ų147.980%0.80483%0.828SS**  104.1127.590.600000110.1
109K32.7Very low33.1Very low223 Ų223140.5 Ų140.597%0.9783%0.826SS**  176149.971.7-158.7175.6-173.5-179.40112.2
110G28.2Very low33.3Very low70 Ų70143.4 Ų143.472%0.72283%0.83SS**  trans130.186.5156.600000114.8
111S28.9Very low33.6Very low93 Ų93139.7 Ų139.765%0.6583%0.826SS**  88.310785.2-168.80000114.5
112H33.4Very low33.8Very low183 Ų183143.3 Ų143.385%0.84783%0.828SS**  165.4123116.9-84.6-66.9000111.3
113G32.7Very low34.1Very low70 Ų70138.8 Ų138.872%0.72282%0.823SS**  trans-81.3176.2161.300000111.5
114P42.6Very low34.3Very low142 Ų142138 Ų13892%0.92282%0.819SS**  -133.3165.475.834.5-18.8000111
115G30.4Very low34.1Very low70 Ų70135.5 Ų135.572%0.72281%0.812SS**  cis148.3146.626.200000105.9
116P49.5Very low34.3Very low141 Ų141134.9 Ų134.992%0.91682%0.816SS**  trans-108.3151-164.137.4-29.1000116
117G29Very low34.4Very low75 Ų75134.4 Ų134.477%0.77381%0.809SS**  trans132.7160.4154.600000115.2
118P42.3Very low34.8Very low133 Ų133133.7 Ų133.786%0.86481%0.812SS**  cis-135.5147.31.537.2-17.9000116.9
119G30.5Very low34.8Very low83 Ų83139.9 Ų139.986%0.85682%0.817SS**  65.8103.9126.900000122.5
120R35.8Very low34.9Very low241 Ų241135.6 Ų135.691%0.90981%0.809SS**  trans-151.7139.2136.7-160.4162.5-177.7-148.6-1110.6
121P38.8Very low35.2Very low119 Ų119141 Ų14177%0.77382%0.816SS**  trans-83.6145.8-151.230.6-33.6000114.6S123P121-S123 PolarHBondContact O-N 3.21Å
122K37.7Very low35.2Very low207 Ų207145.5 Ų145.590%0.983%0.826SS**  trans-65114.6166.2-67.4-173.3177.5-177.20109.6K124K122-K124 PolarHBondContact O-N 2.8Å
123S35.6Very low35.1Very low112 Ų112147.5 Ų147.578%0.78383%0.828SS**  trans-68.4113.3166.453.80000109.5P121 N125P121-S123 PolarHBondContact O-N 3.21Å; S123-N125 PolarHBondContact O-N 2.88Å
124K36.4Very low35.2Very low192 Ų192153.2 Ų153.284%0.83584%0.836SS**  trans-69.1106.5163.5-71.3179.8178.5179.80107.6K122 L126K122-K124 PolarHBondContact O-N 2.8Å; K124-L126 PolarHBondContact O-N 3.42Å
125N29.6Very low34.7Very low142 Ų142154 Ų15476%0.75983%0.831SS**  trans-79.398.9167.5-135.528.4000107.6S123 Q127S123-N125 PolarHBondContact O-N 2.88Å; N125-Q127 PolarHBondContact O-N 3.26Å
126L34.2Very low35.3Very low158 Ų158156.7 Ų156.783%0.82784%0.839SS**  trans-71100.9164.6-83.8129.4000107.5K124K124-L126 PolarHBondContact O-N 3.42Å
127Q33.4Very low34.7Very low160 Ų160158.6 Ų158.675%0.74884%0.836SS**  trans-77133.2159.7-73.7-123.7-24.800108.9N125 K129N125-Q127 PolarHBondContact O-N 3.26Å; Q127-K129 PolarHBondContact O-N 3.12Å
128P36.8Very low35.2Very low116 Ų116161.9 Ų161.975%0.75384%0.836SS**  trans-62.8123.7171.1-16.129.4000109.6V130P128-V130 PolarHBondContact O-N 3.12Å; P128-V130 VanDerWaalsContact O-N 3.08Å
129K31.7Very low35.3Very low207 Ų207161.4 Ų161.490%0.983%0.833SS**  trans-67.1101.8177.4-164.3160.8-178.9174.20108.6Q127Q127-K129 PolarHBondContact O-N 3.12Å
130V35.3Very low35.9Very low133 Ų133165.4 Ų165.481%0.80683%0.829SS**  trans-72.1125.8162.8-171.70000106.3P128 E132P128-V130 PolarHBondContact O-N 3.12Å; P128-V130 VanDerWaalsContact O-N 3.08Å; V130-E132 PolarHBondContact O-N 3.42Å; V130-E132 VanDerWaalsContact O-N 3.08Å
131Q34.6Very low36.9Very low185 Ų185161.7 Ų161.786%0.86483%0.827SS**  trans-77.592.1-174.4-157.7164.86.400107.5
132E29.7Very low37.3Very low186 Ų186162.9 Ų162.987%0.86983%0.826SS**  trans-80.5127.5173.4-127.3170.8-171.400109.1V130 E134V130-E132 PolarHBondContact O-N 3.42Å; V130-E132 VanDerWaalsContact O-N 3.08Å; E132-E134 PolarHBondContact O-N 3.39Å
133Y30.8Very low38Very low225 Ų225158 Ų15888%0.88282%0.815SS**  trans-56.7128.8177.9-120.1-108.1000110.3L135Y133-L135 PolarHBondContact O-N 3.32Å; Y133-L135 VanDerWaalsContact O-N 3.12Å
134E35.3Very low39.3Very low191 Ų191163.2 Ų163.289%0.89382%0.817SS**  trans-63.9108.2170.1-77.6178.615200109.9E132E132-E134 PolarHBondContact O-N 3.39Å
135L31.9Very low40Very low157 Ų157160.7 Ų160.782%0.82281%0.813SS**  trans-105.5107.4150.4-96.7155.6000106.2Y133 E137Y133-L135 PolarHBondContact O-N 3.32Å; Y133-L135 VanDerWaalsContact O-N 3.12Å; L135-E137 VanDerWaalsContact C-N 3.26Å; L135-E137 PolarHBondContact O-N 2.87Å
136S43.3Very low41.8Very low127 Ų127159.8 Ų159.889%0.88882%0.815SS**  trans-68.885169.624.20000109.3
137E35.3Very low43.6Very low181 Ų181160.4 Ų160.485%0.84681%0.811SS**  trans-94.2129.1165-107.1-175.1147.300110.3L135L135-E137 VanDerWaalsContact C-N 3.26Å; L135-E137 PolarHBondContact O-N 2.87Å
138D39.4Very low45.7Very low144 Ų144156.6 Ų156.677%0.7780%0.796SS**  trans-56.2141.2-176.2-152.64.1000112Q140D138-Q140 VanDerWaalsContact C-N 3.33Å; D138-Q140 PolarHBondContact O-N 3.29Å
139P45.6Very low48Very low123 Ų123154.4 Ų154.480%0.79978%0.778SS**  trans-69.483.2179.3-17.732000112.5
140Q43.2Very low50.6Low168 Ų168147.2 Ų147.279%0.78576%0.757SS**  trans-75.9127.1160.3-82-169.1-24.300109.9D138 I142D138-Q140 VanDerWaalsContact C-N 3.33Å; D138-Q140 PolarHBondContact O-N 3.29Å; Q140-I142 PolarHBondContact O-N 3.47Å
141D55.6Low53.2Low163 Ų163144 Ų14487%0.87274%0.738SS**  trans-64.173.9-178.9-155.95.9000111P143D141-P143 VanDerWaalsContact O-CD 3.31Å; D141-P143 WeakPolarHBondContact O-CD 3.42Å
142I48.4Very low55.8Low144 Ų144140.1 Ų140.174%0.73872%0.724SS**  trans-73.4116.9170.8-58.2169.9000106.8Q140 R144Q140-I142 PolarHBondContact O-N 3.47Å; I142-R144 PolarHBondContact O-N 3.06Å
143P53.1Low58.8Low104 Ų104139.7 Ų139.768%0.67571%0.714SS**  trans-56.3114.2176.4-22.233.1000109D141 N145D141-P143 VanDerWaalsContact O-CD 3.31Å; D141-P143 WeakPolarHBondContact O-CD 3.42Å; P143-N145 PolarHBondContact O-N 2.91Å
144R61Low61.8Low221 Ų221134.5 Ų134.583%0.83470%0.696SS**  trans-61106.2177-138.6177.2-171.41695.1107.1I142I142-R144 PolarHBondContact O-N 3.06Å
145N53Low64.6Low140 Ų140133.2 Ų133.275%0.74968%0.684SS**PPolyproline II helixtrans-47135175.8-87.712.9000109P143 K147P143-N145 PolarHBondContact O-N 2.91Å; N145-K147 PolarHBondContact O-N 3.28Å
146P66.9Low67.5Low122 Ų122128.4 Ų128.479%0.79267%0.667SS**PPolyproline II helixtrans-55.4116.7178.521.3-29.7000107.5N148P146-N148 PolarHBondContact O-N 3.04Å
147K70.9Confident69.9Low171 Ų171125.7 Ų125.774%0.74365%0.648SS**PPolyproline II helixtrans-53.7119.3-179.4-69.3-177.1176.5-175.10107.4N145 D149N145-K147 PolarHBondContact O-N 3.28Å; K147-D149 VanDerWaalsContact C-N 3.33Å; K147-D149 PolarHBondContact O-N 2.88Å
148N78.3Confident72.9Confident81 Ų81118.7 Ų118.743%0.43362%0.617SS.*  trans-63.398.2176.2-177.65000108.2Q48 P146 A150Q48-N148 PolarHBondContact NE2-ND2 2.86Å; P146-N148 PolarHBondContact O-N 3.04Å; N148-A150 VanDerWaalsContact C-N 3.27Å; N148-A150 WeakPolarHBondContact OD1-CB 3.5Å; N148-A150 PolarHBondContact OD1-N 3.36Å
149D84.4Confident75.4Confident70 Ų70118.4 Ų118.437%0.37461%0.611SS.*  trans-893.4179.3-164.644.7000111.6K147 N152 R153K147-D149 VanDerWaalsContact C-N 3.33Å; K147-D149 PolarHBondContact O-N 2.88Å; D149-N152 PolarHBondContact O-N 3.19Å; D149-N152 VanDerWaalsContact OD1-CB 3.28Å; D149-N152 WeakPolarHBondContact OD1-CB 3.42Å; D149-N152 PolarHBondContact OD1-ND2 3.19Å; D149-R153 WeakPolarHBondContact O-CG 3.44Å; D149-R153 PolarHBondContact O-N 3.26Å; D149-R153 IonicContact OD2-NE 3.38Å
150A87.6Confident77.7Confident56 Ų56116.9 Ų116.946%0.46360%0.601SS.*Hα-helixtrans-56.8-41.3-179.300000113N148 N152 R153 F154N148-A150 VanDerWaalsContact C-N 3.27Å; N148-A150 WeakPolarHBondContact OD1-CB 3.5Å; N148-A150 PolarHBondContact OD1-N 3.36Å; A150-N152 PolarHBondContact O-N 3.23Å; A150-R153 PolarHBondContact O-N 2.91Å; A150-F154 WeakPolarHBondContact O-CB 3.42Å; A150-F154 PolarHBondContact O-N 2.77Å
151P89.2Confident80Confident64 Ų64118.6 Ų118.642%0.41660%0.602SS.*Hα-helixtrans-62-43.3175.6-24.135.5000112.9F154 W155P151-F154 PolarHBondContact O-N 3.43Å; P151-W155 PolarHBondContact O-N 3.28Å
152N89.5Confident81.7Confident105 Ų105115.5 Ų115.556%0.56159%0.592SS**Hα-helixtrans-67.7-39.1179.3-62.3-33.7000111.6D149 A150 W155 A156D149-N152 PolarHBondContact O-N 3.19Å; D149-N152 VanDerWaalsContact OD1-CB 3.28Å; D149-N152 WeakPolarHBondContact OD1-CB 3.42Å; D149-N152 PolarHBondContact OD1-ND2 3.19Å; A150-N152 PolarHBondContact O-N 3.23Å; N152-W155 PolarHBondContact O-N 3.26Å; N152-A156 VanDerWaalsContact O-CB 3.29Å; N152-A156 WeakPolarHBondContact O-CB 3.43Å; N152-A156 PolarHBondContact O-N 3.5Å
153R92.5Very high83.8Confident177 Ų177111.5 Ų111.567%0.66858%0.58SS**Hα-helixtrans-63.8-41.3175.5-73.9176.3171.1-167.5-9.4112D149 A150 A156 S157D149-R153 WeakPolarHBondContact O-CG 3.44Å; D149-R153 PolarHBondContact O-N 3.26Å; D149-R153 IonicContact OD2-NE 3.38Å; A150-R153 PolarHBondContact O-N 2.91Å; R153-A156 PolarHBondContact O-N 2.7Å; R153-S157 PolarHBondContact O-N 3.38Å; R153-S157 PolarHBondContact O-OG 2.6Å
154F93.1Very high85.8Confident115 Ų115110.6 Ų110.650%0.50457%0.57SS.*Hα-helixtrans-59.3-52.8173.9172.6-97.4000110.6A150 P151 A156 S157 V158A150-F154 WeakPolarHBondContact O-CB 3.42Å; A150-F154 PolarHBondContact O-N 2.77Å; P151-F154 PolarHBondContact O-N 3.43Å; F154-A156 VanDerWaalsContact C-N 3.34Å; F154-A156 PolarHBondContact O-N 3.2Å; F154-S157 PolarHBondContact O-N 3.03Å; F154-S157 PolarHBondContact O-OG 3.28Å; F154-V158 HydrophobicContact CD1-CG2 4.4Å; F154-V158 HydrophobicContact CD2-CG2 4.34Å; F154-V158 HydrophobicContact CE1-CG2 4Å; F154-V158 HydrophobicContact CE2-CG2 3.94Å; F154-V158 HydrophobicContact CZ-CG2 3.76Å; F154-V158 WeakPolarHBondContact O-CG2 3.43Å; F154-V158 PolarHBondContact O-N 3.39Å
155W94.1Very high87.4Confident164 Ų164102.2 Ų102.262%0.62154%0.541SS*.Hα-helixtrans-63.7-37.9-179.9-70.9119.9000113P151 N152 S157 V158 E159P151-W155 PolarHBondContact O-N 3.28Å; N152-W155 PolarHBondContact O-N 3.26Å; W155-S157 VanDerWaalsContact C-N 3.29Å; W155-S157 PolarHBondContact O-N 2.95Å; W155-V158 HydrophobicContact CE3-CB 4.45Å; W155-V158 HydrophobicContact CE3-CG1 4.43Å; W155-V158 HydrophobicContact CZ3-CG1 4.45Å; W155-V158 PolarHBondContact O-N 2.89Å; W155-E159 WeakPolarHBondContact O-CB 3.44Å; W155-E159 PolarHBondContact O-N 3.01Å
156A93Very high89.5Confident57 Ų5798.5 Ų98.547%0.47152%0.523SS..Hα-helixtrans-63.3-33.8173.400000112.7N152 R153 F154 P160N152-A156 VanDerWaalsContact O-CB 3.29Å; N152-A156 WeakPolarHBondContact O-CB 3.43Å; N152-A156 PolarHBondContact O-N 3.5Å; R153-A156 PolarHBondContact O-N 2.7Å; F154-A156 VanDerWaalsContact C-N 3.34Å; F154-A156 PolarHBondContact O-N 3.2Å; A156-P160 WeakPolarHBondContact O-CD 3.49Å
157S94.9Very high90.8Very high70 Ų7097.7 Ų97.749%0.4951%0.513SS..Hα-helixtrans-74.5-28.2174.570.20000113.4R153 F154 W155 Y161R153-S157 PolarHBondContact O-N 3.38Å; R153-S157 PolarHBondContact O-OG 2.6Å; F154-S157 PolarHBondContact O-N 3.03Å; F154-S157 PolarHBondContact O-OG 3.28Å; W155-S157 VanDerWaalsContact C-N 3.29Å; W155-S157 PolarHBondContact O-N 2.95Å; S157-Y161 WeakPolarHBondContact O-CD2 3.45Å; S157-Y161 WeakPolarHBondContact O-CE2 3.44Å
158V96.3Very high92Very high34 Ų3494.7 Ų94.721%0.20650%0.501CS..Hα-helixtrans-84.6-31.2-179.5172.20000111.5F154 W155 P160 Y161 C162F154-V158 HydrophobicContact CD1-CG2 4.4Å; F154-V158 HydrophobicContact CD2-CG2 4.34Å; F154-V158 HydrophobicContact CE1-CG2 4Å; F154-V158 HydrophobicContact CE2-CG2 3.94Å; F154-V158 HydrophobicContact CZ-CG2 3.76Å; F154-V158 WeakPolarHBondContact O-CG2 3.43Å; F154-V158 PolarHBondContact O-N 3.39Å; W155-V158 HydrophobicContact CE3-CB 4.45Å; W155-V158 HydrophobicContact CE3-CG1 4.43Å; W155-V158 HydrophobicContact CZ3-CG1 4.45Å; W155-V158 PolarHBondContact O-N 2.89Å; V158-P160 VanDerWaalsContact C-CD 3.44Å; V158-Y161 WeakPolarHBondContact O-CB 3.35Å; V158-Y161 PolarHBondContact O-N 3.17Å; V158-C162 VanDerWaalsContact CG1-SG 3.53Å; V158-C162 PolarHBondContact O-N 3.45Å
159E93.9Very high92.8Very high137 Ų13795 Ų9564%0.6450%0.5SS*.Hα-helixtrans-47.1-46.6-176.3178.6-179.8-150.200113.9W155 Y161 C162 A163W155-E159 WeakPolarHBondContact O-CB 3.44Å; W155-E159 PolarHBondContact O-N 3.01Å; E159-Y161 PolarHBondContact O-N 2.99Å; E159-C162 CarbonylContact O-C 3.58Å; E159-C162 PolarHBondContact O-N 3.42Å; E159-C162 VanDerWaalsContact O-N 3.12Å; E159-A163 PolarHBondContact O-N 3.35Å
160P93Very high93.3Very high91 Ų9192.2 Ų92.259%0.59149%0.485SS*.Hα-helixtrans-62.6-28.3179.8-22.734.8000114.2A156 V158A156-P160 WeakPolarHBondContact O-CD 3.49Å; V158-P160 VanDerWaalsContact C-CD 3.44Å
161Y91.9Very high93.8Very high205 Ų20596.7 Ų96.780%0.80449%0.49SS*.Hα-helixtrans-85.1-17.3179.8-57.7-82.1000112.8S157 V158 E159S157-Y161 WeakPolarHBondContact O-CD2 3.45Å; S157-Y161 WeakPolarHBondContact O-CE2 3.44Å; V158-Y161 WeakPolarHBondContact O-CB 3.35Å; V158-Y161 PolarHBondContact O-N 3.17Å; E159-Y161 PolarHBondContact O-N 2.99Å
162C90.9Very high94.1Very high98 Ų9896.6 Ų96.666%0.66249%0.488SS*.Hα-helixtrans-107.51.2177.6-60.80000112.8V158 E159V158-C162 VanDerWaalsContact CG1-SG 3.53Å; V158-C162 PolarHBondContact O-N 3.45Å; E159-C162 CarbonylContact O-C 3.58Å; E159-C162 PolarHBondContact O-N 3.42Å; E159-C162 VanDerWaalsContact O-N 3.12Å
163A92.3Very high94.4Very high59 Ų5993.3 Ų93.349%0.48847%0.47SS..SBendtrans-66.4151.7178.500000111.4E159E159-A163 PolarHBondContact O-N 3.35Å
164D95Very high94.6Very high86 Ų8688.6 Ų88.646%0.4646%0.456SS..PPolyproline II helixtrans-64.4150.2171-74.6-38.5000110.1Q377D164-Q377 HydrophobicContact CB-CG 4.44Å
165I95.4Very high94.7Very high45 Ų4589.2 Ų89.223%0.23146%0.46CS..PPolyproline II helixtrans-78.5128.9-176.5-64.4177000107.9E169 I170 A370 E373 M374 Q377I165-E169 VanDerWaalsContact CA-OE2 3.25Å; I165-E169 WeakPolarHBondContact CA-OE2 3.33Å; I165-E169 HydrophobicContact CG2-CB 4.42Å; I165-I170 HydrophobicContact CG2-CD1 4.14Å; I165-I170 HydrophobicContact CG2-CG1 4.27Å; I165-A370 HydrophobicContact CD1-CB 4.08Å; I165-A370 HydrophobicContact CG2-CB 4.47Å; I165-E373 HydrophobicContact CD1-CB 3.9Å; I165-E373 HydrophobicContact CD1-CG 3.83Å; I165-M374 HydrophobicContact CB-CG 4.37Å; I165-M374 HydrophobicContact CG2-CG 4.14Å; I165-Q377 VanDerWaalsContact N-OE1 3.16Å; I165-Q377 PolarHBondContact O-OE1 3.35Å
166T95.4Very high94.7Very high61 Ų6185.7 Ų85.737%0.37445%0.453SS..PPolyproline II helixtrans-93.8156.6-179.371.30000112E168 E169 I170T166-E168 PolarHBondContact O-N 2.93Å; T166-E169 WeakPolarHBondContact CG2-OE1 3.36Å; T166-E169 PolarHBondContact N-OE2 3.5Å; T166-E169 PolarHBondContact O-N 2.91Å; T166-E169 PolarHBondContact OG1-N 3.43Å; T166-E169 PolarHBondContact OG1-OE1 2.84Å; T166-I170 PolarHBondContact O-N 3.37Å
167N95.3Very high94.7Very high106 Ų10684.3 Ų84.357%0.56744%0.438SS*.Hα-helixtrans-58.9-26.5171.7-76.6-77.4000112.4R171 M374N167-R171 VanDerWaalsContact O-CG 3.32Å; N167-R171 WeakPolarHBondContact O-CG 3.44Å; N167-R171 PolarHBondContact O-N 3.44Å; N167-R171 VanDerWaalsContact O-N 3.09Å; N167-M374 WeakPolarHBondContact OD1-CE 3.33Å
168E95.8Very high94.5Very high108 Ų10887.8 Ų87.851%0.50544%0.444SS..Hα-helixtrans-72.1-41.7178.8-167.358.5-158.300111.3T166 I170 R171 V172T166-E168 PolarHBondContact O-N 2.93Å; E168-I170 VanDerWaalsContact C-N 3.29Å; E168-I170 PolarHBondContact O-N 2.89Å; E168-R171 WeakPolarHBondContact O-CB 3.32Å; E168-R171 PolarHBondContact O-N 3.22Å; E168-R171 VanDerWaalsContact O-N 3.09Å; E168-R171 IonicContact OE2-NH1 3.75Å; E168-R171 PolarHBondContact OE2-NH1 2.93Å; E168-R171 VanDerWaalsContact OE2-NH1 3.14Å; E168-V172 WeakPolarHBondContact O-CG2 3.48Å; E168-V172 PolarHBondContact O-N 2.87Å
169E94.6Very high93.9Very high87 Ų8789.7 Ų89.741%0.40746%0.457SS..Hα-helixtrans-61.7-37.4174.1-71.1138.6-143.500112.3I165 T166 V172 L173I165-E169 VanDerWaalsContact CA-OE2 3.25Å; I165-E169 WeakPolarHBondContact CA-OE2 3.33Å; I165-E169 HydrophobicContact CG2-CB 4.42Å; T166-E169 WeakPolarHBondContact CG2-OE1 3.36Å; T166-E169 PolarHBondContact N-OE2 3.5Å; T166-E169 PolarHBondContact O-N 2.91Å; T166-E169 PolarHBondContact OG1-N 3.43Å; T166-E169 PolarHBondContact OG1-OE1 2.84Å; E169-V172 PolarHBondContact O-N 3.33Å; E169-L173 WeakPolarHBondContact O-CG 3.5Å; E169-L173 PolarHBondContact O-N 3Å
170I96.5Very high93.4Very high11 Ų1186.7 Ų86.76%0.05645%0.45CS..Hα-helixtrans-61.8-45.9171.7-64.7-60.3000111.2I165 T166 E168 V172 L173 E174 L367 A370 K371 M374I165-I170 HydrophobicContact CG2-CD1 4.14Å; I165-I170 HydrophobicContact CG2-CG1 4.27Å; T166-I170 PolarHBondContact O-N 3.37Å; E168-I170 VanDerWaalsContact C-N 3.29Å; E168-I170 PolarHBondContact O-N 2.89Å; I170-V172 VanDerWaalsContact C-N 3.33Å; I170-V172 PolarHBondContact O-N 3.17Å; I170-L173 PolarHBondContact O-N 2.72Å; I170-E174 HydrophobicContact CG2-CG 4.41Å; I170-E174 WeakPolarHBondContact O-CG 3.47Å; I170-E174 PolarHBondContact O-N 3.45Å; I170-L367 HydrophobicContact CD1-CD1 4.34Å; I170-L367 HydrophobicContact CG2-CD1 3.88Å; I170-A370 HydrophobicContact CD1-CB 3.32Å; I170-K371 HydrophobicContact CD1-CG 4.24Å; I170-M374 HydrophobicContact CD1-SD 4.15Å; I170-M374 HydrophobicContact CG1-CG 4.41Å; I170-M374 HydrophobicContact CG1-SD 3.46Å; I170-M374 WeakPolarHBondContact CG1-SD 3.21Å
