A0A3Q0KNQ1_SCHMA Loading...

Feline leukemia virus subgroup C receptor-related

AlphaFold DB , UniProt , Accession A0A3Q0KNQ1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 596 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
1M32.8Very low48.1Very low252 Ų252126.8 Ų126.8100%1.24168%0.681SS**  095.40-83.9175.3165.300109
2Q28Very low50.8Low199 Ų199123 Ų12393%0.9366%0.659SS**  trans-91114.9171-79.7172.6-22.400107.6K4Q2-K4 PolarHBondContact O-N 2.68Å
3K34.4Very low53.5Low202 Ų202119.1 Ų119.188%0.87864%0.637SS**  trans-70.1107.2172.1-150.6175.5-173.5-179.20106.3E5K3-E5 PolarHBondContact O-N 3.16Å; K3-E5 VanDerWaalsContact O-N 3.08Å
4K34Very low55.9Low209 Ų209116 Ų11691%0.90961%0.613SS**  trans-51.9115.7170.8-96.8-179.6171.8-179.90107.9Q2Q2-K4 PolarHBondContact O-N 2.68Å
5E38.3Very low58.1Low96 Ų96121.3 Ų121.345%0.44963%0.629SS.*  trans-67.7132.9-175.9-66.9172.9126.200110.5K3 D7K3-E5 PolarHBondContact O-N 3.16Å; K3-E5 VanDerWaalsContact O-N 3.08Å; E5-D7 PolarHBondContact O-N 3.15Å
6A37.3Very low60Low95 Ų95118.3 Ų118.379%0.78561%0.607SS**THydrogen-bonded Turntrans-72.317-166.400000116.9
7D52.7Low61.9Low94 Ų94112.7 Ų112.750%0.50358%0.576SS.*THydrogen-bonded Turntrans-148.714.7-176.2-76.8-44.9000114.3E5 F9 K263E5-D7 PolarHBondContact O-N 3.15Å; D7-F9 PolarHBondContact O-N 2.99Å; D7-K263 WeakPolarHBondContact OD2-CE 3.27Å; D7-K263 IonicContact OD2-NZ 3.22Å; D7-K263 PolarHBondContact OD2-NZ 2.99Å
8G55.4Low63.6Low76 Ų76112.3 Ų112.378%0.78457%0.567SS**SBendtrans66.61.6-17800000115.5
9F67.5Low65.1Low21 Ų21111.2 Ų111.29%0.09256%0.558CS.*  trans-73129.9172.8178-104.2000110.1D7 V11 E256 L259 Y262D7-F9 PolarHBondContact O-N 2.99Å; F9-V11 HydrophobicContact CD1-CG2 4.17Å; F9-V11 HydrophobicContact CE1-CG2 3.56Å; F9-V11 HydrophobicContact CZ-CG2 4.44Å; F9-E256 HydrophobicContact CE2-CB 4.32Å; F9-E256 HydrophobicContact CZ-CB 4.05Å; F9-E256 WeakPolarHBondContact CZ-O 3.04Å; F9-L259 HydrophobicContact CB-CD1 4.16Å; F9-L259 HydrophobicContact CD1-CB 4.24Å; F9-L259 HydrophobicContact CD1-CD1 3.78Å; F9-L259 HydrophobicContact CE1-CB 4.26Å; F9-L259 HydrophobicContact CE1-CD1 4.46Å; F9-L259 HydrophobicContact CG-CD1 4.13Å; F9-Y262 HydrophobicContact CB-CD1 4.48Å; F9-Y262 AromaticContact CD2-CD1 3.9Å; F9-Y262 HydrophobicContact CD2-CD1 3.9Å; F9-Y262 AromaticContact CD2-CD2 3.46Å; F9-Y262 HydrophobicContact CD2-CD2 3.46Å; F9-Y262 VanDerWaalsContact CD2-CD2 3.46Å; F9-Y262 HydrophobicContact CD2-CE1 4.27Å; F9-Y262 AromaticContact CD2-CE2 3.86Å; F9-Y262 HydrophobicContact CD2-CE2 3.86Å; F9-Y262 AromaticContact CD2-CG 3.48Å; F9-Y262 HydrophobicContact CD2-CG 3.48Å; F9-Y262 VanDerWaalsContact CD2-CG 3.48Å; F9-Y262 HydrophobicContact CE2-CD1 4.36Å; F9-Y262 AromaticContact CE2-CD2 3.41Å; F9-Y262 HydrophobicContact CE2-CD2 3.41Å; F9-Y262 VanDerWaalsContact CE2-CD2 3.41Å; F9-Y262 HydrophobicContact CE2-CE2 4.2Å; F9-Y262 AromaticContact CE2-CG 3.5Å; F9-Y262 HydrophobicContact CE2-CG 3.5Å; F9-Y262 HydrophobicContact CG-CD1 4.19Å; F9-Y262 HydrophobicContact CG-CD2 4.49Å; F9-Y262 HydrophobicContact CG-CG 4.12Å; F9-Y262 HydrophobicContact CZ-CD2 4.39Å; F9-Y262 HydrophobicContact CZ-CG 4.14Å
10T70.4Confident66.4Low98 Ų98105.6 Ų105.660%0.60153%0.53SS*.  trans-114.1124.2173.149.50000110I12T10-I12 PolarHBondContact O-N 3.18Å
11V78.2Confident67.7Low53 Ų53100.9 Ų100.932%0.32151%0.506SS..  trans-72.5115.5178.4175.70000110.2F9 L13 P257F9-V11 HydrophobicContact CD1-CG2 4.17Å; F9-V11 HydrophobicContact CE1-CG2 3.56Å; F9-V11 HydrophobicContact CZ-CG2 4.44Å; V11-L13 HydrophobicContact CG1-CD1 4.47Å; V11-L13 HydrophobicContact CG1-CD2 3.94Å; V11-L13 HydrophobicContact CG1-CG 3.99Å; V11-P257 VanDerWaalsContact CG1-O 3.23Å; V11-P257 WeakPolarHBondContact CG1-O 3.27Å
12I81.2Confident70.6Confident81 Ų8193.3 Ų93.342%0.41547%0.47SS..  trans-110124.6172.9-58175.1000110.1T10 Y14T10-I12 PolarHBondContact O-N 3.18Å; I12-Y14 HydrophobicContact CG2-CE1 4.36Å; I12-Y14 HydrophobicContact CG2-CE2 4.23Å
13L85.7Confident73.7Confident72 Ų7283.9 Ų83.938%0.37743%0.426SS..  trans-110.3115.7-177.1-67.8179.5000111V11 P257V11-L13 HydrophobicContact CG1-CD1 4.47Å; V11-L13 HydrophobicContact CG1-CD2 3.94Å; V11-L13 HydrophobicContact CG1-CG 3.99Å; L13-P257 HydrophobicContact CD2-CB 3.65Å
14Y87.3Confident76.6Confident76 Ų7674.3 Ų74.330%0.29838%0.384SS..  trans-86.9132.9-177.6-64.6-83.1000112.1I12 R16 R17 P253 K254 T255I12-Y14 HydrophobicContact CG2-CE1 4.36Å; I12-Y14 HydrophobicContact CG2-CE2 4.23Å; Y14-R16 PolarHBondContact O-N 3.08Å; Y14-R17 WeakPolarHBondContact O-CB 3.45Å; Y14-R17 WeakPolarHBondContact O-CD 3.42Å; Y14-R17 WeakPolarHBondContact O-CG 3.25Å; Y14-R17 PolarHBondContact O-N 2.97Å; Y14-P253 HydrophobicContact CD2-CB 3.76Å; Y14-P253 HydrophobicContact CE2-CB 4.13Å; Y14-K254 HydrophobicContact CE2-CB 4.15Å; Y14-T255 WeakPolarHBondContact CE2-OG1 3.49Å
15K88.5Confident79.5Confident196 Ų19665.2 Ų65.285%0.85235%0.347SS*.THydrogen-bonded Turntrans-52.2-29.6173.1-68.1-171.6178.4-176.30113.5R17 W18K15-R17 PolarHBondContact O-N 2.83Å; K15-R17 VanDerWaalsContact O-N 3.1Å; K15-W18 PolarHBondContact O-N 3.1Å