171R96.8Very high92.9Very high150 Ų15090.9 Ų90.957%0.56647%0.467SS*.Hα-helixtrans-61.8-41.5178-74.3170.4-178.9169.6-2.1111.9N167 E168 L173 E174 E175N167-R171 VanDerWaalsContact O-CG 3.32Å; N167-R171 WeakPolarHBondContact O-CG 3.44Å; N167-R171 PolarHBondContact O-N 3.44Å; N167-R171 VanDerWaalsContact O-N 3.09Å; E168-R171 WeakPolarHBondContact O-CB 3.32Å; E168-R171 PolarHBondContact O-N 3.22Å; E168-R171 VanDerWaalsContact O-N 3.09Å; E168-R171 IonicContact OE2-NH1 3.75Å; E168-R171 PolarHBondContact OE2-NH1 2.93Å; E168-R171 VanDerWaalsContact OE2-NH1 3.14Å; R171-L173 VanDerWaalsContact C-N 3.33Å; R171-L173 PolarHBondContact O-N 3.44Å; R171-E174 PolarHBondContact O-N 3.45Å; R171-E175 WeakPolarHBondContact O-CB 3.45Å; R171-E175 PolarHBondContact O-N 3.48Å
172V96Very high92.5Very high63 Ų6383.9 Ų83.938%0.38244%0.444SS..Hα-helixtrans-59.5-45.2174.7170.80000110.4E168 E169 I170 E174 E175 L176E168-V172 WeakPolarHBondContact O-CG2 3.48Å; E168-V172 PolarHBondContact O-N 2.87Å; E169-V172 PolarHBondContact O-N 3.33Å; I170-V172 VanDerWaalsContact C-N 3.33Å; I170-V172 PolarHBondContact O-N 3.17Å; V172-E174 VanDerWaalsContact C-N 3.35Å; V172-E174 PolarHBondContact O-N 2.99Å; V172-E175 PolarHBondContact O-N 2.94Å; V172-L176 HydrophobicContact CG1-CD1 3.98Å; V172-L176 HydrophobicContact CG1-CG 4.36Å; V172-L176 WeakPolarHBondContact O-CB 3.49Å; V172-L176 VanDerWaalsContact O-CG 3.24Å; V172-L176 WeakPolarHBondContact O-CG 3.24Å; V172-L176 PolarHBondContact O-N 2.74Å
173L95.5Very high92.1Very high35 Ų3582.1 Ų82.118%0.18343%0.426CS..Hα-helixtrans-62.9-39.4175.6-74.2172.5000112.7E169 I170 R171 L177 L367 A370E169-L173 WeakPolarHBondContact O-CG 3.5Å; E169-L173 PolarHBondContact O-N 3Å; I170-L173 PolarHBondContact O-N 2.72Å; R171-L173 VanDerWaalsContact C-N 3.33Å; R171-L173 PolarHBondContact O-N 3.44Å; L173-L177 WeakPolarHBondContact O-CG 3.46Å; L173-L177 PolarHBondContact O-N 2.96Å; L173-L367 HydrophobicContact CB-CD1 4.09Å; L173-A370 HydrophobicContact CD1-CB 4.18Å
174E95.9Very high91.7Very high79 Ų7982.5 Ų82.537%0.36943%0.428SS..Hα-helixtrans-66.4-37.6175.5-72.5178161.500112.3I170 R171 V172 L177 L367 K371I170-E174 HydrophobicContact CG2-CG 4.41Å; I170-E174 WeakPolarHBondContact O-CG 3.47Å; I170-E174 PolarHBondContact O-N 3.45Å; R171-E174 PolarHBondContact O-N 3.45Å; V172-E174 VanDerWaalsContact C-N 3.35Å; V172-E174 PolarHBondContact O-N 2.99Å; E174-L177 PolarHBondContact O-N 3.35Å; E174-L367 HydrophobicContact CG-CD1 3.82Å; E174-L367 HydrophobicContact CG-CD2 3.79Å; E174-L367 HydrophobicContact CG-CG 4.49Å; E174-K371 WeakPolarHBondContact OE1-CE 3.35Å; E174-K371 IonicContact OE1-NZ 2.64Å; E174-K371 PolarHBondContact OE1-NZ 3.11Å
175E95.4Very high91.4Very high128 Ų12884.3 Ų84.360%0.59843%0.434SS*.Hα-helixtrans-67.9-45.1174.9-174.5173.2-169.600111.6R171 V172 L177 K178R171-E175 WeakPolarHBondContact O-CB 3.45Å; R171-E175 PolarHBondContact O-N 3.48Å; V172-E175 PolarHBondContact O-N 2.94Å; E175-L177 PolarHBondContact O-N 2.91Å; E175-L177 VanDerWaalsContact O-N 3.09Å; E175-K178 VanDerWaalsContact O-CB 3.3Å; E175-K178 WeakPolarHBondContact O-CB 3.49Å; E175-K178 PolarHBondContact O-N 3Å
176L94Very high90.8Very high89 Ų8988.3 Ų88.347%0.46645%0.447SS..THydrogen-bonded Turntrans-63.6-14.6176.2-72.7174.9000114V172 K363V172-L176 HydrophobicContact CG1-CD1 3.98Å; V172-L176 HydrophobicContact CG1-CG 4.36Å; V172-L176 WeakPolarHBondContact O-CB 3.49Å; V172-L176 VanDerWaalsContact O-CG 3.24Å; V172-L176 WeakPolarHBondContact O-CG 3.24Å; V172-L176 PolarHBondContact O-N 2.74Å; L176-K363 HydrophobicContact CB-CD 4.31Å; L176-K363 WeakPolarHBondContact O-CD 3.26Å; L176-K363 PolarHBondContact O-NZ 3.03Å
177L93.4Very high90.5Very high29 Ų2987.9 Ų87.915%0.15244%0.439CS..THydrogen-bonded Turntrans-88.4-13.6174.2-84.5167000113.6L173 E174 E175 R360 K363 Q364 L367L173-L177 WeakPolarHBondContact O-CG 3.46Å; L173-L177 PolarHBondContact O-N 2.96Å; E174-L177 PolarHBondContact O-N 3.35Å; E175-L177 PolarHBondContact O-N 2.91Å; E175-L177 VanDerWaalsContact O-N 3.09Å; L177-R360 HydrophobicContact CD2-CG 4.07Å; L177-K363 HydrophobicContact CD2-CB 3.66Å; L177-K363 HydrophobicContact CG-CB 3.96Å; L177-Q364 HydrophobicContact CD1-CG 4.23Å; L177-Q364 HydrophobicContact CD2-CG 3.53Å; L177-L367 HydrophobicContact CD1-CB 4.24Å; L177-L367 HydrophobicContact CD1-CD2 3.61Å
178K91.4Very high90.2Very high142 Ų14289.5 Ų89.562%0.61744%0.441SS*.SBendtrans-68.1130.3172.9-63.7177.5-176.6170.80108.5E175E175-K178 VanDerWaalsContact O-CB 3.3Å; E175-K178 WeakPolarHBondContact O-CB 3.49Å; E175-K178 PolarHBondContact O-N 3Å
179P83.7Confident89.8Confident75 Ų7587.5 Ų87.549%0.48743%0.433SS..PPolyproline II helixtrans-61.7137.6173.725.9-31.3000109.1
180P83.1Confident89.4Confident74 Ų7488.8 Ų88.848%0.48145%0.449SS..PPolyproline II helixtrans-58.4140.8171.2-21.532.4000110.9D182 E183P180-D182 WeakPolarHBondContact CB-OD1 3.33Å; P180-D182 PolarHBondContact O-N 3.45Å; P180-E183 HydrophobicContact CB-CB 4.35Å; P180-E183 WeakPolarHBondContact O-CB 3.45Å; P180-E183 PolarHBondContact O-N 3.4Å; P180-E183 VanDerWaalsContact O-N 3.13Å
181D82.6Confident88.7Confident178 Ų17892.9 Ų92.995%0.95249%0.485SS*.THydrogen-bonded Turntrans-62.6-25.4-178.9-68.7-33000112.6
182D83.1Confident87.9Confident59 Ų5993.2 Ų93.232%0.31650%0.497SS..THydrogen-bonded Turntrans-95.43.2-179.363.7-19.2000113.7P180 A184 E185 Y186P180-D182 WeakPolarHBondContact CB-OD1 3.33Å; P180-D182 PolarHBondContact O-N 3.45Å; D182-A184 PolarHBondContact O-N 2.82Å; D182-A184 VanDerWaalsContact O-N 3.08Å; D182-E185 WeakPolarHBondContact O-CB 3.37Å; D182-E185 PolarHBondContact O-N 3.36Å; D182-Y186 PolarHBondContact OD2-OH 3.08Å
183E82.9Confident87.3Confident61 Ų6193.5 Ų93.529%0.28551%0.513SS..THydrogen-bonded Turntrans-56.2-34.7-175.5179.2170.7-141.700112.4P180 E185 Y187P180-E183 HydrophobicContact CB-CB 4.35Å; P180-E183 WeakPolarHBondContact O-CB 3.45Å; P180-E183 PolarHBondContact O-N 3.4Å; P180-E183 VanDerWaalsContact O-N 3.13Å; E183-E185 VanDerWaalsContact C-N 3.27Å; E183-E185 PolarHBondContact O-N 3.08Å; E183-Y187 HydrophobicContact CG-CE2 3.87Å; E183-Y187 WeakPolarHBondContact O-CD2 3.46Å; E183-Y187 WeakPolarHBondContact O-CE2 3.46Å
184A84.5Confident86.7Confident66 Ų6696.4 Ų96.455%0.54552%0.524SS..THydrogen-bonded Turntrans-69.1-22.4178.100000113.6D182D182-A184 PolarHBondContact O-N 2.82Å; D182-A184 VanDerWaalsContact O-N 3.08Å
185E87.3Confident86.2Confident125 Ų12597.2 Ų97.258%0.58453%0.527SS*.G310 helixtrans-74.2-33.5-179.1-59-169.2164.100111.8D182 E183 Y187 K188D182-E185 WeakPolarHBondContact O-CB 3.37Å; D182-E185 PolarHBondContact O-N 3.36Å; E183-E185 VanDerWaalsContact C-N 3.27Å; E183-E185 PolarHBondContact O-N 3.08Å; E185-Y187 PolarHBondContact O-N 3.3Å; E185-Y187 VanDerWaalsContact O-N 3.09Å; E185-K188 PolarHBondContact O-N 3.23Å; E185-K188 VanDerWaalsContact O-N 3.12Å
186Y84.3Confident85.6Confident128 Ų12897.7 Ų97.750%0.50253%0.525SS..G310 helixtrans-62.9-17.7177.8-57.6-52.5000114.1D182D182-Y186 PolarHBondContact OD2-OH 3.08Å
187Y88.3Confident85Confident52 Ų5296.1 Ų96.120%0.20452%0.521CS..G310 helixtrans-104.62.6-179.2-52.3-63.3000113.5E183 E185 Q349 L352 K353E183-Y187 HydrophobicContact CG-CE2 3.87Å; E183-Y187 WeakPolarHBondContact O-CD2 3.46Å; E183-Y187 WeakPolarHBondContact O-CE2 3.46Å; E185-Y187 PolarHBondContact O-N 3.3Å; E185-Y187 VanDerWaalsContact O-N 3.09Å; Y187-Q349 HydrophobicContact CD1-CB 4.23Å; Y187-Q349 HydrophobicContact CD1-CG 4.24Å; Y187-Q349 PolarHBondContact O-NE2 3.11Å; Y187-L352 HydrophobicContact CE1-CD2 4.08Å; Y187-L352 HydrophobicContact CE1-CG 4.33Å; Y187-K353 HydrophobicContact CD1-CD 4.47Å; Y187-K353 VanDerWaalsContact CD1-CE 3.5Å; Y187-K353 HydrophobicContact CD1-CG 4.21Å; Y187-K353 HydrophobicContact CE1-CD 4.21Å; Y187-K353 HydrophobicContact CE1-CG 3.49Å; Y187-K353 VanDerWaalsContact CE1-CG 3.49Å
188K89.9Confident84.5Confident141 Ų14198.5 Ų98.561%0.61353%0.532SS*.PPolyproline II helixtrans-87.3126176.9-70.2175-171.8168.60110.1E185E185-K188 PolarHBondContact O-N 3.23Å; E185-K188 VanDerWaalsContact O-N 3.12Å
189I87Confident84.2Confident65 Ų6598.3 Ų98.333%0.33353%0.527SS..PPolyproline II helixtrans-102.1116172.2-51.1-178000107.3L342 L345 H346I189-L342 HydrophobicContact CD1-CD1 3.84Å; I189-L342 HydrophobicContact CG2-CD1 3.88Å; I189-L345 HydrophobicContact CB-CD2 4.47Å; I189-L345 HydrophobicContact CD1-CD2 3.34Å; I189-L345 HydrophobicContact CG1-CD2 3.43Å; I189-L345 VanDerWaalsContact CG1-CD2 3.43Å; I189-L345 HydrophobicContact CG2-CD2 4.39Å; I189-H346 WeakPolarHBondContact CD1-CD2 3.23Å; I189-H346 WeakPolarHBondContact CD1-NE2 3.46Å
190P85.2Confident84.4Confident114 Ų114101.9 Ų101.974%0.7453%0.531SS*.PPolyproline II helixtrans-61.5148.7174.9-21.833.6000111.5
191A82.4Confident84.5Confident97 Ų97100.2 Ų100.280%0.80252%0.523SS*.PPolyproline II helixtrans-64.7144.8172.400000110.7G193A191-G193 PolarHBondContact O-N 3.22Å
192L80.8Confident84.6Confident158 Ų15892.8 Ų92.883%0.82748%0.483SS*.PPolyproline II helixtrans-59.5128170.3-67.3168.4000108.9
193G81.7Confident84.6Confident69 Ų6994.9 Ų94.971%0.71149%0.491SS*.  trans-72-174.3176.100000112.5A191 H195A191-G193 PolarHBondContact O-N 3.22Å; G193-H195 PolarHBondContact O-N 2.94Å
194K84.1Confident84.9Confident95 Ų9596.4 Ų96.441%0.41350%0.501SS..SBendtrans-58.1138.7171.2-64.5-167.9-173.4-171.70110.3R199 D235K194-R199 HydrophobicContact CB-CG 3.87Å; K194-D235 IonicContact NZ-OD1 2.67Å; K194-D235 PolarHBondContact NZ-OD1 3Å
195H84.8Confident84.8Confident96 Ų9695.8 Ų95.844%0.44449%0.488SS..  trans-60.8143.9177.7-168.7-100.6000110.9G193 S197 Q198 R199G193-H195 PolarHBondContact O-N 2.94Å; H195-S197 PolarHBondContact ND1-N 3.27Å; H195-S197 PolarHBondContact ND1-OG 3.21Å; H195-S197 PolarHBondContact O-N 2.92Å; H195-Q198 PolarHBondContact O-N 3.45Å; H195-R199 PolarHBondContact O-N 3.12Å; H195-R199 VanDerWaalsContact O-N 3.08Å
196Y82.9Confident84.6Confident138 Ų13892 Ų9254%0.54147%0.472SS..Hα-helixtrans-58-35.3-173.761-94.4000112.4Q198 R199 W200Y196-Q198 VanDerWaalsContact C-N 3.34Å; Y196-Q198 PolarHBondContact O-N 3.02Å; Y196-R199 PolarHBondContact O-N 3.27Å; Y196-R199 VanDerWaalsContact O-N 3.14Å; Y196-W200 HydrophobicContact CD2-CD2 4.3Å; Y196-W200 AromaticContact CD2-CE3 3.82Å; Y196-W200 HydrophobicContact CD2-CE3 3.82Å; Y196-W200 AromaticContact CD2-CH2 3.86Å; Y196-W200 HydrophobicContact CD2-CH2 3.86Å; Y196-W200 HydrophobicContact CD2-CZ2 4.33Å; Y196-W200 AromaticContact CD2-CZ3 3.58Å; Y196-W200 HydrophobicContact CD2-CZ3 3.58Å; Y196-W200 HydrophobicContact CE2-CE3 4.39Å; Y196-W200 HydrophobicContact CE2-CH2 4.31Å; Y196-W200 AromaticContact CE2-CZ3 3.88Å; Y196-W200 HydrophobicContact CE2-CZ3 3.88Å; Y196-W200 PolarHBondContact O-N 3.3Å
197S82.1Confident84.6Confident57 Ų5791.3 Ų91.340%0.39947%0.473SS..Hα-helixtrans-63.2-37.9177.262.30000112.8H195 A201H195-S197 PolarHBondContact ND1-N 3.27Å; H195-S197 PolarHBondContact ND1-OG 3.21Å; H195-S197 PolarHBondContact O-N 2.92Å; S197-A201 WeakPolarHBondContact O-CB 3.41Å; S197-A201 PolarHBondContact O-N 3.44Å
198Q82Confident84.3Confident79 Ų7995.2 Ų95.237%0.36949%0.493SS..Hα-helixtrans-70.9-35.5174.4-70.4-178.3-4.300111.3H195 Y196 Q202H195-Q198 PolarHBondContact O-N 3.45Å; Y196-Q198 VanDerWaalsContact C-N 3.34Å; Y196-Q198 PolarHBondContact O-N 3.02Å; Q198-Q202 WeakPolarHBondContact O-CB 3.42Å; Q198-Q202 PolarHBondContact O-N 2.94Å
199R85.4Confident83.6Confident138 Ų13891.3 Ų91.352%0.52148%0.477SS..Hα-helixtrans-66.8-43.5175.5-62.3-171.579175.64.2111.2K194 H195 Y196 Q202 E203K194-R199 HydrophobicContact CB-CG 3.87Å; H195-R199 PolarHBondContact O-N 3.12Å; H195-R199 VanDerWaalsContact O-N 3.08Å; Y196-R199 PolarHBondContact O-N 3.27Å; Y196-R199 VanDerWaalsContact O-N 3.14Å; R199-Q202 PolarHBondContact O-N 3.37Å; R199-E203 WeakPolarHBondContact O-CB 3.4Å; R199-E203 VanDerWaalsContact O-CG 3.24Å; R199-E203 WeakPolarHBondContact O-CG 3.36Å; R199-E203 PolarHBondContact O-N 3.4Å
200W88.6Confident83.2Confident150 Ų15095.4 Ų95.457%0.56849%0.488SS*.Hα-helixtrans-64.5-49.4174.9-69-21.4000111.9Y196 Q202 E203 D204Y196-W200 HydrophobicContact CD2-CD2 4.3Å; Y196-W200 AromaticContact CD2-CE3 3.82Å; Y196-W200 HydrophobicContact CD2-CE3 3.82Å; Y196-W200 AromaticContact CD2-CH2 3.86Å; Y196-W200 HydrophobicContact CD2-CH2 3.86Å; Y196-W200 HydrophobicContact CD2-CZ2 4.33Å; Y196-W200 AromaticContact CD2-CZ3 3.58Å; Y196-W200 HydrophobicContact CD2-CZ3 3.58Å; Y196-W200 HydrophobicContact CE2-CE3 4.39Å; Y196-W200 HydrophobicContact CE2-CH2 4.31Å; Y196-W200 AromaticContact CE2-CZ3 3.88Å; Y196-W200 HydrophobicContact CE2-CZ3 3.88Å; Y196-W200 PolarHBondContact O-N 3.3Å; W200-Q202 PolarHBondContact O-N 3.29Å; W200-E203 CarbonylContact O-C 3.55Å; W200-E203 PolarHBondContact O-N 3.49Å; W200-D204 WeakPolarHBondContact O-CB 3.42Å; W200-D204 VanDerWaalsContact O-CG 3.22Å; W200-D204 PolarHBondContact O-N 2.84Å
201A85.1Confident82.8Confident39 Ų3995.7 Ų95.732%0.32248%0.48SS..Hα-helixtrans-57.6-36.3176.300000112.4S197 L205 L238S197-A201 WeakPolarHBondContact O-CB 3.41Å; S197-A201 PolarHBondContact O-N 3.44Å; A201-L205 WeakPolarHBondContact O-CB 3.28Å; A201-L205 PolarHBondContact O-N 3.16Å; A201-L238 HydrophobicContact CB-CD1 4.15Å; A201-L238 HydrophobicContact CB-CD2 4.19Å
202Q83.6Confident82.2Confident22 Ų2292.9 Ų92.910%0.10346%0.46CS..Hα-helixtrans-69.1-42.9173.7168.7161.528.400112.5Q198 R199 W200 L206 A231 V234 L238Q198-Q202 WeakPolarHBondContact O-CB 3.42Å; Q198-Q202 PolarHBondContact O-N 2.94Å; R199-Q202 PolarHBondContact O-N 3.37Å; W200-Q202 PolarHBondContact O-N 3.29Å; Q202-L206 HydrophobicContact CG-CD1 4.07Å; Q202-L206 WeakPolarHBondContact O-CB 3.33Å; Q202-L206 WeakPolarHBondContact O-CD1 3.49Å; Q202-L206 VanDerWaalsContact O-CG 3.23Å; Q202-L206 WeakPolarHBondContact O-CG 3.49Å; Q202-L206 PolarHBondContact O-N 3.46Å; Q202-L206 VanDerWaalsContact O-N 3.13Å; Q202-A231 PolarHBondContact NE2-O 2.96Å; Q202-V234 HydrophobicContact CB-CG1 4.04Å; Q202-V234 HydrophobicContact CG-CG1 3.81Å; Q202-L238 HydrophobicContact CB-CD1 4.15Å
203E84.3Confident81.5Confident103 Ų10388 Ų8848%0.48144%0.443SS..Hα-helixtrans-66.9-45.1178.5-77168.3-170.500111.5R199 W200 L205 L206 E207R199-E203 WeakPolarHBondContact O-CB 3.4Å; R199-E203 VanDerWaalsContact O-CG 3.24Å; R199-E203 WeakPolarHBondContact O-CG 3.36Å; R199-E203 PolarHBondContact O-N 3.4Å; W200-E203 CarbonylContact O-C 3.55Å; W200-E203 PolarHBondContact O-N 3.49Å; E203-L205 PolarHBondContact O-N 3.25Å; E203-L206 CarbonylContact O-C 3.54Å; E203-L206 PolarHBondContact O-N 3.47Å; E203-E207 WeakPolarHBondContact O-CB 3.43Å; E203-E207 PolarHBondContact O-N 2.9Å
204D87.8Confident80.6Confident92 Ų9293 Ų9349%0.49244%0.44SS..Hα-helixtrans-59.8-46.6176.7-67.2-9.6000110.7W200 L206 E207 E208W200-D204 WeakPolarHBondContact O-CB 3.42Å; W200-D204 VanDerWaalsContact O-CG 3.22Å; W200-D204 PolarHBondContact O-N 2.84Å; D204-L206 VanDerWaalsContact C-N 3.32Å; D204-L206 PolarHBondContact O-N 3.36Å; D204-E207 WeakPolarHBondContact O-CB 3.35Å; D204-E207 PolarHBondContact O-N 2.92Å; D204-E207 VanDerWaalsContact O-N 3.1Å; D204-E208 WeakPolarHBondContact O-CG 3.31Å; D204-E208 PolarHBondContact O-N 2.79Å
205L83Confident79.4Confident53 Ų5391.7 Ų91.728%0.27745%0.447SS..Hα-helixtrans-64.8-37.7178.1-170.967.8000112.2A201 E203 E207 Q209 V234 L237A201-L205 WeakPolarHBondContact O-CB 3.28Å; A201-L205 PolarHBondContact O-N 3.16Å; E203-L205 PolarHBondContact O-N 3.25Å; L205-E207 VanDerWaalsContact C-N 3.31Å; L205-Q209 WeakPolarHBondContact O-CB 3.28Å; L205-Q209 PolarHBondContact O-N 2.91Å; L205-V234 HydrophobicContact CB-CG1 4.37Å; L205-V234 HydrophobicContact CD2-CB 4.33Å; L205-V234 HydrophobicContact CD2-CG1 3.74Å; L205-V234 HydrophobicContact CD2-CG2 4.08Å; L205-L237 HydrophobicContact CD2-CD2 4.18Å
206L82.9Confident77.9Confident47 Ų4791.9 Ų91.925%0.24645%0.452CS..Hα-helixtrans-68.9-31.9174.2-74.4169000111.9Q202 E203 D204 R210 V234Q202-L206 HydrophobicContact CG-CD1 4.07Å; Q202-L206 WeakPolarHBondContact O-CB 3.33Å; Q202-L206 WeakPolarHBondContact O-CD1 3.49Å; Q202-L206 VanDerWaalsContact O-CG 3.23Å; Q202-L206 WeakPolarHBondContact O-CG 3.49Å; Q202-L206 PolarHBondContact O-N 3.46Å; Q202-L206 VanDerWaalsContact O-N 3.13Å; E203-L206 CarbonylContact O-C 3.54Å; E203-L206 PolarHBondContact O-N 3.47Å; D204-L206 VanDerWaalsContact C-N 3.32Å; D204-L206 PolarHBondContact O-N 3.36Å; L206-R210 WeakPolarHBondContact O-CB 3.47Å; L206-R210 PolarHBondContact O-N 3.28Å; L206-R210 VanDerWaalsContact O-N 3.1Å; L206-V234 HydrophobicContact CD2-CG2 3.95Å; L206-V234 HydrophobicContact CG-CG2 4.23Å
207E84.2Confident76.4Confident112 Ų11290.3 Ų90.352%0.52345%0.453SS..Hα-helixtrans-71.1-47.9175.3-172.5157.7-126.400111.2E203 D204 L205 Q209 R210 E211E203-E207 WeakPolarHBondContact O-CB 3.43Å; E203-E207 PolarHBondContact O-N 2.9Å; D204-E207 WeakPolarHBondContact O-CB 3.35Å; D204-E207 PolarHBondContact O-N 2.92Å; D204-E207 VanDerWaalsContact O-N 3.1Å; L205-E207 VanDerWaalsContact C-N 3.31Å; E207-Q209 VanDerWaalsContact C-N 3.29Å; E207-Q209 PolarHBondContact O-N 3.2Å; E207-R210 CarbonylContact O-C 3.05Å; E207-R210 WeakPolarHBondContact O-CA 3.25Å; E207-R210 WeakPolarHBondContact O-CB 3.42Å; E207-R210 PolarHBondContact O-N 3.2Å; E207-E211 HydrophobicContact CG-CG 4.49Å; E207-E211 WeakPolarHBondContact O-CG 3.34Å; E207-E211 PolarHBondContact O-N 3.46Å
208E81.4Confident75.2Confident135 Ų13596.9 Ų96.963%0.63147%0.474SS*.Hα-helixtrans-57.6-40.7173.5-73.1-169155.800111.9D204 R210 E211 G212D204-E208 WeakPolarHBondContact O-CG 3.31Å; D204-E208 PolarHBondContact O-N 2.79Å; E208-R210 VanDerWaalsContact C-N 3.34Å; E208-R210 PolarHBondContact O-N 3.37Å; E208-E211 PolarHBondContact O-N 3.02Å; E208-G212 PolarHBondContact O-N 3.42Å
209Q76.7Confident73.9Confident59 Ų59101.7 Ų101.728%0.27649%0.494SS..Hα-helixtrans-63.3-41.2174.7-174179.25400111.5L205 E207 G212 A213L205-Q209 WeakPolarHBondContact O-CB 3.28Å; L205-Q209 PolarHBondContact O-N 2.91Å; E207-Q209 VanDerWaalsContact C-N 3.29Å; E207-Q209 PolarHBondContact O-N 3.2Å; Q209-G212 PolarHBondContact O-N 3.09Å; Q209-A213 VanDerWaalsContact O-CB 3.3Å; Q209-A213 WeakPolarHBondContact O-CB 3.43Å; Q209-A213 PolarHBondContact O-N 3.09Å
210R78.8Confident72.1Confident150 Ų150103.6 Ų103.657%0.56651%0.506SS*.Hα-helixtrans-67.8-40.7178.8-171.9-171.1-53.5-111-1.6111.7L206 E207 E208 R214L206-R210 WeakPolarHBondContact O-CB 3.47Å; L206-R210 PolarHBondContact O-N 3.28Å; L206-R210 VanDerWaalsContact O-N 3.1Å; E207-R210 CarbonylContact O-C 3.05Å; E207-R210 WeakPolarHBondContact O-CA 3.25Å; E207-R210 WeakPolarHBondContact O-CB 3.42Å; E207-R210 PolarHBondContact O-N 3.2Å; E208-R210 VanDerWaalsContact C-N 3.34Å; E208-R210 PolarHBondContact O-N 3.37Å; R210-R214 VanDerWaalsContact O-CG 3.31Å; R210-R214 WeakPolarHBondContact O-CG 3.44Å; R210-R214 PolarHBondContact O-N 2.93Å; R210-R214 VanDerWaalsContact O-N 3.07Å
211E76.1Confident70.1Confident121 Ų121101.8 Ų101.857%0.56552%0.516SS*.Hα-helixtrans-68-42175.2-69.1-162.9153.900111.6E207 E208 A213 R214 A215E207-E211 HydrophobicContact CG-CG 4.49Å; E207-E211 WeakPolarHBondContact O-CG 3.34Å; E207-E211 PolarHBondContact O-N 3.46Å; E208-E211 PolarHBondContact O-N 3.02Å; E211-A213 PolarHBondContact O-N 2.97Å; E211-R214 PolarHBondContact O-N 3.21Å; E211-A215 WeakPolarHBondContact O-CB 3.25Å; E211-A215 PolarHBondContact O-N 3.22Å
212G70.3Confident68.3Low38 Ų38107.8 Ų107.839%0.39254%0.542SS..Hα-helixtrans-61.7-40.2173.200000112.9E208 Q209 A215 N216E208-G212 PolarHBondContact O-N 3.42Å; Q209-G212 PolarHBondContact O-N 3.09Å; G212-A215 PolarHBondContact O-N 3.18Å; G212-N216 WeakPolarHBondContact O-CB 3.43Å; G212-N216 PolarHBondContact O-N 3.12Å
213A66Low66.2Low56 Ų56115.7 Ų115.746%0.46358%0.581SS.*Hα-helixtrans-63.2-43.8173.800000111.8Q209 E211 A215 N216 D217Q209-A213 VanDerWaalsContact O-CB 3.3Å; Q209-A213 WeakPolarHBondContact O-CB 3.43Å; Q209-A213 PolarHBondContact O-N 3.09Å; E211-A213 PolarHBondContact O-N 2.97Å; A213-A215 VanDerWaalsContact C-N 3.33Å; A213-A215 PolarHBondContact O-N 2.91Å; A213-N216 PolarHBondContact O-N 3.04Å; A213-D217 PolarHBondContact O-N 3.27Å
214R62.5Low64.3Low173 Ų173113.5 Ų113.565%0.65359%0.586SS**Hα-helixtrans-66.6-31.3175.5-72.4173.8174.7-180-0.1113.2R210 E211R210-R214 VanDerWaalsContact O-CG 3.31Å; R210-R214 WeakPolarHBondContact O-CG 3.44Å; R210-R214 PolarHBondContact O-N 2.93Å; R210-R214 VanDerWaalsContact O-N 3.07Å; E211-R214 PolarHBondContact O-N 3.21Å
215A59.6Low62.2Low68 Ų68115.3 Ų115.356%0.56260%0.603SS**Hα-helixtrans-73.7-34.3174.900000112.3E211 G212 A213E211-A215 WeakPolarHBondContact O-CB 3.25Å; E211-A215 PolarHBondContact O-N 3.22Å; G212-A215 PolarHBondContact O-N 3.18Å; A213-A215 VanDerWaalsContact C-N 3.33Å; A213-A215 PolarHBondContact O-N 2.91Å
216N53.2Low60.5Low100 Ų100120.1 Ų120.154%0.53563%0.628SS.*Hα-helixtrans-76.6-21.4-179.7-158.224000113.4G212 A213 K218 K219G212-N216 WeakPolarHBondContact O-CB 3.43Å; G212-N216 PolarHBondContact O-N 3.12Å; A213-N216 PolarHBondContact O-N 3.04Å; N216-K218 PolarHBondContact O-N 2.81Å; N216-K219 CarbonylContact O-C 3.53Å; N216-K219 PolarHBondContact O-N 2.8Å
217D51.8Low59Low105 Ų105122.2 Ų122.256%0.56165%0.646SS**G310 helixtrans-62.2-21.6173.5-87.9-44.9000113.4A213 K219A213-D217 PolarHBondContact O-N 3.27Å; D217-K219 VanDerWaalsContact C-N 3.28Å; D217-K219 PolarHBondContact O-N 2.93Å
218K55.3Low57.6Low195 Ų195125.6 Ų125.685%0.84866%0.662SS**G310 helixtrans-79.2-6.5173.3-65.8-177.1-177.1175.10113.8N216N216-K218 PolarHBondContact O-N 2.81Å
219K55.8Low56.5Low179 Ų179122.9 Ų122.978%0.77865%0.652SS**G310 helixtrans-133.535.8-175.6-125-178-173.6178.20112.9N216 D217 S221N216-K219 CarbonylContact O-C 3.53Å; N216-K219 PolarHBondContact O-N 2.8Å; D217-K219 VanDerWaalsContact C-N 3.28Å; D217-K219 PolarHBondContact O-N 2.93Å; K219-S221 PolarHBondContact O-N 3.41Å
220K47.9Very low55.9Low179 Ų179123.7 Ų123.778%0.77866%0.658SS**  trans-81.877.8179.4-152.7171.2-167.1164.70112.6
221S45.6Very low55.1Low112 Ų112119 Ų11978%0.78365%0.652SS**SBendtrans-152.8117.5143.9-168.50000107.8K219K219-S221 PolarHBondContact O-N 3.41Å
222L47.1Very low54.8Low165 Ų165120.8 Ų120.886%0.86466%0.657SS**SBendtrans105.931.8165.3-148.770.7000120.8
223M39.4Very low54.8Low188 Ų188122.8 Ų122.893%0.92666%0.659SS**  trans-154.6144.4148.3-106.1-164.58300112.3
224G44.2Very low54.8Low57 Ų57120.2 Ų120.259%0.58864%0.637SS**  trans-68.6-173.4-167.700000116.4L226G224-L226 PolarHBondContact O-N 3.35Å; G224-L226 VanDerWaalsContact O-N 3.08Å
225P44.2Very low55.2Low129 Ų129113.5 Ų113.584%0.83862%0.615SS**  trans-71107.7-166.629-32.1000110.8S227P225-S227 PolarHBondContact O-N 3.12Å
226L47.2Very low55.9Low154 Ų154113 Ų11381%0.80661%0.611SS**  trans-73.8104.2156.2-99.1133000106.4G224 E228G224-L226 PolarHBondContact O-N 3.35Å; G224-L226 VanDerWaalsContact O-N 3.08Å; L226-E228 PolarHBondContact O-N 3.32Å
227S52.2Low56.7Low91 Ų91112.7 Ų112.764%0.63661%0.609SS**PPolyproline II helixtrans-56.5132.4177.3-590000110.7P225 L229P225-S227 PolarHBondContact O-N 3.12Å; S227-L229 PolarHBondContact O-N 3.47Å
228E55.3Low57.3Low183 Ų183109.9 Ų109.986%0.85559%0.593SS**PPolyproline II helixtrans-47.5121.9157-96.8172.7148.200107.8L226L226-E228 PolarHBondContact O-N 3.32Å
229L58.5Low57.9Low78 Ų78106.6 Ų106.641%0.40858%0.579SS.*PPolyproline II helixtrans-84.1131.7174.9-76.6157.5000105.9S227 D233 V234S227-L229 PolarHBondContact O-N 3.47Å; L229-D233 HydrophobicContact CB-CB 4.08Å; L229-D233 HydrophobicContact CD2-CB 3.56Å; L229-D233 HydrophobicContact CG-CB 4.43Å; L229-V234 HydrophobicContact CB-CG2 4.45Å
230D62.3Low58.4Low76 Ų76104.5 Ų104.541%0.40657%0.57SS.*PPolyproline II helixtrans-77.8170.117888.35.8000111K232 D233 V234D230-K232 PolarHBondContact O-N 3.49Å; D230-K232 VanDerWaalsContact OD1-CA 3.25Å; D230-K232 WeakPolarHBondContact OD1-CA 3.38Å; D230-K232 WeakPolarHBondContact OD1-CB 3.32Å; D230-K232 PolarHBondContact OD1-N 3.18Å; D230-D233 PolarHBondContact N-OD2 2.87Å; D230-D233 PolarHBondContact O-N 2.91Å; D230-D233 VanDerWaalsContact O-N 3.08Å; D230-D233 PolarHBondContact OD1-N 3.5Å; D230-V234 PolarHBondContact O-N 3.02Å; D230-V234 VanDerWaalsContact O-N 3.15Å
231A62.8Low58.8Low53 Ų5399 Ų9944%0.43855%0.554SS.*Hα-helixtrans-58.5-18.7179.100000114.3Q202 D235Q202-A231 PolarHBondContact NE2-O 2.96Å; A231-D235 PolarHBondContact O-N 2.85Å
232K69.4Low59.2Low157 Ų157100 Ų10068%0.68355%0.546SS*.Hα-helixtrans-87.2-34.9177.1-54.4174.6176.91730111.2D230 V234 D235 A236D230-K232 PolarHBondContact O-N 3.49Å; D230-K232 VanDerWaalsContact OD1-CA 3.25Å; D230-K232 WeakPolarHBondContact OD1-CA 3.38Å; D230-K232 WeakPolarHBondContact OD1-CB 3.32Å; D230-K232 PolarHBondContact OD1-N 3.18Å; K232-V234 VanDerWaalsContact C-N 3.34Å; K232-D235 WeakPolarHBondContact O-CB 3.22Å; K232-D235 PolarHBondContact O-N 3.25Å; K232-A236 PolarHBondContact O-N 3.19Å
233D71.6Confident59.4Low80 Ų8096.5 Ų96.543%0.42854%0.536SS..Hα-helixtrans-67.1-38.2174.8-63-38.9000111.4L229 D230 A236 L237L229-D233 HydrophobicContact CB-CB 4.08Å; L229-D233 HydrophobicContact CD2-CB 3.56Å; L229-D233 HydrophobicContact CG-CB 4.43Å; D230-D233 PolarHBondContact N-OD2 2.87Å; D230-D233 PolarHBondContact O-N 2.91Å; D230-D233 VanDerWaalsContact O-N 3.08Å; D230-D233 PolarHBondContact OD1-N 3.5Å; D233-A236 PolarHBondContact O-N 2.67Å; D233-L237 PolarHBondContact O-N 3.05Å
234V65.5Low59.8Low2 Ų294.6 Ų94.61%0.01253%0.525CS..Hα-helixtrans-62.9-42.6171.9169.20000111.6Q202 L205 L206 L229 D230 K232 A236 L237 L238Q202-V234 HydrophobicContact CB-CG1 4.04Å; Q202-V234 HydrophobicContact CG-CG1 3.81Å; L205-V234 HydrophobicContact CB-CG1 4.37Å; L205-V234 HydrophobicContact CD2-CB 4.33Å; L205-V234 HydrophobicContact CD2-CG1 3.74Å; L205-V234 HydrophobicContact CD2-CG2 4.08Å; L206-V234 HydrophobicContact CD2-CG2 3.95Å; L206-V234 HydrophobicContact CG-CG2 4.23Å; L229-V234 HydrophobicContact CB-CG2 4.45Å; D230-V234 PolarHBondContact O-N 3.02Å; D230-V234 VanDerWaalsContact O-N 3.15Å; K232-V234 VanDerWaalsContact C-N 3.34Å; V234-A236 VanDerWaalsContact C-N 3.32Å; V234-A236 PolarHBondContact O-N 3.4Å; V234-L237 PolarHBondContact O-N 3.37Å; V234-L238 HydrophobicContact CG1-CD1 4.03Å; V234-L238 WeakPolarHBondContact O-CG 3.43Å; V234-L238 PolarHBondContact O-N 3.37Å
235D69.6Low59.7Low32 Ų3299 Ų9917%0.17153%0.53CS..Hα-helixtrans-62.6-39176.5-166.786.8000112.1K194 A231 K232 K239K194-D235 IonicContact NZ-OD1 2.67Å; K194-D235 PolarHBondContact NZ-OD1 3Å; A231-D235 PolarHBondContact O-N 2.85Å; K232-D235 WeakPolarHBondContact O-CB 3.22Å; K232-D235 PolarHBondContact O-N 3.25Å; D235-K239 PolarHBondContact O-N 3.41Å; D235-K239 IonicContact OD2-NZ 3.69Å; D235-K239 PolarHBondContact OD2-NZ 2.93Å
236A74.8Confident59.6Low58 Ų5899.6 Ų99.648%0.47953%0.526SS..Hα-helixtrans-68.8-37.4176.100000112.3K232 D233 V234 K240K232-A236 PolarHBondContact O-N 3.19Å; D233-A236 PolarHBondContact O-N 2.67Å; V234-A236 VanDerWaalsContact C-N 3.32Å; V234-A236 PolarHBondContact O-N 3.4Å; A236-K240 WeakPolarHBondContact O-CB 3.13Å; A236-K240 PolarHBondContact O-N 3.46Å; A236-K240 VanDerWaalsContact O-N 3.11Å
237L69.8Low59.6Low94 Ų9496.1 Ų96.149%0.49251%0.513SS..Hα-helixtrans-68.7-43.5178-170.863000111.7L205 D233 V234 K239 K240 S241L205-L237 HydrophobicContact CD2-CD2 4.18Å; D233-L237 PolarHBondContact O-N 3.05Å; V234-L237 PolarHBondContact O-N 3.37Å; L237-K239 PolarHBondContact O-N 3.22Å; L237-K240 WeakPolarHBondContact O-CB 3.2Å; L237-K240 PolarHBondContact O-N 2.91Å; L237-K240 VanDerWaalsContact O-N 3.11Å; L237-S241 PolarHBondContact O-N 2.9Å; L237-S241 PolarHBondContact O-OG 3.23Å
238L64.3Low59.3Low46 Ų4697.2 Ų97.224%0.24152%0.518CS..Hα-helixtrans-62.5-40.9176.7-72.6171.2000112.4A201 Q202 V234 K240 S241 E242A201-L238 HydrophobicContact CB-CD1 4.15Å; A201-L238 HydrophobicContact CB-CD2 4.19Å; Q202-L238 HydrophobicContact CB-CD1 4.15Å; V234-L238 HydrophobicContact CG1-CD1 4.03Å; V234-L238 WeakPolarHBondContact O-CG 3.43Å; V234-L238 PolarHBondContact O-N 3.37Å; L238-K240 VanDerWaalsContact C-N 3.29Å; L238-K240 PolarHBondContact O-N 3.13Å; L238-S241 WeakPolarHBondContact CA-OG 3.31Å; L238-S241 PolarHBondContact O-N 3.45Å; L238-S241 PolarHBondContact O-OG 2.87Å; L238-E242 PolarHBondContact O-N 3.38Å
239K68.3Low58.9Low125 Ų12596.9 Ų96.954%0.54352%0.522SS..Hα-helixtrans-65-32.6173-80.3174.9176.4143.80113.1D235 L237 S243D235-K239 PolarHBondContact O-N 3.41Å; D235-K239 IonicContact OD2-NZ 3.69Å; D235-K239 PolarHBondContact OD2-NZ 2.93Å; L237-K239 PolarHBondContact O-N 3.22Å; K239-S243 PolarHBondContact O-N 3.34Å; K239-S243 PolarHBondContact O-OG 3.45Å
240K66.2Low58.4Low135 Ų13599.7 Ų99.759%0.58754%0.537SS*.Hα-helixtrans-75.8-33177.5-163.5176.9179.4-174.30111.9A236 L237 L238 S243 Q244A236-K240 WeakPolarHBondContact O-CB 3.13Å; A236-K240 PolarHBondContact O-N 3.46Å; A236-K240 VanDerWaalsContact O-N 3.11Å; L237-K240 WeakPolarHBondContact O-CB 3.2Å; L237-K240 PolarHBondContact O-N 2.91Å; L237-K240 VanDerWaalsContact O-N 3.11Å; L238-K240 VanDerWaalsContact C-N 3.29Å; L238-K240 PolarHBondContact O-N 3.13Å; K240-S243 WeakPolarHBondContact CA-OG 3.42Å; K240-S243 PolarHBondContact O-OG 3.31Å; K240-S243 VanDerWaalsContact O-OG 3.06Å; K240-Q244 PolarHBondContact O-N 2.98Å
241S56Low58.1Low65 Ų6599.8 Ų99.846%0.45556%0.556SS.*Hα-helixtrans-73.1-36.9173.455.70000112.8L237 L238 S243 Q244L237-S241 PolarHBondContact O-N 2.9Å; L237-S241 PolarHBondContact O-OG 3.23Å; L238-S241 WeakPolarHBondContact CA-OG 3.31Å; L238-S241 PolarHBondContact O-N 3.45Å; L238-S241 PolarHBondContact O-OG 2.87Å; S241-S243 PolarHBondContact O-N 2.93Å; S241-Q244 CarbonylContact O-C 3.54Å; S241-Q244 VanDerWaalsContact O-C 3.29Å; S241-Q244 PolarHBondContact O-N 3.35Å; S241-Q244 VanDerWaalsContact O-N 3.11Å
242E53.8Low58Low131 Ų131100 Ų10061%0.61255%0.554SS**Hα-helixtrans-62.7-32.1173.9-82.7-179.6154.200112.6L238 Q244L238-E242 PolarHBondContact O-N 3.38Å; E242-Q244 VanDerWaalsContact C-N 3.33Å
243S52.6Low58Low93 Ų9395 Ų9565%0.6554%0.537SS*.THydrogen-bonded Turntrans-82.8-7.9176.444.40000114K239 K240 S241K239-S243 PolarHBondContact O-N 3.34Å; K239-S243 PolarHBondContact O-OG 3.45Å; K240-S243 WeakPolarHBondContact CA-OG 3.42Å; K240-S243 PolarHBondContact O-OG 3.31Å; K240-S243 VanDerWaalsContact O-OG 3.06Å; S241-S243 PolarHBondContact O-N 2.93Å
244Q48.3Very low58.1Low147 Ų14793.5 Ų93.569%0.68753%0.527SS*.THydrogen-bonded Turntrans-12254.8174.1-65.1-149.8-75.900110.8K240 S241 E242 D246K240-Q244 PolarHBondContact O-N 2.98Å; S241-Q244 CarbonylContact O-C 3.54Å; S241-Q244 VanDerWaalsContact O-C 3.29Å; S241-Q244 PolarHBondContact O-N 3.35Å; S241-Q244 VanDerWaalsContact O-N 3.11Å; E242-Q244 VanDerWaalsContact C-N 3.33Å; Q244-D246 VanDerWaalsContact C-N 3.25Å; Q244-D246 PolarHBondContact O-N 3.1Å
245H40.7Very low58.6Low151 Ų15194 Ų9470%0.69953%0.533SS*.  trans-77.375.9172-169.3-68.1000111
246D41.8Very low58.9Low140 Ų14096.8 Ų96.875%0.74955%0.552SS**PPolyproline II helixtrans-94.8120.8144.9-104.9-51.2000106.1Q244Q244-D246 VanDerWaalsContact C-N 3.25Å; Q244-D246 PolarHBondContact O-N 3.1Å
247P48.1Very low59Low82 Ų8296 Ų9653%0.53254%0.54SS..PPolyproline II helixtrans-64.2145.9-177.925.9-31.1000110.1D249P247-D249 PolarHBondContact O-N 2.84Å
248P45.9Very low59.6Low114 Ų11491.9 Ų91.974%0.7452%0.519SS*.PPolyproline II helixtrans-57.6138174.723.8-30.8000109.6D250P248-D250 PolarHBondContact O-N 2.88Å
249D46.5Very low60.5Low176 Ų17693.5 Ų93.594%0.94153%0.525SS*.  trans-71.762.1-178.6-15115.4000109.8P247 G251P247-D249 PolarHBondContact O-N 2.84Å; D249-G251 PolarHBondContact O-N 2.87Å
250D48.6Very low61Low137 Ų13796.5 Ų96.573%0.73353%0.533SS*.  trans-95.575.7-175.1-148.18.5000109.2P248 C252P248-D250 PolarHBondContact O-N 2.88Å; D250-C252 PolarHBondContact O-N 2.77Å
251G55.9Low61.7Low78 Ų7893.4 Ų93.480%0.80452%0.522SS*.SBendtrans57.4-18.8156.200000120.8D249D249-G251 PolarHBondContact O-N 2.87Å
252C60.4Low62.8Low57 Ų5793.4 Ų93.439%0.38552%0.517SS..  trans-113.5118.3-169.3-173.50000109.9D250 F254D250-C252 PolarHBondContact O-N 2.77Å; C252-F254 PolarHBondContact O-N 3.33Å; C252-F254 VanDerWaalsContact O-N 3.13Å
253P69.1Low63.9Low52 Ų5292 Ų9234%0.33851%0.51SS..SBendtrans-72.3-8.1-173.431-36.9000113.4T308P253-T308 HydrophobicContact CB-CG2 3.91Å; P253-T308 HydrophobicContact CG-CG2 4.47Å; P253-T308 WeakPolarHBondContact O-CB 3.34Å; P253-T308 WeakPolarHBondContact O-CG2 3.48Å; P253-T308 PolarHBondContact O-OG1 3.39Å
254F73.8Confident65.1Low48 Ų4889.8 Ų89.821%0.21150%0.498CS..SBendtrans-89.3146.8-178.6-57.6-65.6000111.3C252 T258 Q259 L262 V305 T308 L311C252-F254 PolarHBondContact O-N 3.33Å; C252-F254 VanDerWaalsContact O-N 3.13Å; F254-T258 HydrophobicContact CB-CG2 3.88Å; F254-T258 HydrophobicContact CD1-CG2 3.87Å; F254-T258 HydrophobicContact CG-CG2 3.95Å; F254-Q259 HydrophobicContact CB-CG 4.07Å; F254-Q259 WeakPolarHBondContact O-CG 3.27Å; F254-Q259 PolarHBondContact O-NE2 2.87Å; F254-L262 HydrophobicContact CD2-CD1 3.69Å; F254-L262 HydrophobicContact CE2-CD1 4Å; F254-L262 HydrophobicContact CG-CD1 4.19Å; F254-V305 HydrophobicContact CE1-CB 4.44Å; F254-V305 HydrophobicContact CE1-CG2 4.34Å; F254-V305 HydrophobicContact CZ-CG2 4.06Å; F254-T308 HydrophobicContact CD1-CG2 3.98Å; F254-T308 HydrophobicContact CE1-CG2 4.11Å; F254-L311 HydrophobicContact CD1-CD2 4.12Å; F254-L311 HydrophobicContact CE1-CD2 3.89Å