16R89.1Confident82.2Confident72 Ų7263.2 Ų63.227%0.27234%0.339SS..Hα-helixtrans-57.1-22.4177.1-171.7173.5-174.8146.4-0.4113.9Y14 W18 F19 S20 W165 G248 R250Y14-R16 PolarHBondContact O-N 3.08Å; R16-W18 VanDerWaalsContact C-N 3.26Å; R16-W18 PolarHBondContact O-N 3.28Å; R16-F19 WeakPolarHBondContact O-CA 3.36Å; R16-F19 WeakPolarHBondContact O-CB 3.17Å; R16-F19 PolarHBondContact O-N 3.01Å; R16-S20 PolarHBondContact O-N 3.3Å; R16-S20 PolarHBondContact O-OG 3.41Å; R16-W165 HydrophobicContact CB-CZ3 4.19Å; R16-W165 HydrophobicContact CG-CH2 4.27Å; R16-W165 HydrophobicContact CG-CZ3 4.18Å; R16-G248 PolarHBondContact NE-O 2.93Å; R16-G248 PolarHBondContact NH2-O 3.41Å; R16-R250 VanDerWaalsContact CZ-CD 3.42Å
17R91.4Very high85Confident24 Ų2458.8 Ų58.89%0.09130%0.303CS..Hα-helixtrans-55.1-39.9176.870.1-168.4173.3-177.8-1.7113.4Y14 K15 F19 S20 L21 W165 F166 E170Y14-R17 WeakPolarHBondContact O-CB 3.45Å; Y14-R17 WeakPolarHBondContact O-CD 3.42Å; Y14-R17 WeakPolarHBondContact O-CG 3.25Å; Y14-R17 PolarHBondContact O-N 2.97Å; K15-R17 PolarHBondContact O-N 2.83Å; K15-R17 VanDerWaalsContact O-N 3.1Å; R17-F19 VanDerWaalsContact C-N 3.33Å; R17-S20 PolarHBondContact O-N 3.4Å; R17-L21 PolarHBondContact O-N 2.94Å; R17-W165 HydrophobicContact CB-CB 4.02Å; R17-W165 HydrophobicContact CB-CE3 3.79Å; R17-W165 WeakPolarHBondContact CB-O 3.39Å; R17-F166 HydrophobicContact CB-CE1 4.3Å; R17-F166 HydrophobicContact CB-CE2 4.16Å; R17-F166 HydrophobicContact CB-CZ 4.03Å; R17-F166 HydrophobicContact CG-CD1 4.21Å; R17-F166 HydrophobicContact CG-CE1 3.78Å; R17-F166 HydrophobicContact CG-CZ 3.96Å; R17-E170 IonicContact CZ-OE1 2.72Å; R17-E170 IonicContact CZ-OE2 2.73Å; R17-E170 IonicContact NE-OE2 3.55Å; R17-E170 IonicContact NH1-OE1 3.49Å; R17-E170 IonicContact NH1-OE2 3.6Å; R17-E170 PolarHBondContact NH1-OE2 3.48Å; R17-E170 VanDerWaalsContact NH2-CD 3.27Å; R17-E170 IonicContact NH2-OE1 3.52Å; R17-E170 PolarHBondContact NH2-OE1 2.92Å; R17-E170 IonicContact NH2-OE2 2.74Å; R17-E170 PolarHBondContact NH2-OE2 3Å
18W92.8Very high87.1Confident106 Ų10654.4 Ų54.440%0.40228%0.279SS..Hα-helixtrans-69.7-34.4178.7-68.9110.1000111.4K15 R16 L21 L22 F166 L177K15-W18 PolarHBondContact O-N 3.1Å; R16-W18 VanDerWaalsContact C-N 3.26Å; R16-W18 PolarHBondContact O-N 3.28Å; W18-L21 HydrophobicContact CE3-CD2 4.02Å; W18-L21 HydrophobicContact CZ3-CD2 4.02Å; W18-L21 PolarHBondContact O-N 3.46Å; W18-L22 WeakPolarHBondContact O-CB 3.4Å; W18-L22 PolarHBondContact O-N 3.02Å; W18-F166 AromaticContact CD2-CE1 3.95Å; W18-F166 HydrophobicContact CD2-CE1 3.95Å; W18-F166 HydrophobicContact CD2-CZ 4.39Å; W18-F166 AromaticContact CE2-CE1 3.94Å; W18-F166 HydrophobicContact CE3-CE1 4.03Å; W18-F166 HydrophobicContact CE3-CZ 4.29Å; W18-F166 HydrophobicContact CH2-CE1 4.1Å; W18-F166 HydrophobicContact CZ2-CE1 4.03Å; W18-F166 HydrophobicContact CZ3-CE1 4.11Å; W18-L177 HydrophobicContact CH2-CD1 4.4Å; W18-L177 HydrophobicContact CZ3-CD1 3.68Å