255G75.5Confident66.5Low13 Ų1385.9 Ų85.913%0.13448%0.481CS..  trans-77.9169.3174.100000113.6L257 T258 Q259 E312G255-L257 VanDerWaalsContact C-N 3.28Å; G255-L257 PolarHBondContact O-N 3.09Å; G255-L257 VanDerWaalsContact O-N 3.14Å; G255-T258 PolarHBondContact O-N 2.95Å; G255-Q259 WeakPolarHBondContact O-CG 3.44Å; G255-Q259 PolarHBondContact O-N 3.47Å; G255-E312 WeakPolarHBondContact CA-OE1 3.3Å; G255-E312 WeakPolarHBondContact CA-OE2 3.39Å
256P76.3Confident68Low90 Ų9081.1 Ų81.158%0.58446%0.462SS*.Hα-helixtrans-55.6-36.4-166.3-26.233.9000114.8R260 E312P256-R260 WeakPolarHBondContact O-CB 3.36Å; P256-R260 PolarHBondContact O-N 3.14Å; P256-E312 WeakPolarHBondContact CD-OE1 3.37Å
257L78.4Confident69.3Low41 Ų4180.8 Ų80.822%0.21546%0.457CS..Hα-helixtrans-64.4-47.5178.3173.962000110.8G255 Q259 R260 L261 E312 I315 K316 L319G255-L257 VanDerWaalsContact C-N 3.28Å; G255-L257 PolarHBondContact O-N 3.09Å; G255-L257 VanDerWaalsContact O-N 3.14Å; L257-Q259 VanDerWaalsContact C-N 3.35Å; L257-R260 PolarHBondContact O-N 2.88Å; L257-L261 HydrophobicContact CD1-CD1 4.29Å; L257-L261 HydrophobicContact CG-CD1 4.26Å; L257-L261 WeakPolarHBondContact O-CG 3.5Å; L257-L261 PolarHBondContact O-N 2.82Å; L257-L261 VanDerWaalsContact O-N 3.09Å; L257-E312 HydrophobicContact CB-CG 4.44Å; L257-E312 PolarHBondContact N-OE1 3.41Å; L257-I315 HydrophobicContact CD2-CG2 4.21Å; L257-K316 HydrophobicContact CD2-CB 3.88Å; L257-K316 HydrophobicContact CD2-CG 4.28Å; L257-L319 HydrophobicContact CD1-CD1 4.43Å; L257-L319 HydrophobicContact CD2-CD1 4.49Å
258T82.2Confident70.2Confident9 Ų983.8 Ų83.86%0.05546%0.464CS..Hα-helixtrans-69.3-37-178.2-55.50000110.7F254 G255 L261 L262 I315F254-T258 HydrophobicContact CB-CG2 3.88Å; F254-T258 HydrophobicContact CD1-CG2 3.87Å; F254-T258 HydrophobicContact CG-CG2 3.95Å; G255-T258 PolarHBondContact O-N 2.95Å; T258-L261 PolarHBondContact O-N 3.3Å; T258-L262 HydrophobicContact CG2-CD1 4.06Å; T258-L262 WeakPolarHBondContact O-CB 3.47Å; T258-L262 WeakPolarHBondContact O-CD1 3.35Å; T258-L262 WeakPolarHBondContact O-CG 3.4Å; T258-L262 PolarHBondContact O-N 2.81Å; T258-I315 HydrophobicContact CG2-CD1 4Å
259Q81.5Confident71Confident80 Ų8084.7 Ų84.737%0.37446%0.462SS..Hα-helixtrans-62-45.7173.8-68.3-176900112.2F254 G255 L257 L261 L262 Q263F254-Q259 HydrophobicContact CB-CG 4.07Å; F254-Q259 WeakPolarHBondContact O-CG 3.27Å; F254-Q259 PolarHBondContact O-NE2 2.87Å; G255-Q259 WeakPolarHBondContact O-CG 3.44Å; G255-Q259 PolarHBondContact O-N 3.47Å; L257-Q259 VanDerWaalsContact C-N 3.35Å; Q259-L261 VanDerWaalsContact C-N 3.33Å; Q259-L261 PolarHBondContact O-N 2.84Å; Q259-L262 PolarHBondContact O-N 2.97Å; Q259-Q263 WeakPolarHBondContact O-CB 3.37Å; Q259-Q263 PolarHBondContact O-N 3.19Å
260R79.4Confident71.9Confident188 Ų18881.9 Ų81.971%0.70945%0.446SS*.Hα-helixtrans-62.6-40.3177.9-173.1178.2-68.8149.2-1112.1P256 L257 Q263 A264P256-R260 WeakPolarHBondContact O-CB 3.36Å; P256-R260 PolarHBondContact O-N 3.14Å; L257-R260 PolarHBondContact O-N 2.88Å; R260-Q263 PolarHBondContact O-N 2.7Å; R260-A264 PolarHBondContact O-N 3.3Å
261L81.6Confident72.4Confident69 Ų6978.6 Ų78.636%0.36143%0.427SS..Hα-helixtrans-64.1-45.1175.3-70.2168.6000111.6L257 T258 Q259 Q263 A264 L265 I315 L319L257-L261 HydrophobicContact CD1-CD1 4.29Å; L257-L261 HydrophobicContact CG-CD1 4.26Å; L257-L261 WeakPolarHBondContact O-CG 3.5Å; L257-L261 PolarHBondContact O-N 2.82Å; L257-L261 VanDerWaalsContact O-N 3.09Å; T258-L261 PolarHBondContact O-N 3.3Å; Q259-L261 VanDerWaalsContact C-N 3.33Å; Q259-L261 PolarHBondContact O-N 2.84Å; L261-Q263 VanDerWaalsContact C-N 3.34Å; L261-Q263 PolarHBondContact O-N 3.04Å; L261-A264 PolarHBondContact O-N 3.28Å; L261-L265 VanDerWaalsContact O-CG 3.3Å; L261-L265 WeakPolarHBondContact O-CG 3.45Å; L261-L265 PolarHBondContact O-N 3.4Å; L261-L265 VanDerWaalsContact O-N 3.1Å; L261-I315 HydrophobicContact CD1-CG2 3.63Å; L261-L319 HydrophobicContact CD1-CD1 4.18Å
262L78Confident72.2Confident65 Ų6579.2 Ų79.234%0.3442%0.42SS..Hα-helixtrans-60.4-44.1175.3-78.6161.1000111.6F254 T258 Q259 L265 V266F254-L262 HydrophobicContact CD2-CD1 3.69Å; F254-L262 HydrophobicContact CE2-CD1 4Å; F254-L262 HydrophobicContact CG-CD1 4.19Å; T258-L262 HydrophobicContact CG2-CD1 4.06Å; T258-L262 WeakPolarHBondContact O-CB 3.47Å; T258-L262 WeakPolarHBondContact O-CD1 3.35Å; T258-L262 WeakPolarHBondContact O-CG 3.4Å; T258-L262 PolarHBondContact O-N 2.81Å; Q259-L262 PolarHBondContact O-N 2.97Å; L262-L265 PolarHBondContact O-N 3.43Å; L262-V266 WeakPolarHBondContact O-CG2 3.46Å; L262-V266 PolarHBondContact O-N 3.12Å
263Q78.2Confident71.8Confident102 Ų10280.4 Ų80.448%0.47743%0.426SS..Hα-helixtrans-60.6-46.3177.8-176.662.825.400111.7Q259 R260 L261 L265 V266 E267Q259-Q263 WeakPolarHBondContact O-CB 3.37Å; Q259-Q263 PolarHBondContact O-N 3.19Å; R260-Q263 PolarHBondContact O-N 2.7Å; L261-Q263 VanDerWaalsContact C-N 3.34Å; L261-Q263 PolarHBondContact O-N 3.04Å; Q263-L265 VanDerWaalsContact C-N 3.28Å; Q263-L265 PolarHBondContact O-N 2.94Å; Q263-V266 PolarHBondContact O-N 3.06Å; Q263-V266 VanDerWaalsContact O-N 3.14Å; Q263-E267 WeakPolarHBondContact CG-OE1 3.44Å; Q263-E267 PolarHBondContact NE2-OE1 3.49Å; Q263-E267 WeakPolarHBondContact O-CG 3.37Å; Q263-E267 PolarHBondContact O-N 2.91Å
264A76.5Confident71Confident46 Ų4686.5 Ų86.538%0.3845%0.453SS..Hα-helixtrans-60.3-38.2176.600000112.2R260 L261 V266 E267 E268R260-A264 PolarHBondContact O-N 3.3Å; L261-A264 PolarHBondContact O-N 3.28Å; A264-V266 VanDerWaalsContact C-N 3.33Å; A264-V266 PolarHBondContact O-N 2.85Å; A264-E267 PolarHBondContact O-N 3.49Å; A264-E268 WeakPolarHBondContact O-CB 3.36Å; A264-E268 VanDerWaalsContact O-CG 3.3Å; A264-E268 WeakPolarHBondContact O-CG 3.41Å; A264-E268 PolarHBondContact O-N 3.04Å
265L77.3Confident69.5Low66 Ų6692.1 Ų92.135%0.34648%0.48SS..Hα-helixtrans-68.4-31.9176.9-67.9170.7000113.1L261 L262 Q263 I270 I271L261-L265 VanDerWaalsContact O-CG 3.3Å; L261-L265 WeakPolarHBondContact O-CG 3.45Å; L261-L265 PolarHBondContact O-N 3.4Å; L261-L265 VanDerWaalsContact O-N 3.1Å; L262-L265 PolarHBondContact O-N 3.43Å; Q263-L265 VanDerWaalsContact C-N 3.28Å; Q263-L265 PolarHBondContact O-N 2.94Å; L265-I270 HydrophobicContact CD2-CB 4.35Å; L265-I270 HydrophobicContact CD2-CD1 4.04Å; L265-I270 HydrophobicContact CD2-CG2 4.32Å; L265-I270 PolarHBondContact O-N 3.48Å; L265-I271 HydrophobicContact CB-CD1 3.91Å; L265-I271 HydrophobicContact CB-CG1 4.28Å; L265-I271 HydrophobicContact CD1-CD1 4.02Å; L265-I271 PolarHBondContact O-N 2.83Å
266V73.8Confident68.1Low50 Ų5099.6 Ų99.630%0.30352%0.516SS..Hα-helixtrans-73.1-44174173.30000110.7L262 Q263 A264 E268 N269 P273L262-V266 WeakPolarHBondContact O-CG2 3.46Å; L262-V266 PolarHBondContact O-N 3.12Å; Q263-V266 PolarHBondContact O-N 3.06Å; Q263-V266 VanDerWaalsContact O-N 3.14Å; A264-V266 VanDerWaalsContact C-N 3.33Å; A264-V266 PolarHBondContact O-N 2.85Å; V266-E268 VanDerWaalsContact C-N 3.3Å; V266-E268 PolarHBondContact O-N 2.98Å; V266-N269 PolarHBondContact O-N 3.37Å; V266-N269 VanDerWaalsContact O-N 3.09Å; V266-P273 HydrophobicContact CG1-CG 4.18Å
267E68.9Low66Low134 Ų13499.5 Ų99.563%0.62652%0.518SS*.Hα-helixtrans-61.8-37.3177.7-74.5174.3-169.900112.3Q263 A264 N269Q263-E267 WeakPolarHBondContact CG-OE1 3.44Å; Q263-E267 PolarHBondContact NE2-OE1 3.49Å; Q263-E267 WeakPolarHBondContact O-CG 3.37Å; Q263-E267 PolarHBondContact O-N 2.91Å; A264-E267 PolarHBondContact O-N 3.49Å; E267-N269 PolarHBondContact O-N 2.93Å
268E66.1Low64.2Low145 Ų145103.2 Ų103.268%0.67855%0.545SS*.THydrogen-bonded Turntrans-80.99176.6-66.8-68.814600113.5A264 V266 I270A264-E268 WeakPolarHBondContact O-CB 3.36Å; A264-E268 VanDerWaalsContact O-CG 3.3Å; A264-E268 WeakPolarHBondContact O-CG 3.41Å; A264-E268 PolarHBondContact O-N 3.04Å; V266-E268 VanDerWaalsContact C-N 3.3Å; V266-E268 PolarHBondContact O-N 2.98Å; E268-I270 HydrophobicContact CB-CD1 3.96Å; E268-I270 HydrophobicContact CB-CG1 3.88Å; E268-I270 PolarHBondContact O-N 3.18Å
269N62.5Low62.2Low132 Ų132110.3 Ų110.371%0.70658%0.581SS**THydrogen-bonded Turntrans55.520.1-178.1-94.4-43.2000114.8V266 E267 I271V266-N269 PolarHBondContact O-N 3.37Å; V266-N269 VanDerWaalsContact O-N 3.09Å; E267-N269 PolarHBondContact O-N 2.93Å; N269-I271 VanDerWaalsContact C-N 3.3Å
270I65.6Low60Low117 Ų117111.4 Ų111.460%0.660%0.595SS**SBendtrans-75.2-27.4-179.4-58.2-177.1000110.5L265 E268L265-I270 HydrophobicContact CD2-CB 4.35Å; L265-I270 HydrophobicContact CD2-CD1 4.04Å; L265-I270 HydrophobicContact CD2-CG2 4.32Å; L265-I270 PolarHBondContact O-N 3.48Å; E268-I270 HydrophobicContact CB-CD1 3.96Å; E268-I270 HydrophobicContact CB-CG1 3.88Å; E268-I270 PolarHBondContact O-N 3.18Å
271I59.5Low58.1Low68 Ų68110.6 Ų110.635%0.34960%0.604SS.*SBendtrans-127.1120.2172.9-49.3173.1000106.8L265 N269L265-I271 HydrophobicContact CB-CD1 3.91Å; L265-I271 HydrophobicContact CB-CG1 4.28Å; L265-I271 HydrophobicContact CD1-CD1 4.02Å; L265-I271 PolarHBondContact O-N 2.83Å; N269-I271 VanDerWaalsContact C-N 3.3Å
272S52.5Low56Low92 Ų92114.8 Ų114.864%0.64363%0.626SS**  trans-62.2134.5172-580000109M274S272-M274 PolarHBondContact O-N 2.63Å
273P50.8Low54.1Low81 Ų81117.7 Ų117.753%0.52665%0.651SS.*  trans-52.1129.8167.6-17.427.6000107.2V266 E275V266-P273 HydrophobicContact CG1-CG 4.18Å; P273-E275 VanDerWaalsContact C-N 3.28Å; P273-E275 PolarHBondContact O-N 3.3Å
274M51.8Low52Low180 Ų180116.4 Ų116.489%0.88767%0.665SS**  trans-60.799.3172-71.698.8170.900107.5S272 D276S272-M274 PolarHBondContact O-N 2.63Å; M274-D276 PolarHBondContact O-N 3.27Å
275E42.8Very low50.1Low167 Ų167123 Ų12378%0.7869%0.685SS**  trans-64.1122.3171.9-71.4-164.3141.800107.9P273 S277P273-E275 VanDerWaalsContact C-N 3.28Å; P273-E275 PolarHBondContact O-N 3.3Å; E275-S277 PolarHBondContact O-N 2.91Å
276D46.1Very low48Very low169 Ų169126.5 Ų126.590%0.90470%0.704SS**  trans-65.679.5169.1-15111.4000107.6M274 P278M274-D276 PolarHBondContact O-N 3.27Å; D276-P278 WeakPolarHBondContact O-CD 3.47Å
277S32.7Very low46Very low88 Ų88128.1 Ų128.162%0.61573%0.731SS**PPolyproline II helixtrans-78.9122.1-178.8-84.50000110.1E275 I279E275-S277 PolarHBondContact O-N 2.91Å; S277-I279 PolarHBondContact O-N 2.85Å
278P41Very low44.2Very low120 Ų120125.3 Ų125.378%0.77974%0.739SS**PPolyproline II helixtrans-67.7125.9171.827.7-31.5000109.5D276D276-P278 WeakPolarHBondContact O-CD 3.47Å
279I40.8Very low42.6Very low158 Ų158125.5 Ų125.581%0.8174%0.744SS**PPolyproline II helixtrans-58.5130.6177.5-57.7169000109.2S277S277-I279 PolarHBondContact O-N 2.85Å
280P35Very low41.4Very low103 Ų103127.5 Ų127.567%0.66975%0.749SS**PPolyproline II helixtrans-75.3130.3169.55.98.2000110.1I282P280-I282 PolarHBondContact O-N 3.36Å
281D38.9Very low39.7Very low170 Ų170125.6 Ų125.691%0.90976%0.758SS**PPolyproline II helixtrans-58.5120170.4-79.8-49.7000111.2
282I37.8Very low38.9Very low158 Ų158127.9 Ų127.981%0.8179%0.787SS**  trans-122.198.4167.7-26.7176.5000109.2P280 G284P280-I282 PolarHBondContact O-N 3.36Å; I282-G284 PolarHBondContact O-N 2.98Å
283S37.8Very low38Very low125 Ų125126.7 Ų126.787%0.87479%0.789SS**  trans-65.4119.2161.6147.40000109.4
284G33.9Very low37.3Very low75 Ų75130 Ų13077%0.77381%0.808SS**  trans-167.1109.1175.300000112.7I282I282-G284 PolarHBondContact O-N 2.98Å
285K36.7Very low36.4Very low184 Ų184126.5 Ų126.580%0.880%0.802SS**  trans-84.7152.3-169.6164.8176172.6177.70113.8
286D33.8Very low36.2Very low140 Ų140124.4 Ų124.475%0.74980%0.803SS**  trans76.2116.1158.9-69.3-20.4000121.6
287G31.6Very low35.8Very low84 Ų84127.1 Ų127.187%0.86680%0.8SS**  101.5102.7114.600000119.6
288G30.9Very low36.3Very low76 Ų76128.2 Ų128.278%0.78481%0.808SS**  trans103.999.2136.500000119.5
289N31.9Very low36.1Very low148 Ų148129.6 Ų129.679%0.79180%0.804SS**  trans69126.7133-144.141.6000122.1
290E36.6Very low36.2Very low175 Ų175126.7 Ų126.782%0.81881%0.813SS**  trans72112.3155.2-56.3-100.9144.500119.1
291G30.5Very low36.4Very low76 Ų76129.4 Ų129.478%0.78481%0.814SS**  trans163.1115.4162.400000113.3G293G291-G293 PolarHBondContact O-N 3.3Å
292A43.1Very low36.5Very low116 Ų116125.6 Ų125.696%0.95981%0.806SS**  trans-52131.2-178.500000113.7
293G32.6Very low36.9Very low67 Ų67127.2 Ų127.269%0.69181%0.808SS**  trans-162.699.5171.100000109.5G291 S295G291-G293 PolarHBondContact O-N 3.3Å; G293-S295 PolarHBondContact O-N 3.49Å
294T38Very low37.6Very low151 Ų151125.9 Ų125.993%0.92680%0.799SS**  trans-68.586.4168.552.50000108.3
295S32Very low38.8Very low106 Ų106124.8 Ų124.874%0.74178%0.776SS**  trans-95119.8167.4-174.50000108.5G293 R297G293-S295 PolarHBondContact O-N 3.49Å; S295-R297 PolarHBondContact O-N 2.7Å; S295-R297 VanDerWaalsContact O-N 3.15Å
296P39.4Very low39.8Very low124 Ų124120.5 Ų120.581%0.80577%0.767SS**  trans-75.4108.4175.1-0.216.6000109.3S298P296-S298 PolarHBondContact O-N 2.97Å
297R36.7Very low41.3Very low225 Ų225120.9 Ų120.985%0.84977%0.765SS**  trans-33.4128.2159.8-171.8173.8-175165.50.8113S295 Q299S295-R297 PolarHBondContact O-N 2.7Å; S295-R297 VanDerWaalsContact O-N 3.15Å; R297-Q299 PolarHBondContact O-N 3.38Å
298S42.3Very low43Very low112 Ų112118.1 Ų118.178%0.78373%0.731SS**  trans-30.2119.3164.439.20000115.5P296P296-S298 PolarHBondContact O-N 2.97Å
299Q37.5Very low44.7Very low149 Ų149124.3 Ų124.370%0.69673%0.73SS**  trans-140.6120.8153.2-70.9-166-700108.5R297 K301R297-Q299 PolarHBondContact O-N 3.38Å; Q299-K301 PolarHBondContact O-N 3.46Å
300G43.6Very low46.8Very low96 Ų96120 Ų12099%0.9971%0.712SS**  trans-67.379.9168.200000111.1
301K39Very low48.8Very low161 Ų161114.9 Ų114.970%0.769%0.69SS**  trans-124.3131.8166.8-78.2178.6176.4171.70107.2Q299 F303Q299-K301 PolarHBondContact O-N 3.46Å; K301-F303 PolarHBondContact O-N 2.81Å
302A41.7Very low51.2Low90 Ų90113.6 Ų113.674%0.74466%0.663SS**  trans-46.6139.616900000109.3S304A302-S304 PolarHBondContact O-N 3.45Å
303F45.7Very low53Low192 Ų192110.8 Ų110.884%0.84264%0.64SS**  trans-6282.8179.2-142.5-92.3000108.9K301 V305K301-F303 PolarHBondContact O-N 2.81Å; F303-V305 HydrophobicContact CD1-CG2 4.28Å; F303-V305 PolarHBondContact O-N 2.89Å
304S51.5Low55.5Low97 Ų97115.7 Ų115.768%0.67864%0.638SS**  trans-86.898.9-179.5179.20000107.5A302 P306A302-S304 PolarHBondContact O-N 3.45Å; S304-P306 VanDerWaalsContact O-CD 3.3Å; S304-P306 WeakPolarHBondContact O-CD 3.32Å
305V58.9Low57.6Low51 Ų51110.4 Ų110.431%0.30960%0.604SS.*  trans-71.7116.4168.3-179.20000107F254 F303 T308F254-V305 HydrophobicContact CE1-CB 4.44Å; F254-V305 HydrophobicContact CE1-CG2 4.34Å; F254-V305 HydrophobicContact CZ-CG2 4.06Å; F303-V305 HydrophobicContact CD1-CG2 4.28Å; F303-V305 PolarHBondContact O-N 2.89Å; V305-T308 HydrophobicContact CB-CG2 4.04Å; V305-T308 WeakPolarHBondContact O-CG2 3.3Å
306P59.5Low60Low94 Ų94110.6 Ų110.661%0.6159%0.591SS**THydrogen-bonded Turntrans-65142.4176.827-33.4000109.7S304S304-P306 VanDerWaalsContact O-CD 3.3Å; S304-P306 WeakPolarHBondContact O-CD 3.32Å
307H63.3Low62.2Low149 Ų149110.9 Ų110.969%0.6958%0.581SS**THydrogen-bonded Turntrans72.630.7179.8-46.683000116.6R309 S310 L311H307-R309 PolarHBondContact O-N 3.29Å; H307-S310 WeakPolarHBondContact O-CA 3.15Å; H307-S310 WeakPolarHBondContact O-CB 3.24Å; H307-S310 PolarHBondContact O-N 3.48Å; H307-L311 PolarHBondContact O-N 2.89Å
308T68.4Low64.5Low26 Ų26104.9 Ų104.916%0.1656%0.563CS.*Hα-helixtrans-55-35176.456.30000114.6P253 F254 V305 S310 L311 E312P253-T308 HydrophobicContact CB-CG2 3.91Å; P253-T308 HydrophobicContact CG-CG2 4.47Å; P253-T308 WeakPolarHBondContact O-CB 3.34Å; P253-T308 WeakPolarHBondContact O-CG2 3.48Å; P253-T308 PolarHBondContact O-OG1 3.39Å; F254-T308 HydrophobicContact CD1-CG2 3.98Å; F254-T308 HydrophobicContact CE1-CG2 4.11Å; V305-T308 HydrophobicContact CB-CG2 4.04Å; V305-T308 WeakPolarHBondContact O-CG2 3.3Å; T308-S310 VanDerWaalsContact C-N 3.35Å; T308-S310 PolarHBondContact O-N 2.83Å; T308-L311 WeakPolarHBondContact O-CB 3.4Å; T308-L311 PolarHBondContact O-N 3.09Å; T308-E312 PolarHBondContact O-N 3.12Å
309R65.5Low66.5Low205 Ų205101.2 Ų101.277%0.77453%0.534SS*.Hα-helixtrans-65.2-35.7172.4-63.4-171.2-164.5-138.62.5112.9H307 A313H307-R309 PolarHBondContact O-N 3.29Å; R309-A313 WeakPolarHBondContact O-CB 3.42Å; R309-A313 PolarHBondContact O-N 3.38Å; R309-A313 VanDerWaalsContact O-N 3.09Å
310S76.4Confident68.6Low57 Ų5796.4 Ų96.440%0.39951%0.513SS..Hα-helixtrans-74.1-33.2175.9-172.60000111.7H307 T308 R314H307-S310 WeakPolarHBondContact O-CA 3.15Å; H307-S310 WeakPolarHBondContact O-CB 3.24Å; H307-S310 PolarHBondContact O-N 3.48Å; T308-S310 VanDerWaalsContact C-N 3.35Å; T308-S310 PolarHBondContact O-N 2.83Å; S310-R314 WeakPolarHBondContact O-CB 3.21Å; S310-R314 PolarHBondContact O-N 3.08Å