19F92.2Very high89.1Confident90 Ų9052.3 Ų52.340%0.39525%0.249SC..Hα-helixtrans-68.8-41.5172.9-174-113.3000112R16 R17 L21 L22 I23R16-F19 WeakPolarHBondContact O-CA 3.36Å; R16-F19 WeakPolarHBondContact O-CB 3.17Å; R16-F19 PolarHBondContact O-N 3.01Å; R17-F19 VanDerWaalsContact C-N 3.33Å; F19-L21 VanDerWaalsContact C-N 3.31Å; F19-L21 PolarHBondContact O-N 2.98Å; F19-L22 PolarHBondContact O-N 3.04Å; F19-I23 HydrophobicContact CD1-CD1 3.91Å; F19-I23 HydrophobicContact CE1-CD1 3.58Å; F19-I23 HydrophobicContact CE1-CG1 4.45Å; F19-I23 HydrophobicContact CZ-CD1 3.92Å; F19-I23 HydrophobicContact CZ-CG1 4.4Å; F19-I23 WeakPolarHBondContact O-CG1 3.44Å; F19-I23 PolarHBondContact O-N 3.1Å
20S91.8Very high90.5Very high0 Ų051.3 Ų51.30%024%0.244CC..Hα-helixtrans-60.3-41.7172.2-61.30000111.7R16 R17 F24 W165R16-S20 PolarHBondContact O-N 3.3Å; R16-S20 PolarHBondContact O-OG 3.41Å; R17-S20 PolarHBondContact O-N 3.4Å; S20-F24 PolarHBondContact O-N 3.3Å; S20-F24 VanDerWaalsContact O-N 3.09Å; S20-W165 WeakPolarHBondContact OG-CZ2 3.48Å
21L93.1Very high91.8Very high6 Ų646.6 Ų46.63%0.03122%0.216CC..Hα-helixtrans-63.6-44.9174.6-178.762.2000112.1R17 W18 F19 I23 F24 C25 L161 F166 A174 L177R17-L21 PolarHBondContact O-N 2.94Å; W18-L21 HydrophobicContact CE3-CD2 4.02Å; W18-L21 HydrophobicContact CZ3-CD2 4.02Å; W18-L21 PolarHBondContact O-N 3.46Å; F19-L21 VanDerWaalsContact C-N 3.31Å; F19-L21 PolarHBondContact O-N 2.98Å; L21-I23 PolarHBondContact O-N 3.22Å; L21-F24 HydrophobicContact CD1-CD1 4.39Å; L21-F24 WeakPolarHBondContact O-CB 3.41Å; L21-F24 PolarHBondContact O-N 3.42Å; L21-C25 PolarHBondContact O-N 3.04Å; L21-C25 PolarHBondContact O-SG 3.38Å; L21-L161 HydrophobicContact CD1-CD2 3.73Å; L21-F166 HydrophobicContact CB-CE2 4.19Å; L21-F166 HydrophobicContact CB-CZ 3.89Å; L21-F166 HydrophobicContact CD2-CE1 4.43Å; L21-F166 HydrophobicContact CD2-CE2 4.34Å; L21-F166 HydrophobicContact CD2-CZ 3.71Å; L21-F166 HydrophobicContact CG-CZ 4.39Å; L21-A174 HydrophobicContact CD2-CB 4.2Å; L21-L177 HydrophobicContact CD2-CB 4.04Å; L21-L177 HydrophobicContact CD2-CD1 4.09Å
22L94.1Very high92.7Very high94 Ų9444.2 Ų44.249%0.49220%0.201SC..Hα-helixtrans-58.6-45.8176.9179.664.2000112W18 F19 F24 C25 L26W18-L22 WeakPolarHBondContact O-CB 3.4Å; W18-L22 PolarHBondContact O-N 3.02Å; F19-L22 PolarHBondContact O-N 3.04Å; L22-F24 VanDerWaalsContact C-N 3.32Å; L22-F24 PolarHBondContact O-N 2.85Å; L22-C25 PolarHBondContact O-N 2.59Å; L22-L26 HydrophobicContact CD1-CD1 4.49Å; L22-L26 HydrophobicContact CD1-CG 4.45Å; L22-L26 HydrophobicContact CG-CD1 4.28Å; L22-L26 WeakPolarHBondContact O-CG 3.46Å; L22-L26 PolarHBondContact O-N 3.31Å
23I93.2Very high93.5Very high1 Ų140.3 Ų40.31%0.00518%0.181CC..Hα-helixtrans-58.9-46.9176.1-66.8169.4000110.3F19 L21 C25 L26 C27 F244 A245F19-I23 HydrophobicContact CD1-CD1 3.91Å; F19-I23 HydrophobicContact CE1-CD1 3.58Å; F19-I23 HydrophobicContact CE1-CG1 4.45Å; F19-I23 HydrophobicContact CZ-CD1 3.92Å; F19-I23 HydrophobicContact CZ-CG1 4.4Å; F19-I23 WeakPolarHBondContact O-CG1 3.44Å; F19-I23 PolarHBondContact O-N 3.1Å; L21-I23 PolarHBondContact O-N 3.22Å; I23-C25 PolarHBondContact O-N 2.68Å; I23-L26 PolarHBondContact O-N 3.27Å; I23-C27 PolarHBondContact O-N 3.29Å; I23-C27 PolarHBondContact O-SG 2.67Å; I23-C27 VanDerWaalsContact O-SG 3.33Å; I23-F244 HydrophobicContact CD1-CB 4.35Å; I23-F244 WeakPolarHBondContact CD1-O 3.48Å; I23-F244 HydrophobicContact CG1-CB 4.02Å; I23-A245 HydrophobicContact CG2-CB 3.97Å
24F94.3Very high94Very high0 Ų036.9 Ų36.90%016%0.163CC..Hα-helixtrans-59.5-47.3177170.6-102.6000111.9S20 L21 L22 L26 C27 S28 L96 I154 I157 P158 L161S20-F24 PolarHBondContact O-N 3.3Å; S20-F24 VanDerWaalsContact O-N 3.09Å; L21-F24 HydrophobicContact CD1-CD1 4.39Å; L21-F24 WeakPolarHBondContact O-CB 3.41Å; L21-F24 PolarHBondContact O-N 3.42Å; L22-F24 VanDerWaalsContact C-N 3.32Å; L22-F24 PolarHBondContact O-N 2.85Å; F24-L26 VanDerWaalsContact C-N 3.29Å; F24-L26 PolarHBondContact O-N 3.46Å; F24-C27 PolarHBondContact O-N 3Å; F24-S28 WeakPolarHBondContact O-CB 3.23Å; F24-S28 PolarHBondContact O-N 3.22Å; F24-L96 HydrophobicContact CB-CD1 4.46Å; F24-L96 HydrophobicContact CD2-CD1 4.18Å; F24-L96 HydrophobicContact CD2-CD2 3.85Å; F24-L96 HydrophobicContact CE2-CD2 4.33Å; F24-I154 HydrophobicContact CE2-CG2 4.19Å; F24-I154 WeakPolarHBondContact CE2-O 3.47Å; F24-I157 HydrophobicContact CD2-CB 4.15Å; F24-I157 HydrophobicContact CD2-CG2 3.59Å; F24-I157 HydrophobicContact CE2-CB 3.51Å; F24-I157 HydrophobicContact CE2-CD1 4.49Å; F24-I157 HydrophobicContact CE2-CG2 3.47Å; F24-I157 VanDerWaalsContact CE2-CG2 3.47Å; F24-I157 HydrophobicContact CG-CG2 4.31Å; F24-I157 HydrophobicContact CZ-CB 4.03Å; F24-I157 HydrophobicContact CZ-CG2 4.1Å; F24-P158 HydrophobicContact CE1-CB 4.2Å; F24-P158 HydrophobicContact CE1-CG 3.72Å; F24-P158 HydrophobicContact CZ-CB 4.49Å; F24-P158 HydrophobicContact CZ-CG 3.64Å; F24-L161 HydrophobicContact CB-CD2 3.53Å; F24-L161 HydrophobicContact CD1-CD2 3.71Å; F24-L161 HydrophobicContact CD2-CD2 4.48Å; F24-L161 HydrophobicContact CG-CD2 3.61Å