311L79.6Confident70.5Confident68 Ų6895.9 Ų95.936%0.35649%0.494SS..Hα-helixtrans-63.8-47.8173.1177.365.7000110.3F254 H307 T308 A313 R314 I315F254-L311 HydrophobicContact CD1-CD2 4.12Å; F254-L311 HydrophobicContact CE1-CD2 3.89Å; H307-L311 PolarHBondContact O-N 2.89Å; T308-L311 WeakPolarHBondContact O-CB 3.4Å; T308-L311 PolarHBondContact O-N 3.09Å; L311-A313 PolarHBondContact O-N 2.87Å; L311-R314 PolarHBondContact O-N 3.13Å; L311-I315 HydrophobicContact CD1-CD1 4.01Å; L311-I315 HydrophobicContact CD1-CG1 4.29Å; L311-I315 HydrophobicContact CG-CD1 3.83Å; L311-I315 HydrophobicContact CG-CG1 4.49Å; L311-I315 VanDerWaalsContact O-CG1 3.3Å; L311-I315 WeakPolarHBondContact O-CG1 3.3Å; L311-I315 PolarHBondContact O-N 2.94Å
312E81.3Confident72.6Confident49 Ų4993.7 Ų93.723%0.22949%0.486CS..Hα-helixtrans-59.5-44.6176.8-177.8173.1-14300112.1G255 P256 L257 T308 R314 I315 K316G255-E312 WeakPolarHBondContact CA-OE1 3.3Å; G255-E312 WeakPolarHBondContact CA-OE2 3.39Å; P256-E312 WeakPolarHBondContact CD-OE1 3.37Å; L257-E312 HydrophobicContact CB-CG 4.44Å; L257-E312 PolarHBondContact N-OE1 3.41Å; T308-E312 PolarHBondContact O-N 3.12Å; E312-R314 VanDerWaalsContact C-N 3.34Å; E312-R314 PolarHBondContact O-N 3.19Å; E312-I315 PolarHBondContact O-N 3.36Å; E312-K316 WeakPolarHBondContact O-CB 3.07Å; E312-K316 PolarHBondContact O-N 3.26Å
313A81.2Confident74.3Confident57 Ų5792.2 Ų92.247%0.47148%0.48SS..Hα-helixtrans-60.8-42.2175.700000112.3R309 L311 K316 E317R309-A313 WeakPolarHBondContact O-CB 3.42Å; R309-A313 PolarHBondContact O-N 3.38Å; R309-A313 VanDerWaalsContact O-N 3.09Å; L311-A313 PolarHBondContact O-N 2.87Å; A313-K316 PolarHBondContact O-N 3.47Å; A313-E317 WeakPolarHBondContact O-CB 3.28Å; A313-E317 PolarHBondContact O-N 3.4Å
314R83.7Confident75.9Confident171 Ų17188.7 Ų88.765%0.64547%0.469SS*.Hα-helixtrans-71.3-37.9-179.7-166.7179-73.3169.3-3112.4S310 L311 E312 K316 E317 E318S310-R314 WeakPolarHBondContact O-CB 3.21Å; S310-R314 PolarHBondContact O-N 3.08Å; L311-R314 PolarHBondContact O-N 3.13Å; E312-R314 VanDerWaalsContact C-N 3.34Å; E312-R314 PolarHBondContact O-N 3.19Å; R314-K316 VanDerWaalsContact C-N 3.33Å; R314-E317 PolarHBondContact O-N 2.78Å; R314-E318 WeakPolarHBondContact O-CB 3.23Å; R314-E318 PolarHBondContact O-N 2.76Å
315I83.4Confident77Confident40 Ų4087.1 Ų87.121%0.20545%0.453CS..Hα-helixtrans-61.6-45.2172.4-71.1167.6000109.7L257 T258 L261 L311 E312 E318 L319L257-I315 HydrophobicContact CD2-CG2 4.21Å; T258-I315 HydrophobicContact CG2-CD1 4Å; L261-I315 HydrophobicContact CD1-CG2 3.63Å; L311-I315 HydrophobicContact CD1-CD1 4.01Å; L311-I315 HydrophobicContact CD1-CG1 4.29Å; L311-I315 HydrophobicContact CG-CD1 3.83Å; L311-I315 HydrophobicContact CG-CG1 4.49Å; L311-I315 VanDerWaalsContact O-CG1 3.3Å; L311-I315 WeakPolarHBondContact O-CG1 3.3Å; L311-I315 PolarHBondContact O-N 2.94Å; E312-I315 PolarHBondContact O-N 3.36Å; I315-E318 PolarHBondContact O-N 2.85Å; I315-L319 HydrophobicContact CG2-CD1 3.86Å; I315-L319 HydrophobicContact CG2-CG 4.34Å; I315-L319 WeakPolarHBondContact O-CB 3.5Å; I315-L319 VanDerWaalsContact O-CG 3.26Å; I315-L319 WeakPolarHBondContact O-CG 3.31Å; I315-L319 PolarHBondContact O-N 2.79Å
316K81.8Confident77.8Confident109 Ų10991.7 Ų91.747%0.47448%0.476SS..Hα-helixtrans-60.9-46.8176.9-168.4-178.7179178.20111.5L257 E312 A313 R314 E318 L319 M320 L325L257-K316 HydrophobicContact CD2-CB 3.88Å; L257-K316 HydrophobicContact CD2-CG 4.28Å; E312-K316 WeakPolarHBondContact O-CB 3.07Å; E312-K316 PolarHBondContact O-N 3.26Å; A313-K316 PolarHBondContact O-N 3.47Å; R314-K316 VanDerWaalsContact C-N 3.33Å; K316-E318 PolarHBondContact O-N 3.03Å; K316-L319 PolarHBondContact O-N 3.11Å; K316-M320 HydrophobicContact CG-CE 4.1Å; K316-M320 HydrophobicContact CG-SD 4.37Å; K316-M320 VanDerWaalsContact O-CG 3.26Å; K316-M320 WeakPolarHBondContact O-CG 3.37Å; K316-M320 PolarHBondContact O-N 3.47Å; K316-L325 HydrophobicContact CG-CD1 4.37Å
317E84.4Confident78Confident130 Ų13091.6 Ų91.661%0.60748%0.477SS*.Hα-helixtrans-60.6-42.6178-171.6176.3-166.800112.6A313 R314 M320 S321A313-E317 WeakPolarHBondContact O-CB 3.28Å; A313-E317 PolarHBondContact O-N 3.4Å; R314-E317 PolarHBondContact O-N 2.78Å; E317-M320 HydrophobicContact CB-CE 4.41Å; E317-M320 PolarHBondContact O-N 2.82Å; E317-S321 WeakPolarHBondContact O-CB 3.45Å; E317-S321 PolarHBondContact O-N 3.05Å
318E84.8Confident77.4Confident100 Ų10090.3 Ų90.347%0.46747%0.471SS..Hα-helixtrans-68.6-40.2177.2-172.262.6-151.600112.3R314 I315 K316 M320 S321 Q322R314-E318 WeakPolarHBondContact O-CB 3.23Å; R314-E318 PolarHBondContact O-N 2.76Å; I315-E318 PolarHBondContact O-N 2.85Å; K316-E318 PolarHBondContact O-N 3.03Å; E318-M320 VanDerWaalsContact C-N 3.27Å; E318-M320 PolarHBondContact O-N 2.96Å; E318-S321 WeakPolarHBondContact CA-OG 3.21Å; E318-S321 PolarHBondContact O-N 3.42Å; E318-S321 PolarHBondContact O-OG 2.89Å; E318-Q322 WeakPolarHBondContact O-CB 3.44Å; E318-Q322 WeakPolarHBondContact O-CG 3.48Å; E318-Q322 PolarHBondContact O-N 3Å; E318-Q322 PolarHBondContact OE1-NE2 3.02Å
319L85.3Confident76.4Confident34 Ų3498 Ų9818%0.17851%0.505CS..Hα-helixtrans-66-33.2174.8-71.2175.2000111.8L257 L261 I315 K316 G323 L324 L325L257-L319 HydrophobicContact CD1-CD1 4.43Å; L257-L319 HydrophobicContact CD2-CD1 4.49Å; L261-L319 HydrophobicContact CD1-CD1 4.18Å; I315-L319 HydrophobicContact CG2-CD1 3.86Å; I315-L319 HydrophobicContact CG2-CG 4.34Å; I315-L319 WeakPolarHBondContact O-CB 3.5Å; I315-L319 VanDerWaalsContact O-CG 3.26Å; I315-L319 WeakPolarHBondContact O-CG 3.31Å; I315-L319 PolarHBondContact O-N 2.79Å; K316-L319 PolarHBondContact O-N 3.11Å; L319-G323 PolarHBondContact O-N 3.35Å; L319-L324 HydrophobicContact CD2-CB 4.3Å; L319-L324 HydrophobicContact CD2-CD1 3.75Å; L319-L324 WeakPolarHBondContact O-CA 3.29Å; L319-L324 WeakPolarHBondContact O-CB 3.49Å; L319-L324 PolarHBondContact O-N 3.08Å; L319-L325 HydrophobicContact CB-CB 4.38Å; L319-L325 HydrophobicContact CB-CD1 3.58Å; L319-L325 HydrophobicContact CB-CG 3.87Å; L319-L325 HydrophobicContact CD1-CD1 3.84Å; L319-L325 HydrophobicContact CD1-CG 4.5Å; L319-L325 HydrophobicContact CG-CD1 4.38Å; L319-L325 PolarHBondContact O-N 3.11Å; L319-L325 VanDerWaalsContact O-N 3.1Å
320M82.3Confident75.1Confident48 Ų4897 Ų9724%0.23650%0.502CS..Hα-helixtrans-69.9-41.8171.6-69.3-179-56.300111.9K316 E317 E318 Q322 G323 L325K316-M320 HydrophobicContact CG-CE 4.1Å; K316-M320 HydrophobicContact CG-SD 4.37Å; K316-M320 VanDerWaalsContact O-CG 3.26Å; K316-M320 WeakPolarHBondContact O-CG 3.37Å; K316-M320 PolarHBondContact O-N 3.47Å; E317-M320 HydrophobicContact CB-CE 4.41Å; E317-M320 PolarHBondContact O-N 2.82Å; E318-M320 VanDerWaalsContact C-N 3.27Å; E318-M320 PolarHBondContact O-N 2.96Å; M320-Q322 VanDerWaalsContact C-N 3.29Å; M320-Q322 PolarHBondContact O-N 3.1Å; M320-G323 PolarHBondContact O-N 2.81Å; M320-L325 WeakPolarHBondContact CA-O 3.49Å; M320-L325 HydrophobicContact CG-CB 3.78Å
321S82.8Confident73.7Confident85 Ų85101 Ų10159%0.59453%0.526SS*.Hα-helixtrans-65.1-33.3179.278.30000112.5E317 E318 G323E317-S321 WeakPolarHBondContact O-CB 3.45Å; E317-S321 PolarHBondContact O-N 3.05Å; E318-S321 WeakPolarHBondContact CA-OG 3.21Å; E318-S321 PolarHBondContact O-N 3.42Å; E318-S321 PolarHBondContact O-OG 2.89Å; S321-G323 PolarHBondContact O-N 2.87Å
322Q84.2Confident71.7Confident115 Ų11599.8 Ų99.854%0.53753%0.53SS..THydrogen-bonded Turntrans-79.9-1174.5-66.1-175.43000113.3E318 M320 L324E318-Q322 WeakPolarHBondContact O-CB 3.44Å; E318-Q322 WeakPolarHBondContact O-CG 3.48Å; E318-Q322 PolarHBondContact O-N 3Å; E318-Q322 PolarHBondContact OE1-NE2 3.02Å; M320-Q322 VanDerWaalsContact C-N 3.29Å; M320-Q322 PolarHBondContact O-N 3.1Å; Q322-L324 HydrophobicContact CB-CD1 4.2Å; Q322-L324 HydrophobicContact CB-CG 4.21Å; Q322-L324 PolarHBondContact O-N 2.6Å
323G75.6Confident69.9Low59 Ų59103 Ų10361%0.60857%0.565SS**THydrogen-bonded Turntrans69.220.1-179.400000113.9L319 M320 S321L319-G323 PolarHBondContact O-N 3.35Å; M320-G323 PolarHBondContact O-N 2.81Å; S321-G323 PolarHBondContact O-N 2.87Å
324L79.1Confident68.2Low118 Ų118103.9 Ų103.962%0.61858%0.579SS**SBendtrans-87.2-21.4176.1-63.6172.5000112L319 Q322L319-L324 HydrophobicContact CD2-CB 4.3Å; L319-L324 HydrophobicContact CD2-CD1 3.75Å; L319-L324 WeakPolarHBondContact O-CA 3.29Å; L319-L324 WeakPolarHBondContact O-CB 3.49Å; L319-L324 PolarHBondContact O-N 3.08Å; Q322-L324 HydrophobicContact CB-CD1 4.2Å; Q322-L324 HydrophobicContact CB-CG 4.21Å; Q322-L324 PolarHBondContact O-N 2.6Å
325L74.9Confident66.1Low64 Ų6499 Ų9934%0.33558%0.582SS.*SBendtrans-127.7137.4171.8-68.2176.9000109.6K316 L319 M320K316-L325 HydrophobicContact CG-CD1 4.37Å; L319-L325 HydrophobicContact CB-CB 4.38Å; L319-L325 HydrophobicContact CB-CD1 3.58Å; L319-L325 HydrophobicContact CB-CG 3.87Å; L319-L325 HydrophobicContact CD1-CD1 3.84Å; L319-L325 HydrophobicContact CD1-CG 4.5Å; L319-L325 HydrophobicContact CG-CD1 4.38Å; L319-L325 PolarHBondContact O-N 3.11Å; L319-L325 VanDerWaalsContact O-N 3.1Å; M320-L325 WeakPolarHBondContact CA-O 3.49Å; M320-L325 HydrophobicContact CG-CB 3.78Å
326D77.4Confident64.1Low148 Ų148104.8 Ų104.879%0.79161%0.614SS**  trans-73.7140.2173.9-71.1-40.2000110.8E328D326-E328 PolarHBondContact O-N 3.14Å
327S62.7Low62.6Low91 Ų91104.3 Ų104.364%0.63662%0.624SS**SBendtrans-67.5-5.3-171.4-66.60000115.3
328E50.8Low61.1Low122 Ų122105.4 Ų105.457%0.5763%0.629SS**  trans-150.280.5-176.3-83.1-87.791.700110.1D326 R330D326-E328 PolarHBondContact O-N 3.14Å; E328-R330 HydrophobicContact CB-CG 4.29Å; E328-R330 PolarHBondContact O-N 3.28Å; E328-R330 WeakPolarHBondContact OE2-CD 3.31Å; E328-R330 WeakPolarHBondContact OE2-CG 3.45Å; E328-R330 IonicContact OE2-CZ 2.91Å; E328-R330 IonicContact OE2-NE 2.7Å; E328-R330 PolarHBondContact OE2-NE 3.13Å; E328-R330 IonicContact OE2-NH2 3.49Å; E328-R330 PolarHBondContact OE2-NH2 3.34Å
329E46.7Very low60.5Low187 Ų187103.8 Ų103.887%0.87462%0.624SS**  trans-72.680.2144.7-165.1175.3-151.700105.8P331E329-P331 VanDerWaalsContact O-CD 3.28Å; E329-P331 WeakPolarHBondContact O-CD 3.3Å
330R39.6Very low60.5Low186 Ų186110.1 Ų110.170%0.70265%0.652SS**  trans-57124.2172.9-85.9-175.5-178.8167.65.6107.6E328 G332E328-R330 HydrophobicContact CB-CG 4.29Å; E328-R330 PolarHBondContact O-N 3.28Å; E328-R330 WeakPolarHBondContact OE2-CD 3.31Å; E328-R330 WeakPolarHBondContact OE2-CG 3.45Å; E328-R330 IonicContact OE2-CZ 2.91Å; E328-R330 IonicContact OE2-NE 2.7Å; E328-R330 PolarHBondContact OE2-NE 3.13Å; E328-R330 IonicContact OE2-NH2 3.49Å; E328-R330 PolarHBondContact OE2-NH2 3.34Å; R330-G332 PolarHBondContact O-N 2.88Å
331P45.8Very low60.7Low140 Ų140112.8 Ų112.891%0.90967%0.671SS**  trans-75.268.2160.530.2-25000107.4E329E329-P331 VanDerWaalsContact O-CD 3.28Å; E329-P331 WeakPolarHBondContact O-CD 3.3Å
332G37.7Very low60.9Low43 Ų43111.7 Ų111.744%0.44366%0.658SS.*  trans-112.1115.3174.100000107.9R330 G334R330-G332 PolarHBondContact O-N 2.88Å; G332-G334 PolarHBondContact O-N 3.14Å; G332-G334 VanDerWaalsContact O-N 3.08Å
333A43.6Very low61Low117 Ų117108 Ų10897%0.96765%0.647SS**SBendtrans-50.6115.6165.100000109.2
334G44.9Very low61.8Low74 Ų74107.9 Ų107.976%0.76363%0.631SS**SBendtrans89.282.1-178.700000112.4G332 D336G332-G334 PolarHBondContact O-N 3.14Å; G332-G334 VanDerWaalsContact O-N 3.08Å; G334-D336 PolarHBondContact O-N 3.27Å; G334-D336 VanDerWaalsContact O-N 3.1Å
335G40.5Very low62.3Low69 Ų69105.5 Ų105.571%0.71162%0.618SS**  trans-64.3107.5167.400000109.6S337G335-S337 PolarHBondContact O-N 3.13Å
336D42.2Very low63.1Low162 Ų162107 Ų10787%0.86662%0.623SS**  trans-68.532.1173-153.622.1000112.7G334G334-D336 PolarHBondContact O-N 3.27Å; G334-D336 VanDerWaalsContact O-N 3.1Å
337S49.7Very low63.9Low98 Ų98104.8 Ų104.869%0.68561%0.607SS**SBendtrans-81.8100.3148.2153.30000102.9G335 D339G335-S337 PolarHBondContact O-N 3.13Å; S337-D339 PolarHBondContact O-N 3.46Å
338E52.5Low65.4Low153 Ų153107.1 Ų107.172%0.71560%0.602SS**  trans-39114.2173.2-63.2-172.514400108.1E340 A343E338-E340 PolarHBondContact O-N 3.01Å; E338-A343 HydrophobicContact CB-CB 4.31Å
339D72.7Confident67.4Low67 Ų67102.5 Ų102.536%0.35858%0.58SS.*  trans-48.8108.5176.7166.91.3000105.8S337 V341 L342 A343S337-D339 PolarHBondContact O-N 3.46Å; D339-V341 PolarHBondContact O-N 2.91Å; D339-V341 VanDerWaalsContact OD1-CB 3.27Å; D339-V341 WeakPolarHBondContact OD1-CB 3.34Å; D339-V341 PolarHBondContact OD1-N 2.81Å; D339-V341 VanDerWaalsContact OD1-N 3.11Å; D339-L342 HydrophobicContact CB-CB 3.67Å; D339-L342 CarbonylContact O-C 3.58Å; D339-L342 WeakPolarHBondContact O-CA 3.35Å; D339-L342 WeakPolarHBondContact O-CB 3.32Å; D339-L342 PolarHBondContact O-N 2.8Å; D339-L342 PolarHBondContact OD1-N 2.96Å; D339-A343 PolarHBondContact O-N 3.42Å
340E85.1Confident69.7Low166 Ų16696.3 Ų96.378%0.77656%0.561SS**Hα-helixtrans-55.4-33.5-170.3-175.9-174.7172.800109.6E338 E344E338-E340 PolarHBondContact O-N 3.01Å; E340-E344 VanDerWaalsContact O-CB 3.23Å; E340-E344 WeakPolarHBondContact O-CB 3.18Å; E340-E344 PolarHBondContact O-N 3.43Å
341V85.8Confident72.3Confident105 Ų10591.6 Ų91.664%0.63655%0.547SS*.Hα-helixtrans-67.6-45.3175.1-175.50000110.8D339 L345D339-V341 PolarHBondContact O-N 2.91Å; D339-V341 VanDerWaalsContact OD1-CB 3.27Å; D339-V341 WeakPolarHBondContact OD1-CB 3.34Å; D339-V341 PolarHBondContact OD1-N 2.81Å; D339-V341 VanDerWaalsContact OD1-N 3.11Å; V341-L345 WeakPolarHBondContact O-CB 3.12Å; V341-L345 PolarHBondContact O-N 3.1Å
342L86.7Confident74.6Confident62 Ų6288.2 Ų88.233%0.32552%0.521SS..Hα-helixtrans-64.6-44176.6-176.563.2000112.2I189 D339 L345 H346I189-L342 HydrophobicContact CD1-CD1 3.84Å; I189-L342 HydrophobicContact CG2-CD1 3.88Å; D339-L342 HydrophobicContact CB-CB 3.67Å; D339-L342 CarbonylContact O-C 3.58Å; D339-L342 WeakPolarHBondContact O-CA 3.35Å; D339-L342 WeakPolarHBondContact O-CB 3.32Å; D339-L342 PolarHBondContact O-N 2.8Å; D339-L342 PolarHBondContact OD1-N 2.96Å; L342-L345 PolarHBondContact O-N 2.86Å; L342-H346 PolarHBondContact O-N 2.83Å; L342-H346 PolarHBondContact O-ND1 3.25Å
343A87.9Confident77.3Confident36 Ų3691.4 Ų91.430%0.29852%0.523SS..Hα-helixtrans-62.9-46.4177.400000111.1E338 D339 L345 H346 K347E338-A343 HydrophobicContact CB-CB 4.31Å; D339-A343 PolarHBondContact O-N 3.42Å; A343-L345 VanDerWaalsContact C-N 3.31Å; A343-L345 PolarHBondContact O-N 2.96Å; A343-H346 PolarHBondContact O-N 3.39Å; A343-K347 WeakPolarHBondContact O-CB 3.05Å; A343-K347 PolarHBondContact O-N 2.89Å
344E90.8Very high79.7Confident57 Ų5788.9 Ų88.927%0.26650%0.501SS..Hα-helixtrans-66.7-35.2176.1-165.661.4-15100111E340 K347 R348E340-E344 VanDerWaalsContact O-CB 3.23Å; E340-E344 WeakPolarHBondContact O-CB 3.18Å; E340-E344 PolarHBondContact O-N 3.43Å; E344-K347 WeakPolarHBondContact O-CB 3.35Å; E344-K347 PolarHBondContact O-N 3.02Å; E344-K347 IonicContact OE1-NZ 3.78Å; E344-K347 PolarHBondContact OE1-NZ 3.36Å; E344-K347 IonicContact OE2-NZ 3.8Å; E344-K347 PolarHBondContact OE2-NZ 2.94Å; E344-R348 HydrophobicContact CG-CG 4.47Å; E344-R348 WeakPolarHBondContact O-CB 3.1Å; E344-R348 WeakPolarHBondContact O-CG 3.12Å; E344-R348 PolarHBondContact O-N 2.8Å; E344-R348 IonicContact OE1-CZ 2.7Å; E344-R348 IonicContact OE1-NE 3.5Å; E344-R348 PolarHBondContact OE1-NE 3.4Å; E344-R348 IonicContact OE1-NH1 3.49Å; E344-R348 IonicContact OE1-NH2 2.99Å; E344-R348 PolarHBondContact OE1-NH2 3.39Å
345L90.8Very high82.1Confident68 Ų6890.3 Ų90.336%0.35649%0.491SS..Hα-helixtrans-66-43175.9-168.9142.9000111.9I189 V341 L342 A343 K347 R348 Q349I189-L345 HydrophobicContact CB-CD2 4.47Å; I189-L345 HydrophobicContact CD1-CD2 3.34Å; I189-L345 HydrophobicContact CG1-CD2 3.43Å; I189-L345 VanDerWaalsContact CG1-CD2 3.43Å; I189-L345 HydrophobicContact CG2-CD2 4.39Å; V341-L345 WeakPolarHBondContact O-CB 3.12Å; V341-L345 PolarHBondContact O-N 3.1Å; L342-L345 PolarHBondContact O-N 2.86Å; A343-L345 VanDerWaalsContact C-N 3.31Å; A343-L345 PolarHBondContact O-N 2.96Å; L345-K347 VanDerWaalsContact C-N 3.34Å; L345-K347 PolarHBondContact O-N 2.93Å; L345-R348 PolarHBondContact O-N 3.32Å; L345-Q349 HydrophobicContact CD2-CG 4.26Å; L345-Q349 WeakPolarHBondContact O-CB 3.22Å; L345-Q349 VanDerWaalsContact O-CG 3.3Å; L345-Q349 WeakPolarHBondContact O-CG 3.28Å; L345-Q349 PolarHBondContact O-N 2.84Å
346H91.1Very high84.6Confident96 Ų9688.8 Ų88.844%0.44447%0.47SS..Hα-helixtrans-60.1-43.5171.8-75.2148.8000112.1I189 L342 A343 Q349 A350I189-H346 WeakPolarHBondContact CD1-CD2 3.23Å; I189-H346 WeakPolarHBondContact CD1-NE2 3.46Å; L342-H346 PolarHBondContact O-N 2.83Å; L342-H346 PolarHBondContact O-ND1 3.25Å; A343-H346 PolarHBondContact O-N 3.39Å; H346-Q349 PolarHBondContact O-N 3.49Å; H346-A350 PolarHBondContact O-N 3.4Å
347K93.6Very high87Confident102 Ų10284 Ų8444%0.44345%0.453SS..Hα-helixtrans-61.4-46.3176.6178.6-178.6164-158.60111.6A343 E344 L345 Q349 A350 E351A343-K347 WeakPolarHBondContact O-CB 3.05Å; A343-K347 PolarHBondContact O-N 2.89Å; E344-K347 WeakPolarHBondContact O-CB 3.35Å; E344-K347 PolarHBondContact O-N 3.02Å; E344-K347 IonicContact OE1-NZ 3.78Å; E344-K347 PolarHBondContact OE1-NZ 3.36Å; E344-K347 IonicContact OE2-NZ 3.8Å; E344-K347 PolarHBondContact OE2-NZ 2.94Å; L345-K347 VanDerWaalsContact C-N 3.34Å; L345-K347 PolarHBondContact O-N 2.93Å; K347-Q349 VanDerWaalsContact C-N 3.34Å; K347-Q349 PolarHBondContact O-N 3.34Å; K347-A350 WeakPolarHBondContact O-CB 3.35Å; K347-A350 PolarHBondContact O-N 2.92Å; K347-A350 VanDerWaalsContact O-N 3.13Å; K347-E351 WeakPolarHBondContact CE-OE1 3.14Å; K347-E351 WeakPolarHBondContact O-CG 3.42Å; K347-E351 PolarHBondContact O-N 3.4Å
348R94.5Very high89.2Confident140 Ų14084.5 Ų84.553%0.52844%0.444SS..Hα-helixtrans-65.1-36.9177-65.3-65.3161.178.4-0.7112.4E344 L345 A350 E351 L352E344-R348 HydrophobicContact CG-CG 4.47Å; E344-R348 WeakPolarHBondContact O-CB 3.1Å; E344-R348 WeakPolarHBondContact O-CG 3.12Å; E344-R348 PolarHBondContact O-N 2.8Å; E344-R348 IonicContact OE1-CZ 2.7Å; E344-R348 IonicContact OE1-NE 3.5Å; E344-R348 PolarHBondContact OE1-NE 3.4Å; E344-R348 IonicContact OE1-NH1 3.49Å; E344-R348 IonicContact OE1-NH2 2.99Å; E344-R348 PolarHBondContact OE1-NH2 3.39Å; L345-R348 PolarHBondContact O-N 3.32Å; R348-A350 VanDerWaalsContact C-N 3.34Å; R348-E351 WeakPolarHBondContact CD-OE2 3.45Å; R348-E351 IonicContact NE-OE2 2.77Å; R348-E351 PolarHBondContact O-N 3.32Å; R348-L352 VanDerWaalsContact O-CB 3.31Å; R348-L352 WeakPolarHBondContact O-CB 3.27Å; R348-L352 PolarHBondContact O-N 2.97Å
349Q93.9Very high91.3Very high24 Ų2481.1 Ų81.111%0.11243%0.431CS..Hα-helixtrans-63.3-39171.6-75.1179.4-9.900112.1Y187 L345 H346 K347 K353Y187-Q349 HydrophobicContact CD1-CB 4.23Å; Y187-Q349 HydrophobicContact CD1-CG 4.24Å; Y187-Q349 PolarHBondContact O-NE2 3.11Å; L345-Q349 HydrophobicContact CD2-CG 4.26Å; L345-Q349 WeakPolarHBondContact O-CB 3.22Å; L345-Q349 VanDerWaalsContact O-CG 3.3Å; L345-Q349 WeakPolarHBondContact O-CG 3.28Å; L345-Q349 PolarHBondContact O-N 2.84Å; H346-Q349 PolarHBondContact O-N 3.49Å; K347-Q349 VanDerWaalsContact C-N 3.34Å; K347-Q349 PolarHBondContact O-N 3.34Å; Q349-K353 VanDerWaalsContact O-CG 3.3Å; Q349-K353 WeakPolarHBondContact O-CG 3.29Å; Q349-K353 PolarHBondContact O-N 2.99Å
350A93.9Very high92.3Very high58 Ų5884.1 Ų84.148%0.47944%0.437SS..Hα-helixtrans-66.9-43.717600000112.1H346 K347 R348 K353 A354H346-A350 PolarHBondContact O-N 3.4Å; K347-A350 WeakPolarHBondContact O-CB 3.35Å; K347-A350 PolarHBondContact O-N 2.92Å; K347-A350 VanDerWaalsContact O-N 3.13Å; R348-A350 VanDerWaalsContact C-N 3.34Å; A350-K353 PolarHBondContact O-N 3.31Å; A350-A354 PolarHBondContact O-N 3.38Å
351E95.6Very high92.8Very high86 Ų8679.4 Ų79.440%0.40242%0.422SS..Hα-helixtrans-60-45.3173.6-72.1173.4-169.600111.3K347 R348 K353 A354 L355K347-E351 WeakPolarHBondContact CE-OE1 3.14Å; K347-E351 WeakPolarHBondContact O-CG 3.42Å; K347-E351 PolarHBondContact O-N 3.4Å; R348-E351 WeakPolarHBondContact CD-OE2 3.45Å; R348-E351 IonicContact NE-OE2 2.77Å; R348-E351 PolarHBondContact O-N 3.32Å; E351-K353 PolarHBondContact O-N 3.11Å; E351-A354 PolarHBondContact O-N 3.37Å; E351-L355 WeakPolarHBondContact O-CB 3.31Å; E351-L355 WeakPolarHBondContact O-CG 3.33Å; E351-L355 PolarHBondContact O-N 2.84Å
352L93.9Very high93.4Very high69 Ų6981.6 Ų81.636%0.36142%0.419SS..Hα-helixtrans-60.6-43.7176.5-177.961000111.6Y187 R348 A354 L355 S356Y187-L352 HydrophobicContact CE1-CD2 4.08Å; Y187-L352 HydrophobicContact CE1-CG 4.33Å; R348-L352 VanDerWaalsContact O-CB 3.31Å; R348-L352 WeakPolarHBondContact O-CB 3.27Å; R348-L352 PolarHBondContact O-N 2.97Å; L352-A354 PolarHBondContact O-N 2.96Å; L352-L355 PolarHBondContact O-N 3.44Å; L352-S356 WeakPolarHBondContact O-CB 3.42Å; L352-S356 PolarHBondContact O-N 2.86Å; L352-S356 PolarHBondContact O-OG 3.42Å; L352-S356 VanDerWaalsContact O-OG 3.1Å
353K92.9Very high93.8Very high111 Ų11181.9 Ų81.948%0.48342%0.418SS..Hα-helixtrans-59.5-45.1175.2-75.3171.4-175.4171.70111.9Y187 Q349 A350 E351 A357Y187-K353 HydrophobicContact CD1-CD 4.47Å; Y187-K353 VanDerWaalsContact CD1-CE 3.5Å; Y187-K353 HydrophobicContact CD1-CG 4.21Å; Y187-K353 HydrophobicContact CE1-CD 4.21Å; Y187-K353 HydrophobicContact CE1-CG 3.49Å; Y187-K353 VanDerWaalsContact CE1-CG 3.49Å; Q349-K353 VanDerWaalsContact O-CG 3.3Å; Q349-K353 WeakPolarHBondContact O-CG 3.29Å; Q349-K353 PolarHBondContact O-N 2.99Å; A350-K353 PolarHBondContact O-N 3.31Å; E351-K353 PolarHBondContact O-N 3.11Å; K353-A357 VanDerWaalsContact O-CB 3.31Å; K353-A357 WeakPolarHBondContact O-CB 3.46Å; K353-A357 PolarHBondContact O-N 2.91Å
354A95.4Very high94.3Very high63 Ų6385 Ų8552%0.52143%0.426SS..Hα-helixtrans-64.1-44.217900000111.8A350 E351 L352 A357 H358A350-A354 PolarHBondContact O-N 3.38Å; E351-A354 PolarHBondContact O-N 3.37Å; L352-A354 PolarHBondContact O-N 2.96Å; A354-A357 PolarHBondContact O-N 3.21Å; A354-H358 WeakPolarHBondContact O-CB 3.47Å; A354-H358 PolarHBondContact O-N 3.03Å
355L95.1Very high94.6Very high104 Ų10485.8 Ų85.855%0.54543%0.43SS..Hα-helixtrans-64.5-45.5176.8-72.8172.6000112E351 L352 A357 H358 N359E351-L355 WeakPolarHBondContact O-CB 3.31Å; E351-L355 WeakPolarHBondContact O-CG 3.33Å; E351-L355 PolarHBondContact O-N 2.84Å; L352-L355 PolarHBondContact O-N 3.44Å; L355-A357 VanDerWaalsContact C-N 3.35Å; L355-A357 PolarHBondContact O-N 3.09Å; L355-H358 PolarHBondContact O-N 3.47Å; L355-N359 WeakPolarHBondContact O-CB 3.48Å; L355-N359 VanDerWaalsContact O-CG 3.25Å; L355-N359 PolarHBondContact O-N 2.77Å; L355-N359 PolarHBondContact O-ND2 3.32Å
356S92.2Very high94.9Very high38 Ų3887.2 Ų87.227%0.26644%0.437SS..Hα-helixtrans-61.3-42.9176.7-69.10000111.6L352 N359 R360L352-S356 WeakPolarHBondContact O-CB 3.42Å; L352-S356 PolarHBondContact O-N 2.86Å; L352-S356 PolarHBondContact O-OG 3.42Å; L352-S356 VanDerWaalsContact O-OG 3.1Å; S356-N359 PolarHBondContact O-N 2.82Å; S356-R360 VanDerWaalsContact O-CB 3.28Å; S356-R360 WeakPolarHBondContact O-CB 3.46Å; S356-R360 PolarHBondContact O-N 3.45Å
357A93.4Very high95.2Very high61 Ų6183.7 Ų83.750%0.50442%0.422SS..Hα-helixtrans-62.9-4517500000112.2K353 A354 L355 R360 S361K353-A357 VanDerWaalsContact O-CB 3.31Å; K353-A357 WeakPolarHBondContact O-CB 3.46Å; K353-A357 PolarHBondContact O-N 2.91Å; A354-A357 PolarHBondContact O-N 3.21Å; L355-A357 VanDerWaalsContact C-N 3.35Å; L355-A357 PolarHBondContact O-N 3.09Å; A357-R360 PolarHBondContact O-N 2.8Å; A357-S361 WeakPolarHBondContact O-CB 3.26Å; A357-S361 PolarHBondContact O-N 3.42Å
358H96.4Very high95.4Very high108 Ų10884.2 Ų84.250%0.542%0.421SS..Hα-helixtrans-61-50.3176.3-177.476.9000111.5A354 L355 R360 S361 R362A354-H358 WeakPolarHBondContact O-CB 3.47Å; A354-H358 PolarHBondContact O-N 3.03Å; L355-H358 PolarHBondContact O-N 3.47Å; H358-R360 VanDerWaalsContact C-N 3.3Å; H358-R360 PolarHBondContact O-N 3.06Å; H358-S361 WeakPolarHBondContact O-CB 3.34Å; H358-S361 PolarHBondContact O-N 2.88Å; H358-S361 VanDerWaalsContact O-N 3.16Å; H358-R362 WeakPolarHBondContact NE2-CG 3.45Å; H358-R362 WeakPolarHBondContact O-CG 3.48Å; H358-R362 PolarHBondContact O-N 3.09Å
359N94.8Very high95.5Very high83 Ų8381.2 Ų81.244%0.44442%0.415SS..Hα-helixtrans-59.6-41.7178.8-73.8-20.9000111.6L355 S356 R362 K363L355-N359 WeakPolarHBondContact O-CB 3.48Å; L355-N359 VanDerWaalsContact O-CG 3.25Å; L355-N359 PolarHBondContact O-N 2.77Å; L355-N359 PolarHBondContact O-ND2 3.32Å; S356-N359 PolarHBondContact O-N 2.82Å; N359-R362 PolarHBondContact O-N 3.34Å; N359-K363 WeakPolarHBondContact O-CB 3.33Å; N359-K363 VanDerWaalsContact O-CG 3.25Å; N359-K363 WeakPolarHBondContact O-CG 3.35Å; N359-K363 PolarHBondContact O-N 3.23Å
360R94.5Very high95.6Very high130 Ų13080.5 Ų80.549%0.49141%0.413SS..Hα-helixtrans-61.4-46.3175.1-171.6176.9-172.9-1791.6111.6L177 S356 A357 H358 R362 K363 Q364L177-R360 HydrophobicContact CD2-CG 4.07Å; S356-R360 VanDerWaalsContact O-CB 3.28Å; S356-R360 WeakPolarHBondContact O-CB 3.46Å; S356-R360 PolarHBondContact O-N 3.45Å; A357-R360 PolarHBondContact O-N 2.8Å; H358-R360 VanDerWaalsContact C-N 3.3Å; H358-R360 PolarHBondContact O-N 3.06Å; R360-R362 PolarHBondContact O-N 3.5Å; R360-K363 PolarHBondContact O-N 3.17Å; R360-Q364 WeakPolarHBondContact O-CG 3.44Å; R360-Q364 PolarHBondContact O-N 3.28Å
361S96.7Very high95.7Very high66 Ų6681.8 Ų81.846%0.46241%0.408SS..Hα-helixtrans-60.6-44.8176.6179.20000112A357 H358 Q364 E365A357-S361 WeakPolarHBondContact O-CB 3.26Å; A357-S361 PolarHBondContact O-N 3.42Å; H358-S361 WeakPolarHBondContact O-CB 3.34Å; H358-S361 PolarHBondContact O-N 2.88Å; H358-S361 VanDerWaalsContact O-N 3.16Å; S361-Q364 WeakPolarHBondContact O-CB 3.28Å; S361-Q364 PolarHBondContact O-N 3.49Å; S361-E365 PolarHBondContact O-N 3.49Å
362R97.3Very high95.7Very high151 Ų15180.2 Ų80.257%0.5740%0.4SS*.Hα-helixtrans-63.7-42.1177.2-64.3-63.9-76.9174.1-6.5112.2H358 N359 R360 E365 L366H358-R362 WeakPolarHBondContact NE2-CG 3.45Å; H358-R362 WeakPolarHBondContact O-CG 3.48Å; H358-R362 PolarHBondContact O-N 3.09Å; N359-R362 PolarHBondContact O-N 3.34Å; R360-R362 PolarHBondContact O-N 3.5Å; R362-E365 PolarHBondContact O-N 2.86Å; R362-L366 WeakPolarHBondContact O-CB 3.4Å; R362-L366 WeakPolarHBondContact O-CG 3.41Å; R362-L366 PolarHBondContact O-N 2.9Å
363K95.9Very high95.8Very high69 Ų6979.6 Ų79.630%0.340%0.396SS..Hα-helixtrans-62.4-40174.6-72.9171178-177.60112.1L176 L177 N359 R360 L366 L367L176-K363 HydrophobicContact CB-CD 4.31Å; L176-K363 WeakPolarHBondContact O-CD 3.26Å; L176-K363 PolarHBondContact O-NZ 3.03Å; L177-K363 HydrophobicContact CD2-CB 3.66Å; L177-K363 HydrophobicContact CG-CB 3.96Å; N359-K363 WeakPolarHBondContact O-CB 3.33Å; N359-K363 VanDerWaalsContact O-CG 3.25Å; N359-K363 WeakPolarHBondContact O-CG 3.35Å; N359-K363 PolarHBondContact O-N 3.23Å; R360-K363 PolarHBondContact O-N 3.17Å; K363-L366 PolarHBondContact O-N 2.92Å; K363-L367 WeakPolarHBondContact O-CB 3.36Å; K363-L367 PolarHBondContact O-N 2.95Å
364Q97.1Very high96Very high102 Ų10275.7 Ų75.748%0.47738%0.379SS..Hα-helixtrans-62.7-43.8175.3-74.6175.6-21.800111.8L177 R360 S361 L367 R368L177-Q364 HydrophobicContact CD1-CG 4.23Å; L177-Q364 HydrophobicContact CD2-CG 3.53Å; R360-Q364 WeakPolarHBondContact O-CG 3.44Å; R360-Q364 PolarHBondContact O-N 3.28Å; S361-Q364 WeakPolarHBondContact O-CB 3.28Å; S361-Q364 PolarHBondContact O-N 3.49Å; Q364-L367 PolarHBondContact O-N 3.32Å; Q364-R368 PolarHBondContact O-N 3.02Å
365E97.8Very high95.9Very high73 Ų7379.7 Ų79.734%0.34138%0.381SS..Hα-helixtrans-66.3-42.3177.418056.9-167.400111.8S361 R362 L367 R368 L369S361-E365 PolarHBondContact O-N 3.49Å; R362-E365 PolarHBondContact O-N 2.86Å; E365-L367 VanDerWaalsContact C-N 3.32Å; E365-L367 PolarHBondContact O-N 3.49Å; E365-R368 WeakPolarHBondContact O-CB 3.41Å; E365-R368 PolarHBondContact O-N 3.39Å; E365-R368 VanDerWaalsContact O-N 3.17Å; E365-R368 IonicContact OE1-CZ 3.14Å; E365-R368 IonicContact OE1-NE 2.63Å; E365-R368 PolarHBondContact OE1-NE 3Å; E365-R368 IonicContact OE1-NH2 2.7Å; E365-R368 PolarHBondContact OE1-NH2 3.19Å; E365-R368 IonicContact OE2-CZ 3.93Å; E365-R368 IonicContact OE2-NE 3.45Å; E365-R368 PolarHBondContact OE2-NE 3.02Å; E365-R368 IonicContact OE2-NH2 2.8Å; E365-L369 HydrophobicContact CG-CD1 4.19Å; E365-L369 WeakPolarHBondContact O-CG 3.44Å; E365-L369 PolarHBondContact O-N 3.11Å
366L97Very high95.9Very high97 Ų9778.2 Ų78.251%0.50837%0.37SS..Hα-helixtrans-58.8-43.7173.5-75.4171.8000111.8R362 K363 R368 L369 A370R362-L366 WeakPolarHBondContact O-CB 3.4Å; R362-L366 WeakPolarHBondContact O-CG 3.41Å; R362-L366 PolarHBondContact O-N 2.9Å; K363-L366 PolarHBondContact O-N 2.92Å; L366-R368 VanDerWaalsContact C-N 3.32Å; L366-R368 PolarHBondContact O-N 3.14Å; L366-L369 PolarHBondContact O-N 2.91Å; L366-A370 VanDerWaalsContact O-CB 3.24Å; L366-A370 WeakPolarHBondContact O-CB 3.43Å; L366-A370 PolarHBondContact O-N 3.08Å
367L97.3Very high96.1Very high23 Ų2377.6 Ų77.612%0.1236%0.363CS..Hα-helixtrans-61.6-41.2176179.663.1000111.8I170 L173 E174 L177 K363 Q364 E365 A370 K371I170-L367 HydrophobicContact CD1-CD1 4.34Å; I170-L367 HydrophobicContact CG2-CD1 3.88Å; L173-L367 HydrophobicContact CB-CD1 4.09Å; E174-L367 HydrophobicContact CG-CD1 3.82Å; E174-L367 HydrophobicContact CG-CD2 3.79Å; E174-L367 HydrophobicContact CG-CG 4.49Å; L177-L367 HydrophobicContact CD1-CB 4.24Å; L177-L367 HydrophobicContact CD1-CD2 3.61Å; K363-L367 WeakPolarHBondContact O-CB 3.36Å; K363-L367 PolarHBondContact O-N 2.95Å; Q364-L367 PolarHBondContact O-N 3.32Å; E365-L367 VanDerWaalsContact C-N 3.32Å; E365-L367 PolarHBondContact O-N 3.49Å; L367-A370 PolarHBondContact O-N 2.95Å; L367-K371 HydrophobicContact CD1-CD 4.31Å; L367-K371 HydrophobicContact CD1-CG 4.39Å; L367-K371 HydrophobicContact CG-CD 4.34Å; L367-K371 WeakPolarHBondContact O-CB 3.43Å; L367-K371 WeakPolarHBondContact O-CG 3.4Å; L367-K371 PolarHBondContact O-N 3Å
368R97.5Very high96.2Very high113 Ų11380.4 Ų80.443%0.42637%0.366SS..Hα-helixtrans-61.7-49.7176.9-170.4-165.269.272.3-1.6111Q364 E365 L366 K371 E372Q364-R368 PolarHBondContact O-N 3.02Å; E365-R368 WeakPolarHBondContact O-CB 3.41Å; E365-R368 PolarHBondContact O-N 3.39Å; E365-R368 VanDerWaalsContact O-N 3.17Å; E365-R368 IonicContact OE1-CZ 3.14Å; E365-R368 IonicContact OE1-NE 2.63Å; E365-R368 PolarHBondContact OE1-NE 3Å; E365-R368 IonicContact OE1-NH2 2.7Å; E365-R368 PolarHBondContact OE1-NH2 3.19Å; E365-R368 IonicContact OE2-CZ 3.93Å; E365-R368 IonicContact OE2-NE 3.45Å; E365-R368 PolarHBondContact OE2-NE 3.02Å; E365-R368 IonicContact OE2-NH2 2.8Å; L366-R368 VanDerWaalsContact C-N 3.32Å; L366-R368 PolarHBondContact O-N 3.14Å; R368-K371 PolarHBondContact O-N 3.49Å; R368-E372 IonicContact NH1-OE2 3.64Å; R368-E372 PolarHBondContact NH1-OE2 3Å; R368-E372 PolarHBondContact O-N 3.42Å
369L97.1Very high96.2Very high77 Ų7776.8 Ų76.840%0.40335%0.35SS..Hα-helixtrans-62-44.1178.4-71171.7000111.5E365 L366 K371 E372 E373E365-L369 HydrophobicContact CG-CD1 4.19Å; E365-L369 WeakPolarHBondContact O-CG 3.44Å; E365-L369 PolarHBondContact O-N 3.11Å; L366-L369 PolarHBondContact O-N 2.91Å; L369-K371 PolarHBondContact O-N 3.18Å; L369-E372 WeakPolarHBondContact O-CB 3.49Å; L369-E372 PolarHBondContact O-N 2.81Å; L369-E373 WeakPolarHBondContact O-CB 3.5Å; L369-E373 PolarHBondContact O-N 3.14Å
370A96.6Very high96.2Very high9 Ų976.7 Ų76.77%0.07434%0.344CS..Hα-helixtrans-63.4-40.6178.700000112.1I165 I170 L173 L366 L367 E373 M374I165-A370 HydrophobicContact CD1-CB 4.08Å; I165-A370 HydrophobicContact CG2-CB 4.47Å; I170-A370 HydrophobicContact CD1-CB 3.32Å; L173-A370 HydrophobicContact CD1-CB 4.18Å; L366-A370 VanDerWaalsContact O-CB 3.24Å; L366-A370 WeakPolarHBondContact O-CB 3.43Å; L366-A370 PolarHBondContact O-N 3.08Å; L367-A370 PolarHBondContact O-N 2.95Å; A370-E373 PolarHBondContact O-N 2.89Å; A370-M374 WeakPolarHBondContact O-CG 3.43Å; A370-M374 PolarHBondContact O-N 3.35Å
371K96.3Very high96.3Very high84 Ų8475.3 Ų75.337%0.36534%0.343SS..Hα-helixtrans-67.2-32.6173.7-75.8-179.6174.71750113.4I170 E174 L367 R368 L369 R375I170-K371 HydrophobicContact CD1-CG 4.24Å; E174-K371 WeakPolarHBondContact OE1-CE 3.35Å; E174-K371 IonicContact OE1-NZ 2.64Å; E174-K371 PolarHBondContact OE1-NZ 3.11Å; L367-K371 HydrophobicContact CD1-CD 4.31Å; L367-K371 HydrophobicContact CD1-CG 4.39Å; L367-K371 HydrophobicContact CG-CD 4.34Å; L367-K371 WeakPolarHBondContact O-CB 3.43Å; L367-K371 WeakPolarHBondContact O-CG 3.4Å; L367-K371 PolarHBondContact O-N 3Å; R368-K371 PolarHBondContact O-N 3.49Å; L369-K371 PolarHBondContact O-N 3.18Å; K371-R375 PolarHBondContact O-N 3.11Å; K371-R375 PolarHBondContact O-NE 3.49Å
372E95.6Very high96.3Very high53 Ų5378 Ų7825%0.24834%0.342CS..Hα-helixtrans-68.7-44.4172.5-168-171.3138.100111.1R368 L369 M374 R375 K376R368-E372 IonicContact NH1-OE2 3.64Å; R368-E372 PolarHBondContact NH1-OE2 3Å; R368-E372 PolarHBondContact O-N 3.42Å; L369-E372 WeakPolarHBondContact O-CB 3.49Å; L369-E372 PolarHBondContact O-N 2.81Å; E372-M374 PolarHBondContact O-N 3.36Å; E372-R375 WeakPolarHBondContact O-CB 3.3Å; E372-R375 PolarHBondContact O-N 3.34Å; E372-R375 VanDerWaalsContact O-N 3.16Å; E372-K376 PolarHBondContact O-N 3.4Å; E372-K376 IonicContact OE1-NZ 2.69Å; E372-K376 PolarHBondContact OE1-NZ 3.35Å