25C95.3Very high94.5Very high19 Ų1934.2 Ų34.213%0.12815%0.153CC..Hα-helixtrans-58.5-41.4177.8-67.60000111.3L21 L22 I23 S28 F29 L177L21-C25 PolarHBondContact O-N 3.04Å; L21-C25 PolarHBondContact O-SG 3.38Å; L22-C25 PolarHBondContact O-N 2.59Å; I23-C25 PolarHBondContact O-N 2.68Å; C25-S28 PolarHBondContact O-N 3Å; C25-F29 WeakPolarHBondContact O-CB 3.48Å; C25-F29 PolarHBondContact O-N 3.39Å; C25-L177 PolarHBondContact SG-O 2.74Å; C25-L177 VanDerWaalsContact SG-O 3.35Å
26L95.4Very high94.9Very high54 Ų5424.9 Ų24.928%0.28311%0.112SC..Hα-helixtrans-67.1-41.5176.8-70.5173.3000112.7L22 I23 F24 S28 F29 G30 P241 F244L22-L26 HydrophobicContact CD1-CD1 4.49Å; L22-L26 HydrophobicContact CD1-CG 4.45Å; L22-L26 HydrophobicContact CG-CD1 4.28Å; L22-L26 WeakPolarHBondContact O-CG 3.46Å; L22-L26 PolarHBondContact O-N 3.31Å; I23-L26 PolarHBondContact O-N 3.27Å; F24-L26 VanDerWaalsContact C-N 3.29Å; F24-L26 PolarHBondContact O-N 3.46Å; L26-S28 VanDerWaalsContact C-N 3.34Å; L26-F29 PolarHBondContact O-N 3Å; L26-G30 PolarHBondContact O-N 3.38Å; L26-P241 HydrophobicContact CB-CB 4.08Å; L26-P241 HydrophobicContact CB-CG 3.96Å; L26-F244 HydrophobicContact CD1-CD2 3.9Å; L26-F244 HydrophobicContact CD1-CE2 4.04Å
27C95.4Very high95.3Very high2 Ų221.5 Ų21.51%0.01410%0.099CC..Hα-helixtrans-61.6-43.9173.5-69.20000111.5I23 F24 N31 P241I23-C27 PolarHBondContact O-N 3.29Å; I23-C27 PolarHBondContact O-SG 2.67Å; I23-C27 VanDerWaalsContact O-SG 3.33Å; F24-C27 PolarHBondContact O-N 3Å; C27-N31 PolarHBondContact O-N 2.84Å; C27-N31 VanDerWaalsContact O-N 3.15Å; C27-P241 HydrophobicContact CB-CB 4.37Å; C27-P241 WeakPolarHBondContact SG-CB 3.39Å
28S96Very high95.6Very high2 Ų220.3 Ų20.31%0.01410%0.095CC..Hα-helixtrans-67.4-41.8179.2-165.40000112F24 C25 L26 N31 A32 N182F24-S28 WeakPolarHBondContact O-CB 3.23Å; F24-S28 PolarHBondContact O-N 3.22Å; C25-S28 PolarHBondContact O-N 3Å; L26-S28 VanDerWaalsContact C-N 3.34Å; S28-N31 PolarHBondContact O-N 3.16Å; S28-A32 VanDerWaalsContact O-CB 3.27Å; S28-A32 WeakPolarHBondContact O-CB 3.5Å; S28-A32 PolarHBondContact O-N 3.01Å; S28-N182 VanDerWaalsContact OG-CB 3.27Å; S28-N182 WeakPolarHBondContact OG-CB 3.5Å; S28-N182 PolarHBondContact OG-ND2 3.02Å