373E95.4Very high96.3Very high57 Ų5771.4 Ų71.427%0.26632%0.319SS..Hα-helixtrans-66.3-36.8178.9-174.254.1-145.900112.2I165 L369 A370 R375 K376 Q377 R380I165-E373 HydrophobicContact CD1-CB 3.9Å; I165-E373 HydrophobicContact CD1-CG 3.83Å; L369-E373 WeakPolarHBondContact O-CB 3.5Å; L369-E373 PolarHBondContact O-N 3.14Å; A370-E373 PolarHBondContact O-N 2.89Å; E373-R375 VanDerWaalsContact C-N 3.33Å; E373-R375 PolarHBondContact O-N 3.11Å; E373-K376 CarbonylContact O-C 3.57Å; E373-K376 WeakPolarHBondContact O-CA 3.32Å; E373-K376 WeakPolarHBondContact O-CB 3.16Å; E373-K376 PolarHBondContact O-N 3.18Å; E373-K376 VanDerWaalsContact O-N 3.12Å; E373-Q377 WeakPolarHBondContact O-CG 3.33Å; E373-Q377 PolarHBondContact O-N 3.32Å; E373-R380 IonicContact OE1-CZ 2.74Å; E373-R380 VanDerWaalsContact OE1-CZ 3.27Å; E373-R380 IonicContact OE1-NH1 3.02Å; E373-R380 PolarHBondContact OE1-NH1 2.88Å; E373-R380 IonicContact OE1-NH2 2.79Å; E373-R380 PolarHBondContact OE1-NH2 2.77Å
374M95.9Very high96.3Very high28 Ų2874.6 Ų74.614%0.13833%0.329CS..Hα-helixtrans-57.1-44.2170-82.8-163.172.600112.6I165 N167 I170 A370 E372 K376 Q377 E378I165-M374 HydrophobicContact CB-CG 4.37Å; I165-M374 HydrophobicContact CG2-CG 4.14Å; N167-M374 WeakPolarHBondContact OD1-CE 3.33Å; I170-M374 HydrophobicContact CD1-SD 4.15Å; I170-M374 HydrophobicContact CG1-CG 4.41Å; I170-M374 HydrophobicContact CG1-SD 3.46Å; I170-M374 WeakPolarHBondContact CG1-SD 3.21Å; A370-M374 WeakPolarHBondContact O-CG 3.43Å; A370-M374 PolarHBondContact O-N 3.35Å; E372-M374 PolarHBondContact O-N 3.36Å; M374-K376 VanDerWaalsContact C-N 3.3Å; M374-K376 PolarHBondContact O-N 2.84Å; M374-Q377 WeakPolarHBondContact O-CB 3.47Å; M374-Q377 PolarHBondContact O-N 2.8Å; M374-E378 WeakPolarHBondContact O-CG 3.45Å; M374-E378 PolarHBondContact O-N 3.21Å
375R95.1Very high96.3Very high147 Ų14773.1 Ų73.156%0.55533%0.327SS*.Hα-helixtrans-62.6-38.8175.5-73.6-178.5-79.7147.4-6.1111.4K371 E372 E373 E378 L379K371-R375 PolarHBondContact O-N 3.11Å; K371-R375 PolarHBondContact O-NE 3.49Å; E372-R375 WeakPolarHBondContact O-CB 3.3Å; E372-R375 PolarHBondContact O-N 3.34Å; E372-R375 VanDerWaalsContact O-N 3.16Å; E373-R375 VanDerWaalsContact C-N 3.33Å; E373-R375 PolarHBondContact O-N 3.11Å; R375-E378 PolarHBondContact O-N 3Å; R375-L379 WeakPolarHBondContact O-CG 3.48Å; R375-L379 PolarHBondContact O-N 3.42Å; R375-L379 VanDerWaalsContact O-N 3.12Å
376K95.2Very high96.2Very high73 Ų7369.8 Ų69.832%0.31731%0.312SS..Hα-helixtrans-65.5-40.7174.3-70.9171.9168.9163.80111.8E372 E373 M374 L379 R380E372-K376 PolarHBondContact O-N 3.4Å; E372-K376 IonicContact OE1-NZ 2.69Å; E372-K376 PolarHBondContact OE1-NZ 3.35Å; E373-K376 CarbonylContact O-C 3.57Å; E373-K376 WeakPolarHBondContact O-CA 3.32Å; E373-K376 WeakPolarHBondContact O-CB 3.16Å; E373-K376 PolarHBondContact O-N 3.18Å; E373-K376 VanDerWaalsContact O-N 3.12Å; M374-K376 VanDerWaalsContact C-N 3.3Å; M374-K376 PolarHBondContact O-N 2.84Å; K376-L379 PolarHBondContact O-N 2.67Å; K376-R380 WeakPolarHBondContact O-CG 3.14Å; K376-R380 PolarHBondContact O-N 2.99Å
377Q95.6Very high96.2Very high26 Ų2667.7 Ų67.712%0.12130%0.301CS..Hα-helixtrans-60.4-43.8174.9-73.9166.56.400111.9D164 I165 E373 M374 L379 R380 Q381D164-Q377 HydrophobicContact CB-CG 4.44Å; I165-Q377 VanDerWaalsContact N-OE1 3.16Å; I165-Q377 PolarHBondContact O-OE1 3.35Å; E373-Q377 WeakPolarHBondContact O-CG 3.33Å; E373-Q377 PolarHBondContact O-N 3.32Å; M374-Q377 WeakPolarHBondContact O-CB 3.47Å; M374-Q377 PolarHBondContact O-N 2.8Å; Q377-L379 PolarHBondContact O-N 3.09Å; Q377-R380 PolarHBondContact O-N 3.35Å; Q377-Q381 WeakPolarHBondContact O-CB 3.25Å; Q377-Q381 PolarHBondContact O-N 2.95Å
378E95.5Very high96.2Very high119 Ų11971 Ų7156%0.55632%0.319SS*.Hα-helixtrans-59.9-44.5174.6-71.3175.4174.100111.9M374 R375 Q381 R382M374-E378 WeakPolarHBondContact O-CG 3.45Å; M374-E378 PolarHBondContact O-N 3.21Å; R375-E378 PolarHBondContact O-N 3Å; E378-Q381 PolarHBondContact O-N 3.43Å; E378-R382 WeakPolarHBondContact O-CG 3.35Å; E378-R382 PolarHBondContact O-N 2.96Å
379L96.1Very high96.2Very high32 Ų3269.8 Ų69.817%0.16832%0.318CS..Hα-helixtrans-63.2-45.2175.6-71.5173.1000111.8R375 K376 Q377 Q381 R382 V383 I425 L428 L429R375-L379 WeakPolarHBondContact O-CG 3.48Å; R375-L379 PolarHBondContact O-N 3.42Å; R375-L379 VanDerWaalsContact O-N 3.12Å; K376-L379 PolarHBondContact O-N 2.67Å; Q377-L379 PolarHBondContact O-N 3.09Å; L379-Q381 VanDerWaalsContact C-N 3.28Å; L379-Q381 PolarHBondContact O-N 3.27Å; L379-R382 WeakPolarHBondContact O-CB 3.4Å; L379-R382 PolarHBondContact O-N 3.2Å; L379-R382 VanDerWaalsContact O-N 3.11Å; L379-V383 WeakPolarHBondContact O-CG2 3.18Å; L379-V383 PolarHBondContact O-N 2.91Å; L379-I425 HydrophobicContact CB-CG2 4.39Å; L379-I425 HydrophobicContact CD2-CG2 4.09Å; L379-L428 HydrophobicContact CD1-CB 4.25Å; L379-L428 HydrophobicContact CD2-CB 4.35Å; L379-L428 HydrophobicContact CD2-CD1 4.39Å; L379-L429 HydrophobicContact CB-CD1 4.22Å; L379-L429 HydrophobicContact CB-CD2 3.61Å; L379-L429 HydrophobicContact CB-CG 3.79Å; L379-L429 HydrophobicContact CD1-CD2 4.14Å; L379-L429 HydrophobicContact CD1-CG 4.29Å
380R95.6Very high96.2Very high82 Ų8267.6 Ų67.631%0.30931%0.308SS..Hα-helixtrans-60.3-38.8175.4-71.4-169.8-61.3-101.88.6111.8E373 K376 Q377 V383 R384 L429E373-R380 IonicContact OE1-CZ 2.74Å; E373-R380 VanDerWaalsContact OE1-CZ 3.27Å; E373-R380 IonicContact OE1-NH1 3.02Å; E373-R380 PolarHBondContact OE1-NH1 2.88Å; E373-R380 IonicContact OE1-NH2 2.79Å; E373-R380 PolarHBondContact OE1-NH2 2.77Å; K376-R380 WeakPolarHBondContact O-CG 3.14Å; K376-R380 PolarHBondContact O-N 2.99Å; Q377-R380 PolarHBondContact O-N 3.35Å; R380-V383 PolarHBondContact O-N 3.49Å; R380-R384 WeakPolarHBondContact O-CG 3.45Å; R380-R384 PolarHBondContact O-N 3.42Å; R380-L429 HydrophobicContact CG-CD1 4.22Å; R380-L429 HydrophobicContact CG-CD2 3.98Å
381Q96.1Very high96.2Very high101 Ų10172.1 Ų72.147%0.47233%0.329SS..Hα-helixtrans-66-40.2174.9-17559.714.500111.8Q377 E378 L379 R384 V385Q377-Q381 WeakPolarHBondContact O-CB 3.25Å; Q377-Q381 PolarHBondContact O-N 2.95Å; E378-Q381 PolarHBondContact O-N 3.43Å; L379-Q381 VanDerWaalsContact C-N 3.28Å; L379-Q381 PolarHBondContact O-N 3.27Å; Q381-R384 WeakPolarHBondContact O-CB 3.45Å; Q381-R384 PolarHBondContact O-N 2.97Å; Q381-V385 WeakPolarHBondContact O-CG2 3.42Å; Q381-V385 PolarHBondContact O-N 3Å
382R96.8Very high96.2Very high121 Ų12172 Ų7246%0.45733%0.33SS..Hα-helixtrans-63.3-39.2173.1-72.3177.862.9-162.8-2.8112.5E378 L379 V385 S386 I425E378-R382 WeakPolarHBondContact O-CG 3.35Å; E378-R382 PolarHBondContact O-N 2.96Å; L379-R382 WeakPolarHBondContact O-CB 3.4Å; L379-R382 PolarHBondContact O-N 3.2Å; L379-R382 VanDerWaalsContact O-N 3.11Å; R382-V385 PolarHBondContact O-N 3.28Å; R382-S386 PolarHBondContact O-N 3.39Å; R382-I425 HydrophobicContact CB-CD1 3.96Å; R382-I425 HydrophobicContact CB-CG2 4.3Å
383V96.5Very high96.2Very high14 Ų1469.7 Ų69.79%0.08532%0.32CS..Hα-helixtrans-58.6-48.6172.6174.40000110.4L379 R380 V385 S386 D387 I425 L426 L429L379-V383 WeakPolarHBondContact O-CG2 3.18Å; L379-V383 PolarHBondContact O-N 2.91Å; R380-V383 PolarHBondContact O-N 3.49Å; V383-V385 VanDerWaalsContact C-N 3.27Å; V383-V385 PolarHBondContact O-N 3.44Å; V383-S386 CarbonylContact O-C 3.18Å; V383-S386 PolarHBondContact O-N 3.09Å; V383-S386 VanDerWaalsContact O-N 3.07Å; V383-D387 WeakPolarHBondContact O-CB 3.48Å; V383-D387 PolarHBondContact O-N 3Å; V383-I425 HydrophobicContact CG2-CB 3.97Å; V383-I425 HydrophobicContact CG2-CG2 3.36Å; V383-L426 HydrophobicContact CG1-CD2 4.21Å; V383-L426 HydrophobicContact CG2-CD2 4.14Å; V383-L429 HydrophobicContact CG2-CD1 3.51Å
384R96.4Very high96.2Very high135 Ų13572.5 Ų72.551%0.50933%0.331SS..Hα-helixtrans-57.9-39.1177.9-69.4172.6-177.3168.5-0.2112.4R380 Q381 N388R380-R384 WeakPolarHBondContact O-CG 3.45Å; R380-R384 PolarHBondContact O-N 3.42Å; Q381-R384 WeakPolarHBondContact O-CB 3.45Å; Q381-R384 PolarHBondContact O-N 2.97Å; R384-N388 PolarHBondContact O-N 2.76Å; R384-N388 VanDerWaalsContact O-N 3.15Å; R384-N388 PolarHBondContact O-ND2 3.31Å
385V97Very high96.2Very high72 Ų7277.9 Ų77.944%0.43635%0.35SS..Hα-helixtrans-64.6-48.4174.9174.20000110.4Q381 R382 V383 D387 N388 E389Q381-V385 WeakPolarHBondContact O-CG2 3.42Å; Q381-V385 PolarHBondContact O-N 3Å; R382-V385 PolarHBondContact O-N 3.28Å; V383-V385 VanDerWaalsContact C-N 3.27Å; V383-V385 PolarHBondContact O-N 3.44Å; V385-D387 PolarHBondContact O-N 3.44Å; V385-N388 WeakPolarHBondContact O-CB 3.47Å; V385-N388 PolarHBondContact O-N 2.99Å; V385-E389 PolarHBondContact O-N 2.72Å
386S96.6Very high96.2Very high2 Ų275 Ų751%0.01434%0.339CS..Hα-helixtrans-63.6-39.5179.6-164.40000112.8R382 V383 N388 E389 V390 A418 R422R382-S386 PolarHBondContact O-N 3.39Å; V383-S386 CarbonylContact O-C 3.18Å; V383-S386 PolarHBondContact O-N 3.09Å; V383-S386 VanDerWaalsContact O-N 3.07Å; S386-N388 VanDerWaalsContact C-N 3.32Å; S386-N388 PolarHBondContact O-N 2.82Å; S386-E389 WeakPolarHBondContact O-CB 3.3Å; S386-E389 PolarHBondContact O-N 3.13Å; S386-E389 VanDerWaalsContact O-N 3.13Å; S386-V390 WeakPolarHBondContact O-CG2 3.46Å; S386-V390 PolarHBondContact O-N 2.75Å; S386-A418 PolarHBondContact OG-O 2.81Å; S386-R422 WeakPolarHBondContact OG-CA 3.49Å; S386-R422 WeakPolarHBondContact OG-CB 3.41Å; S386-R422 PolarHBondContact OG-N 3.15Å; S386-R422 VanDerWaalsContact OG-N 3.11Å
387D96.8Very high96.2Very high54 Ų5473 Ų7329%0.28933%0.332SS..Hα-helixtrans-59.7-42173.4-77.8-22000111.6V383 V385 E389 V390 M391 R422V383-D387 WeakPolarHBondContact O-CB 3.48Å; V383-D387 PolarHBondContact O-N 3Å; V385-D387 PolarHBondContact O-N 3.44Å; D387-E389 VanDerWaalsContact C-N 3.33Å; D387-E389 PolarHBondContact O-N 3.17Å; D387-V390 PolarHBondContact O-N 3.37Å; D387-M391 WeakPolarHBondContact O-CG 3.36Å; D387-M391 PolarHBondContact O-N 3.18Å; D387-R422 WeakPolarHBondContact OD1-CD 3.44Å; D387-R422 IonicContact OD1-CZ 3.94Å; D387-R422 IonicContact OD1-NE 3.93Å; D387-R422 PolarHBondContact OD1-NE 3.27Å
388N97.5Very high96.2Very high93 Ų9375 Ų7550%0.49734%0.342SS..Hα-helixtrans-62.6-41.2174.9-75.9-47.2000111.6R384 V385 S386 M391 E392R384-N388 PolarHBondContact O-N 2.76Å; R384-N388 VanDerWaalsContact O-N 3.15Å; R384-N388 PolarHBondContact O-ND2 3.31Å; V385-N388 WeakPolarHBondContact O-CB 3.47Å; V385-N388 PolarHBondContact O-N 2.99Å; S386-N388 VanDerWaalsContact C-N 3.32Å; S386-N388 PolarHBondContact O-N 2.82Å; N388-M391 PolarHBondContact O-N 2.75Å; N388-E392 WeakPolarHBondContact O-CG 3.45Å; N388-E392 PolarHBondContact O-N 2.97Å
389E96.8Very high96.2Very high86 Ų8671.1 Ų71.140%0.40233%0.33SS..Hα-helixtrans-64.8-39.3175.6-67-171.7169.400112.6V385 S386 D387 E392 G393 A418V385-E389 PolarHBondContact O-N 2.72Å; S386-E389 WeakPolarHBondContact O-CB 3.3Å; S386-E389 PolarHBondContact O-N 3.13Å; S386-E389 VanDerWaalsContact O-N 3.13Å; D387-E389 VanDerWaalsContact C-N 3.33Å; D387-E389 PolarHBondContact O-N 3.17Å; E389-E392 PolarHBondContact O-N 3.44Å; E389-G393 PolarHBondContact O-N 2.95Å; E389-A418 HydrophobicContact CB-CB 3.89Å
390V96.8Very high96.1Very high31 Ų3169.7 Ų69.719%0.18832%0.323CS..Hα-helixtrans-60.4-47.1173170.60000110.2S386 D387 E392 G393 F394 A418 L419S386-V390 WeakPolarHBondContact O-CG2 3.46Å; S386-V390 PolarHBondContact O-N 2.75Å; D387-V390 PolarHBondContact O-N 3.37Å; V390-E392 VanDerWaalsContact C-N 3.33Å; V390-E392 PolarHBondContact O-N 2.99Å; V390-G393 PolarHBondContact O-N 3.44Å; V390-F394 WeakPolarHBondContact O-CB 3.3Å; V390-F394 PolarHBondContact O-N 3.26Å; V390-A418 HydrophobicContact CG2-CB 3.79Å; V390-L419 HydrophobicContact CG1-CD2 3.85Å; V390-L419 HydrophobicContact CG2-CD2 3.95Å; V390-L419 HydrophobicContact CG2-CG 4.23Å
391M97.1Very high96Very high104 Ų10473.6 Ų73.651%0.51234%0.338SS..Hα-helixtrans-64.7-35.4178.4-71.8-61.2-74.100112.6D387 N388 R395D387-M391 WeakPolarHBondContact O-CG 3.36Å; D387-M391 PolarHBondContact O-N 3.18Å; N388-M391 PolarHBondContact O-N 2.75Å; M391-R395 WeakPolarHBondContact O-CB 3.13Å; M391-R395 WeakPolarHBondContact O-CG 3.17Å; M391-R395 PolarHBondContact O-N 3.11Å; M391-R395 PolarHBondContact O-NE 2.99Å
392E96.3Very high96Very high83 Ų8376.3 Ų76.339%0.38835%0.35SS..Hα-helixtrans-68.4-43.9171.8-76.6-168.4-17900112.5N388 E389 V390 F394 R395 R396N388-E392 WeakPolarHBondContact O-CG 3.45Å; N388-E392 PolarHBondContact O-N 2.97Å; E389-E392 PolarHBondContact O-N 3.44Å; V390-E392 VanDerWaalsContact C-N 3.33Å; V390-E392 PolarHBondContact O-N 2.99Å; E392-F394 VanDerWaalsContact C-N 3.3Å; E392-F394 PolarHBondContact O-N 2.71Å; E392-R395 PolarHBondContact O-N 3Å; E392-R396 WeakPolarHBondContact O-CG 3.47Å; E392-R396 PolarHBondContact O-N 3.41Å; E392-R396 IonicContact OE2-CZ 2.77Å; E392-R396 IonicContact OE2-NH2 2.72Å; E392-R396 PolarHBondContact OE2-NH2 3.15Å
393G95.4Very high95.9Very high3 Ų378.7 Ų78.73%0.03136%0.364CS..Hα-helixtrans-56.9-45.9174.700000111.3E389 V390 R396 I397E389-G393 PolarHBondContact O-N 2.95Å; V390-G393 PolarHBondContact O-N 3.44Å; G393-R396 PolarHBondContact O-N 3.08Å; G393-I397 WeakPolarHBondContact O-CG1 2.95Å; G393-I397 PolarHBondContact O-N 3.04Å
394F95.3Very high95.9Very high116 Ų11687.8 Ų87.851%0.50940%0.402SS..Hα-helixtrans-59.4-50173.9178.8-102.6000112V390 E392 R396 I397 M398V390-F394 WeakPolarHBondContact O-CB 3.3Å; V390-F394 PolarHBondContact O-N 3.26Å; E392-F394 VanDerWaalsContact C-N 3.3Å; E392-F394 PolarHBondContact O-N 2.71Å; F394-R396 VanDerWaalsContact C-N 3.33Å; F394-R396 PolarHBondContact O-N 3.47Å; F394-I397 PolarHBondContact O-N 3.45Å; F394-M398 HydrophobicContact CD1-CG 4.16Å; F394-M398 HydrophobicContact CD2-CG 4.22Å; F394-M398 HydrophobicContact CE1-CG 3.74Å; F394-M398 HydrophobicContact CE2-CG 3.81Å; F394-M398 HydrophobicContact CE2-SD 4.1Å; F394-M398 HydrophobicContact CG-CG 4.39Å; F394-M398 HydrophobicContact CZ-CE 4.47Å; F394-M398 HydrophobicContact CZ-CG 3.55Å; F394-M398 HydrophobicContact CZ-SD 4.01Å; F394-M398 WeakPolarHBondContact O-CB 3.45Å; F394-M398 WeakPolarHBondContact O-CG 3.38Å; F394-M398 PolarHBondContact O-N 3.12Å
395R96.6Very high95.8Very high142 Ų14286.6 Ų86.654%0.53640%0.398SS..Hα-helixtrans-57.3-42.8177.2-80.2-179.6-82.9155.8-7.1112.2M391 E392 M398 A399M391-R395 WeakPolarHBondContact O-CB 3.13Å; M391-R395 WeakPolarHBondContact O-CG 3.17Å; M391-R395 PolarHBondContact O-N 3.11Å; M391-R395 PolarHBondContact O-NE 2.99Å; E392-R395 PolarHBondContact O-N 3Å; R395-M398 PolarHBondContact O-N 3.02Å; R395-A399 WeakPolarHBondContact O-CB 3.39Å; R395-A399 PolarHBondContact O-N 3.09Å
396R95.2Very high95.5Very high86 Ų8688.3 Ų88.333%0.32541%0.408SS..Hα-helixtrans-65-43.5177.2-70.4-180-138.4145.84.7112.2E392 G393 F394 A399 A400E392-R396 WeakPolarHBondContact O-CG 3.47Å; E392-R396 PolarHBondContact O-N 3.41Å; E392-R396 IonicContact OE2-CZ 2.77Å; E392-R396 IonicContact OE2-NH2 2.72Å; E392-R396 PolarHBondContact OE2-NH2 3.15Å; G393-R396 PolarHBondContact O-N 3.08Å; F394-R396 VanDerWaalsContact C-N 3.33Å; F394-R396 PolarHBondContact O-N 3.47Å; R396-A399 PolarHBondContact O-N 3.3Å; R396-A400 PolarHBondContact O-N 3.43Å
397I94.6Very high95.4Very high31 Ų3188.9 Ų88.916%0.15941%0.412CS..Hα-helixtrans-61.9-45176-73.1169000110.8G393 F394 A400 R401 P407 A415G393-I397 WeakPolarHBondContact O-CG1 2.95Å; G393-I397 PolarHBondContact O-N 3.04Å; F394-I397 PolarHBondContact O-N 3.45Å; I397-A400 PolarHBondContact O-N 3.07Å; I397-R401 WeakPolarHBondContact O-CG 3.42Å; I397-R401 PolarHBondContact O-N 3.22Å; I397-P407 HydrophobicContact CB-CG 4.46Å; I397-P407 HydrophobicContact CG1-CB 4.27Å; I397-P407 HydrophobicContact CG1-CG 4.46Å; I397-P407 HydrophobicContact CG2-CG 3.88Å; I397-A415 HydrophobicContact CD1-CB 3.77Å
398M95Very high95.3Very high68 Ų6888.8 Ų88.834%0.33541%0.414SS..Hα-helixtrans-65.2-40.9178-70.3-59-7400111.9F394 R395 A400 R401 Q402F394-M398 HydrophobicContact CD1-CG 4.16Å; F394-M398 HydrophobicContact CD2-CG 4.22Å; F394-M398 HydrophobicContact CE1-CG 3.74Å; F394-M398 HydrophobicContact CE2-CG 3.81Å; F394-M398 HydrophobicContact CE2-SD 4.1Å; F394-M398 HydrophobicContact CG-CG 4.39Å; F394-M398 HydrophobicContact CZ-CE 4.47Å; F394-M398 HydrophobicContact CZ-CG 3.55Å; F394-M398 HydrophobicContact CZ-SD 4.01Å; F394-M398 WeakPolarHBondContact O-CB 3.45Å; F394-M398 WeakPolarHBondContact O-CG 3.38Å; F394-M398 PolarHBondContact O-N 3.12Å; R395-M398 PolarHBondContact O-N 3.02Å; M398-A400 VanDerWaalsContact C-N 3.34Å; M398-A400 PolarHBondContact O-N 2.89Å; M398-R401 PolarHBondContact O-N 3.1Å; M398-Q402 WeakPolarHBondContact O-CG 3.49Å; M398-Q402 PolarHBondContact O-N 2.86Å
399A95.4Very high95.2Very high37 Ų3792.2 Ų92.231%0.30642%0.424SS..Hα-helixtrans-62.9-38.5174.900000112.5R395 R396 Q402 K403R395-A399 WeakPolarHBondContact O-CB 3.39Å; R395-A399 PolarHBondContact O-N 3.09Å; R396-A399 PolarHBondContact O-N 3.3Å; A399-Q402 PolarHBondContact O-N 2.86Å; A399-K403 WeakPolarHBondContact O-CG 3.24Å; A399-K403 PolarHBondContact O-N 3.29Å; A399-K403 VanDerWaalsContact O-N 3.15Å
400A94.5Very high95Very high3 Ų396.1 Ų96.13%0.02544%0.44CS..Hα-helixtrans-62.7-45.5173.600000111.3R396 I397 M398 Q402 K403 K404 R405 P407R396-A400 PolarHBondContact O-N 3.43Å; I397-A400 PolarHBondContact O-N 3.07Å; M398-A400 VanDerWaalsContact C-N 3.34Å; M398-A400 PolarHBondContact O-N 2.89Å; A400-Q402 PolarHBondContact O-N 3.49Å; A400-K403 CarbonylContact O-C 3.53Å; A400-K403 PolarHBondContact O-N 3.14Å; A400-K404 PolarHBondContact O-N 3.05Å; A400-R405 CarbonylContact C-O 3.29Å; A400-R405 PolarHBondContact O-N 3.35Å; A400-P407 HydrophobicContact CB-CG 4.31Å
401R93.4Very high94.9Very high164 Ų16496.5 Ų96.562%0.61944%0.44SS*.Hα-helixtrans-62.1-41.5176.7-72.5177.3171.8-175-2.8112.7I397 M398 K403 K404 P407I397-R401 WeakPolarHBondContact O-CG 3.42Å; I397-R401 PolarHBondContact O-N 3.22Å; M398-R401 PolarHBondContact O-N 3.1Å; R401-K403 VanDerWaalsContact C-N 3.26Å; R401-K403 PolarHBondContact O-N 3.01Å; R401-K404 WeakPolarHBondContact O-CA 3.35Å; R401-K404 PolarHBondContact O-N 3.41Å; R401-P407 HydrophobicContact CG-CG 4.47Å
402Q95.5Very high94.7Very high158 Ų15896.7 Ų96.774%0.73844%0.437SS*.Hα-helixtrans-60.5-36.6175-76.4176.1-8.600112.1M398 A399 A400 K404M398-Q402 WeakPolarHBondContact O-CG 3.49Å; M398-Q402 PolarHBondContact O-N 2.86Å; A399-Q402 PolarHBondContact O-N 2.86Å; A400-Q402 PolarHBondContact O-N 3.49Å; Q402-K404 PolarHBondContact O-N 2.7Å
403K96.1Very high94.7Very high170 Ų17096.6 Ų96.674%0.73944%0.44SS*.THydrogen-bonded Turntrans-7712.2173.2-66.1177.7-178.6-1770113.5A399 A400 R401 R405A399-K403 WeakPolarHBondContact O-CG 3.24Å; A399-K403 PolarHBondContact O-N 3.29Å; A399-K403 VanDerWaalsContact O-N 3.15Å; A400-K403 CarbonylContact O-C 3.53Å; A400-K403 PolarHBondContact O-N 3.14Å; R401-K403 VanDerWaalsContact C-N 3.26Å; R401-K403 PolarHBondContact O-N 3.01Å; K403-R405 PolarHBondContact O-N 2.65Å; K403-R405 VanDerWaalsContact O-N 3.08Å
404K94.7Very high94.6Very high205 Ų205101 Ų10189%0.89146%0.46SS*.THydrogen-bonded Turntrans52.127.4-174.8-58.3-177.1179.1-1790113.3A400 R401 Q402A400-K404 PolarHBondContact O-N 3.05Å; R401-K404 WeakPolarHBondContact O-CA 3.35Å; R401-K404 PolarHBondContact O-N 3.41Å; Q402-K404 PolarHBondContact O-N 2.7Å
405R94.8Very high94.6Very high111 Ų11196.1 Ų96.142%0.41944%0.44SS..  trans-107.6136.6178.6-168.9-166.469.5156.3-1.2109.6A400 K403 E411A400-R405 CarbonylContact C-O 3.29Å; A400-R405 PolarHBondContact O-N 3.35Å; K403-R405 PolarHBondContact O-N 2.65Å; K403-R405 VanDerWaalsContact O-N 3.08Å; R405-E411 IonicContact CZ-OE1 2.91Å; R405-E411 IonicContact CZ-OE2 3.66Å; R405-E411 IonicContact NH2-OE1 3.8Å; R405-E411 PolarHBondContact NH2-OE1 3.3Å; R405-E411 IonicContact NH2-OE2 2.6Å; R405-E411 PolarHBondContact NH2-OE2 2.81Å
406T92.1Very high94.6Very high107 Ų10796.7 Ų96.766%0.65644%0.442SS*.PPolyproline II helixtrans-63.6132.8169.9-51.90000110.1T408T406-T408 PolarHBondContact O-N 2.76Å
407P93.2Very high94.7Very high14 Ų1499 Ų999%0.09146%0.455CS..PPolyproline II helixtrans-55.7133.6173-2331.4000110.8I397 A400 R401 E411 K412I397-P407 HydrophobicContact CB-CG 4.46Å; I397-P407 HydrophobicContact CG1-CB 4.27Å; I397-P407 HydrophobicContact CG1-CG 4.46Å; I397-P407 HydrophobicContact CG2-CG 3.88Å; A400-P407 HydrophobicContact CB-CG 4.31Å; R401-P407 HydrophobicContact CG-CG 4.47Å; P407-E411 WeakPolarHBondContact CA-OE2 3.45Å; P407-K412 HydrophobicContact CB-CG 4.13Å; P407-K412 WeakPolarHBondContact O-CE 3.39Å
408T94.5Very high94.7Very high52 Ų5297.7 Ų97.732%0.31945%0.449SS..PPolyproline II helixtrans-65.4156.8179.762.40000110.7T406 K410 E411 K412T406-T408 PolarHBondContact O-N 2.76Å; T408-K410 PolarHBondContact O-N 3.49Å; T408-E411 PolarHBondContact N-OE2 3.22Å; T408-E411 PolarHBondContact O-N 2.83Å; T408-E411 VanDerWaalsContact O-N 3.12Å; T408-E411 WeakPolarHBondContact OG1-CB 3.27Å; T408-E411 WeakPolarHBondContact OG1-CG 3.05Å; T408-E411 PolarHBondContact OG1-N 3.4Å; T408-E411 PolarHBondContact OG1-OE2 3.13Å; T408-K412 PolarHBondContact O-N 3.04Å
409K95.3Very high94.8Very high165 Ų16598.7 Ų98.772%0.71746%0.455SS*.Hα-helixtrans-53-44.5174.1-177.5176.9177.4-176.60111.2E411 K412 D413K409-E411 PolarHBondContact O-N 3.1Å; K409-K412 PolarHBondContact O-N 3.21Å; K409-D413 WeakPolarHBondContact CG-OD2 3.4Å; K409-D413 WeakPolarHBondContact O-CB 3.3Å; K409-D413 PolarHBondContact O-N 3.18Å
410K94.4Very high94.9Very high168 Ų168102.3 Ų102.373%0.7346%0.464SS*.Hα-helixtrans-58.8-42.4177.5-170.6177.2180179.20113.2T408 Q414T408-K410 PolarHBondContact O-N 3.49Å; K410-Q414 VanDerWaalsContact O-CB 3.32Å; K410-Q414 WeakPolarHBondContact O-CB 3.47Å; K410-Q414 PolarHBondContact O-N 3.37Å
411E93.7Very high94.9Very high40 Ų40105.7 Ų105.719%0.18748%0.479CS..Hα-helixtrans-67.1-40.3177.6-72.9159.2164.400112R405 P407 T408 K409 A415R405-E411 IonicContact CZ-OE1 2.91Å; R405-E411 IonicContact CZ-OE2 3.66Å; R405-E411 IonicContact NH2-OE1 3.8Å; R405-E411 PolarHBondContact NH2-OE1 3.3Å; R405-E411 IonicContact NH2-OE2 2.6Å; R405-E411 PolarHBondContact NH2-OE2 2.81Å; P407-E411 WeakPolarHBondContact CA-OE2 3.45Å; T408-E411 PolarHBondContact N-OE2 3.22Å; T408-E411 PolarHBondContact O-N 2.83Å; T408-E411 VanDerWaalsContact O-N 3.12Å; T408-E411 WeakPolarHBondContact OG1-CB 3.27Å; T408-E411 WeakPolarHBondContact OG1-CG 3.05Å; T408-E411 PolarHBondContact OG1-N 3.4Å; T408-E411 PolarHBondContact OG1-OE2 3.13Å; K409-E411 PolarHBondContact O-N 3.1Å; E411-A415 PolarHBondContact O-N 3.34Å; E411-A415 VanDerWaalsContact O-N 3.11Å
412K93.6Very high95.1Very high107 Ų107102.2 Ų102.247%0.46547%0.466SS..Hα-helixtrans-66.4-46.4176-66.4-178.7-177.81790111.6P407 T408 K409 Q414 A415 W416P407-K412 HydrophobicContact CB-CG 4.13Å; P407-K412 WeakPolarHBondContact O-CE 3.39Å; T408-K412 PolarHBondContact O-N 3.04Å; K409-K412 PolarHBondContact O-N 3.21Å; K412-Q414 VanDerWaalsContact C-N 3.3Å; K412-Q414 PolarHBondContact O-N 3.27Å; K412-A415 PolarHBondContact O-N 3.2Å; K412-W416 WeakPolarHBondContact O-CB 3.43Å; K412-W416 PolarHBondContact O-N 2.82Å
413D95.4Very high95.1Very high82 Ų8298.3 Ų98.344%0.43945%0.45SS..Hα-helixtrans-62.6-39.3179.6-68-10000110.9K409 W416 K417K409-D413 WeakPolarHBondContact CG-OD2 3.4Å; K409-D413 WeakPolarHBondContact O-CB 3.3Å; K409-D413 PolarHBondContact O-N 3.18Å; D413-W416 PolarHBondContact O-N 3.01Å; D413-K417 WeakPolarHBondContact O-CB 3.4Å; D413-K417 PolarHBondContact O-N 3.1Å
414Q94.3Very high95.1Very high96 Ų9693.3 Ų93.345%0.44944%0.437SS..Hα-helixtrans-68.1-43.4177.3-169.8165.917.800112.5K410 K412 W416 K417 A418K410-Q414 VanDerWaalsContact O-CB 3.32Å; K410-Q414 WeakPolarHBondContact O-CB 3.47Å; K410-Q414 PolarHBondContact O-N 3.37Å; K412-Q414 VanDerWaalsContact C-N 3.3Å; K412-Q414 PolarHBondContact O-N 3.27Å; Q414-W416 VanDerWaalsContact C-N 3.33Å; Q414-W416 PolarHBondContact O-N 3.33Å; Q414-K417 PolarHBondContact O-N 2.85Å; Q414-A418 PolarHBondContact O-N 3.49Å; Q414-A418 VanDerWaalsContact O-N 3.07Å
415A94.6Very high95.2Very high12 Ų1283.7 Ų83.710%0.09940%0.395CS..Hα-helixtrans-63.1-40.1174.400000112I397 E411 K412 A418 L419I397-A415 HydrophobicContact CD1-CB 3.77Å; E411-A415 PolarHBondContact O-N 3.34Å; E411-A415 VanDerWaalsContact O-N 3.11Å; K412-A415 PolarHBondContact O-N 3.2Å; A415-A418 PolarHBondContact O-N 2.86Å; A415-L419 WeakPolarHBondContact O-CG 2.9Å; A415-L419 PolarHBondContact O-N 3.44Å; A415-L419 VanDerWaalsContact O-N 3.07Å
416W96.1Very high95.2Very high154 Ų15480.5 Ų80.558%0.58339%0.386SS*.Hα-helixtrans-69.5-37.4177.8-170.279.9000112.8K412 D413 Q414 L419 K420K412-W416 WeakPolarHBondContact O-CB 3.43Å; K412-W416 PolarHBondContact O-N 2.82Å; D413-W416 PolarHBondContact O-N 3.01Å; Q414-W416 VanDerWaalsContact C-N 3.33Å; Q414-W416 PolarHBondContact O-N 3.33Å; W416-L419 PolarHBondContact O-N 3.48Å; W416-K420 HydrophobicContact CD2-CD 4.09Å; W416-K420 HydrophobicContact CD2-CG 4.38Å; W416-K420 HydrophobicContact CE3-CD 3.74Å; W416-K420 HydrophobicContact CE3-CG 4.42Å; W416-K420 HydrophobicContact CH2-CD 3.79Å; W416-K420 HydrophobicContact CZ2-CD 4Å; W416-K420 HydrophobicContact CZ3-CD 3.57Å; W416-K420 VanDerWaalsContact CZ3-CE 3.5Å; W416-K420 VanDerWaalsContact CZ3-NZ 3.28Å; W416-K420 PolarHBondContact O-N 3.3Å
417K96.6Very high95.3Very high135 Ų13581.7 Ų81.759%0.58738%0.382SS*.Hα-helixtrans-59.3-47.8172-175.6-174.6174-169.70111D413 Q414 L419 K420 E421D413-K417 WeakPolarHBondContact O-CB 3.4Å; D413-K417 PolarHBondContact O-N 3.1Å; Q414-K417 PolarHBondContact O-N 2.85Å; K417-L419 VanDerWaalsContact C-N 3.33Å; K417-L419 PolarHBondContact O-N 3.44Å; K417-K420 PolarHBondContact O-N 3.15Å; K417-E421 WeakPolarHBondContact O-CB 3.38Å; K417-E421 PolarHBondContact O-N 2.89Å
418A95.7Very high95.3Very high3 Ų385.6 Ų85.63%0.02540%0.402CS..Hα-helixtrans-60.5-42.1178.200000111.9S386 E389 V390 Q414 A415 K420 E421 R422S386-A418 PolarHBondContact OG-O 2.81Å; E389-A418 HydrophobicContact CB-CB 3.89Å; V390-A418 HydrophobicContact CG2-CB 3.79Å; Q414-A418 PolarHBondContact O-N 3.49Å; Q414-A418 VanDerWaalsContact O-N 3.07Å; A415-A418 PolarHBondContact O-N 2.86Å; A418-K420 PolarHBondContact O-N 2.9Å; A418-E421 PolarHBondContact O-N 2.77Å; A418-R422 WeakPolarHBondContact O-CB 3.46Å; A418-R422 PolarHBondContact O-N 3.5Å
419L96.5Very high95.1Very high89 Ų8985.2 Ų85.247%0.46640%0.397SS..Hα-helixtrans-61.3-42.2175.1-75.3170.5000112.8V390 A415 W416 K417 D423V390-L419 HydrophobicContact CG1-CD2 3.85Å; V390-L419 HydrophobicContact CG2-CD2 3.95Å; V390-L419 HydrophobicContact CG2-CG 4.23Å; A415-L419 WeakPolarHBondContact O-CG 2.9Å; A415-L419 PolarHBondContact O-N 3.44Å; A415-L419 VanDerWaalsContact O-N 3.07Å; W416-L419 PolarHBondContact O-N 3.48Å; K417-L419 VanDerWaalsContact C-N 3.33Å; K417-L419 PolarHBondContact O-N 3.44Å; L419-D423 WeakPolarHBondContact O-CB 3.23Å; L419-D423 PolarHBondContact O-N 3.46Å
420K97.3Very high94.6Very high114 Ų11484.1 Ų84.150%0.49640%0.399SS..Hα-helixtrans-66.8-41.2176.8-82.5-170.9156.7-171.80113W416 K417 A418 D423 S424W416-K420 HydrophobicContact CD2-CD 4.09Å; W416-K420 HydrophobicContact CD2-CG 4.38Å; W416-K420 HydrophobicContact CE3-CD 3.74Å; W416-K420 HydrophobicContact CE3-CG 4.42Å; W416-K420 HydrophobicContact CH2-CD 3.79Å; W416-K420 HydrophobicContact CZ2-CD 4Å; W416-K420 HydrophobicContact CZ3-CD 3.57Å; W416-K420 VanDerWaalsContact CZ3-CE 3.5Å; W416-K420 VanDerWaalsContact CZ3-NZ 3.28Å; W416-K420 PolarHBondContact O-N 3.3Å; K417-K420 PolarHBondContact O-N 3.15Å; A418-K420 PolarHBondContact O-N 2.9Å; K420-D423 PolarHBondContact O-N 3.5Å; K420-S424 WeakPolarHBondContact O-CB 3.44Å; K420-S424 PolarHBondContact O-N 3.49Å
421E96.1Very high93.2Very high74 Ų7481.4 Ų81.435%0.34642%0.42SS..Hα-helixtrans-63.8-45.1177.8-177.1160.4-173.600110.6K417 A418 D423 S424 I425K417-E421 WeakPolarHBondContact O-CB 3.38Å; K417-E421 PolarHBondContact O-N 2.89Å; A418-E421 PolarHBondContact O-N 2.77Å; E421-D423 PolarHBondContact O-N 3.42Å; E421-S424 WeakPolarHBondContact O-CB 3.44Å; E421-S424 PolarHBondContact O-N 2.96Å; E421-I425 HydrophobicContact CG-CD1 3.91Å; E421-I425 WeakPolarHBondContact O-CD1 3.5Å; E421-I425 VanDerWaalsContact O-CG1 3.25Å; E421-I425 WeakPolarHBondContact O-CG1 3.38Å; E421-I425 PolarHBondContact O-N 2.86Å
422R96.4Very high93.2Very high90 Ų9083.5 Ų83.534%0.3443%0.431SS..Hα-helixtrans-55.2-51.7172.8-176.4-171.9175.8-89-4.6112S386 D387 A418 S424 I425 L426S386-R422 WeakPolarHBondContact OG-CA 3.49Å; S386-R422 WeakPolarHBondContact OG-CB 3.41Å; S386-R422 PolarHBondContact OG-N 3.15Å; S386-R422 VanDerWaalsContact OG-N 3.11Å; D387-R422 WeakPolarHBondContact OD1-CD 3.44Å; D387-R422 IonicContact OD1-CZ 3.94Å; D387-R422 IonicContact OD1-NE 3.93Å; D387-R422 PolarHBondContact OD1-NE 3.27Å; A418-R422 WeakPolarHBondContact O-CB 3.46Å; A418-R422 PolarHBondContact O-N 3.5Å; R422-S424 VanDerWaalsContact C-N 3.31Å; R422-S424 PolarHBondContact O-N 3.33Å; R422-I425 PolarHBondContact O-N 3.08Å; R422-L426 HydrophobicContact CG-CD1 4.09Å; R422-L426 WeakPolarHBondContact O-CG 3.3Å; R422-L426 PolarHBondContact O-N 3.35Å
423D96.3Very high93.2Very high76 Ų7682.3 Ų82.341%0.40643%0.429SS..Hα-helixtrans-60.1-40.7178.8-174.866000112.1L419 K420 E421 I425 L426 K427L419-D423 WeakPolarHBondContact O-CB 3.23Å; L419-D423 PolarHBondContact O-N 3.46Å; K420-D423 PolarHBondContact O-N 3.5Å; E421-D423 PolarHBondContact O-N 3.42Å; D423-I425 VanDerWaalsContact C-N 3.35Å; D423-I425 PolarHBondContact O-N 3.25Å; D423-L426 PolarHBondContact O-N 3.07Å; D423-K427 WeakPolarHBondContact O-CG 3.38Å; D423-K427 PolarHBondContact O-N 3.46Å; D423-K427 VanDerWaalsContact O-N 3.08Å; D423-K427 WeakPolarHBondContact OD2-CE 3.37Å; D423-K427 IonicContact OD2-NZ 2.7Å; D423-K427 PolarHBondContact OD2-NZ 2.97Å
424S96.6Very high93.1Very high66 Ų6682.3 Ų82.346%0.46243%0.429SS..Hα-helixtrans-63.9-38.1176.3-175.70000112.7K420 E421 R422 L428K420-S424 WeakPolarHBondContact O-CB 3.44Å; K420-S424 PolarHBondContact O-N 3.49Å; E421-S424 WeakPolarHBondContact O-CB 3.44Å; E421-S424 PolarHBondContact O-N 2.96Å; R422-S424 VanDerWaalsContact C-N 3.31Å; R422-S424 PolarHBondContact O-N 3.33Å; S424-L428 WeakPolarHBondContact O-CG 3.31Å; S424-L428 PolarHBondContact O-N 3.19Å
425I95.2Very high93Very high2 Ų281.5 Ų81.51%0.0143%0.428CS..Hα-helixtrans-75.1-38.9179.8-59156.9000110.3L379 R382 V383 E421 R422 D423 K427 L428 L429L379-I425 HydrophobicContact CB-CG2 4.39Å; L379-I425 HydrophobicContact CD2-CG2 4.09Å; R382-I425 HydrophobicContact CB-CD1 3.96Å; R382-I425 HydrophobicContact CB-CG2 4.3Å; V383-I425 HydrophobicContact CG2-CB 3.97Å; V383-I425 HydrophobicContact CG2-CG2 3.36Å; E421-I425 HydrophobicContact CG-CD1 3.91Å; E421-I425 WeakPolarHBondContact O-CD1 3.5Å; E421-I425 VanDerWaalsContact O-CG1 3.25Å; E421-I425 WeakPolarHBondContact O-CG1 3.38Å; E421-I425 PolarHBondContact O-N 2.86Å; R422-I425 PolarHBondContact O-N 3.08Å; D423-I425 VanDerWaalsContact C-N 3.35Å; D423-I425 PolarHBondContact O-N 3.25Å; I425-K427 VanDerWaalsContact C-N 3.33Å; I425-K427 PolarHBondContact O-N 3.23Å; I425-L428 WeakPolarHBondContact O-CB 3.41Å; I425-L428 PolarHBondContact O-N 3.45Å; I425-L429 HydrophobicContact CG2-CD1 4.48Å; I425-L429 PolarHBondContact O-N 2.98Å; I425-L429 VanDerWaalsContact O-N 3.14Å
426L94.4Very high92.9Very high45 Ų4585.8 Ų85.824%0.23645%0.448CS..Hα-helixtrans-60.7-42.1176.2-72.4172.4000111.8V383 R422 D423 L428 L429 D430V383-L426 HydrophobicContact CG1-CD2 4.21Å; V383-L426 HydrophobicContact CG2-CD2 4.14Å; R422-L426 HydrophobicContact CG-CD1 4.09Å; R422-L426 WeakPolarHBondContact O-CG 3.3Å; R422-L426 PolarHBondContact O-N 3.35Å; D423-L426 PolarHBondContact O-N 3.07Å; L426-L428 PolarHBondContact O-N 2.79Å; L426-L429 WeakPolarHBondContact O-CA 3.44Å; L426-L429 WeakPolarHBondContact O-CB 3.47Å; L426-L429 PolarHBondContact O-N 3.3Å; L426-D430 PolarHBondContact O-N 3.49Å
427K94.9Very high92.7Very high132 Ų13281.3 Ų81.357%0.57444%0.439SS*.Hα-helixtrans-59.3-30.2173.4-76169.1175.2161.40114D423 I425 G431D423-K427 WeakPolarHBondContact O-CG 3.38Å; D423-K427 PolarHBondContact O-N 3.46Å; D423-K427 VanDerWaalsContact O-N 3.08Å; D423-K427 WeakPolarHBondContact OD2-CE 3.37Å; D423-K427 IonicContact OD2-NZ 2.7Å; D423-K427 PolarHBondContact OD2-NZ 2.97Å; I425-K427 VanDerWaalsContact C-N 3.33Å; I425-K427 PolarHBondContact O-N 3.23Å; K427-G431 PolarHBondContact O-N 3.31Å
428L92.9Very high92.4Very high95 Ų9577.4 Ų77.450%0.49743%0.429SS..Hα-helixtrans-81.1-16.5175.4-67.4171.9000112.9L379 S424 I425 L426L379-L428 HydrophobicContact CD1-CB 4.25Å; L379-L428 HydrophobicContact CD2-CB 4.35Å; L379-L428 HydrophobicContact CD2-CD1 4.39Å; S424-L428 WeakPolarHBondContact O-CG 3.31Å; S424-L428 PolarHBondContact O-N 3.19Å; I425-L428 WeakPolarHBondContact O-CB 3.41Å; I425-L428 PolarHBondContact O-N 3.45Å; L426-L428 PolarHBondContact O-N 2.79Å
429L89.8Confident92.2Very high44 Ų4483.2 Ų83.223%0.2346%0.46CS..Hα-helixtrans-89.8-32.2174.8-82.5165.9000112.2L379 R380 V383 I425 L426L379-L429 HydrophobicContact CB-CD1 4.22Å; L379-L429 HydrophobicContact CB-CD2 3.61Å; L379-L429 HydrophobicContact CB-CG 3.79Å; L379-L429 HydrophobicContact CD1-CD2 4.14Å; L379-L429 HydrophobicContact CD1-CG 4.29Å; R380-L429 HydrophobicContact CG-CD1 4.22Å; R380-L429 HydrophobicContact CG-CD2 3.98Å; V383-L429 HydrophobicContact CG2-CD1 3.51Å; I425-L429 HydrophobicContact CG2-CD1 4.48Å; I425-L429 PolarHBondContact O-N 2.98Å; I425-L429 VanDerWaalsContact O-N 3.14Å; L426-L429 WeakPolarHBondContact O-CA 3.44Å; L426-L429 WeakPolarHBondContact O-CB 3.47Å; L426-L429 PolarHBondContact O-N 3.3Å
430D85.7Confident91.8Very high142 Ų14282.7 Ų82.776%0.75946%0.459SS*.Hα-helixtrans-82.4-15.7-179.2-65.8-23.2000113.5L426L426-D430 PolarHBondContact O-N 3.49Å
431G65.9Low91.3Very high112 Ų11279.8 Ų79.8100%1.15546%0.456SS*.  trans-101.5017500000111.8K427K427-G431 PolarHBondContact O-N 3.31Å

Retrieved 431 of 431 residues in 2047.1 ms (Link to these results)

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