29F97.4Very high95.8Very high31 Ų3115.3 Ų15.314%0.1368%0.076CC..Hα-helixtrans-57.3-51.2173.6179.8-79.1000111.4C25 L26 N31 A32 Y33 G181 L184 G185 F188 L237C25-F29 WeakPolarHBondContact O-CB 3.48Å; C25-F29 PolarHBondContact O-N 3.39Å; L26-F29 PolarHBondContact O-N 3Å; F29-N31 VanDerWaalsContact C-N 3.35Å; F29-N31 PolarHBondContact O-N 3.4Å; F29-A32 PolarHBondContact O-N 3.11Å; F29-Y33 WeakPolarHBondContact O-CB 3.47Å; F29-Y33 PolarHBondContact O-N 3.05Å; F29-G181 WeakPolarHBondContact CA-O 3.37Å; F29-G181 WeakPolarHBondContact CB-O 3.18Å; F29-L184 HydrophobicContact CD2-CB 3.87Å; F29-L184 VanDerWaalsContact CE2-C 3.44Å; F29-L184 HydrophobicContact CE2-CB 3.96Å; F29-L184 WeakPolarHBondContact CE2-O 3.48Å; F29-G185 WeakPolarHBondContact O-CA 3.46Å; F29-F188 HydrophobicContact CE2-CB 4.21Å; F29-F188 AromaticContact CE2-CD2 3.96Å; F29-F188 HydrophobicContact CE2-CD2 3.96Å; F29-F188 HydrophobicContact CE2-CE2 4.48Å; F29-F188 AromaticContact CE2-CG 3.99Å; F29-F188 HydrophobicContact CE2-CG 3.99Å; F29-F188 HydrophobicContact CZ-CB 3.65Å; F29-F188 AromaticContact CZ-CD1 3.82Å; F29-F188 HydrophobicContact CZ-CD1 3.82Å; F29-F188 HydrophobicContact CZ-CD2 4.02Å; F29-F188 HydrophobicContact CZ-CE1 4.47Å; F29-F188 AromaticContact CZ-CG 3.56Å; F29-F188 HydrophobicContact CZ-CG 3.56Å; F29-L237 HydrophobicContact CD1-CD1 3.95Å; F29-L237 HydrophobicContact CD1-CD2 4.03Å; F29-L237 HydrophobicContact CD1-CG 4.28Å; F29-L237 HydrophobicContact CE1-CD1 3.69Å; F29-L237 HydrophobicContact CE1-CD2 3.72Å; F29-L237 HydrophobicContact CE1-CG 4.2Å
30G97.2Very high96Very high0 Ų011 Ų110%06%0.057CC..Hα-helixtrans-60.2-43-179.700000112.5L26 Q34 N238L26-G30 PolarHBondContact O-N 3.38Å; G30-Q34 WeakPolarHBondContact O-CG 3.4Å; G30-Q34 PolarHBondContact O-N 3.25Å; G30-Q34 VanDerWaalsContact O-N 3.13Å; G30-N238 VanDerWaalsContact C-OD1 3.24Å; G30-N238 WeakPolarHBondContact CA-OD1 3.25Å; G30-N238 PolarHBondContact O-OD1 3.33Å
31N97.5Very high96.2Very high0 Ų011 Ų110%06%0.057CC..Hα-helixtrans-66-43.9176.8-172-107.1000112.6C27 S28 F29 Q34 W35 N103 C147 Q151 I154C27-N31 PolarHBondContact O-N 2.84Å; C27-N31 VanDerWaalsContact O-N 3.15Å; S28-N31 PolarHBondContact O-N 3.16Å; F29-N31 VanDerWaalsContact C-N 3.35Å; F29-N31 PolarHBondContact O-N 3.4Å; N31-Q34 PolarHBondContact O-N 3.32Å; N31-W35 PolarHBondContact O-N 2.77Å; N31-W35 VanDerWaalsContact O-N 3.12Å; N31-N103 WeakPolarHBondContact CB-ND2 3.49Å; N31-N103 PolarHBondContact ND2-ND2 3.29Å; N31-N103 PolarHBondContact ND2-OD1 3.32Å; N31-C147 PolarHBondContact ND2-O 3.33Å; N31-Q151 WeakPolarHBondContact OD1-CA 3.45Å; N31-Q151 VanDerWaalsContact OD1-CB 3.31Å; N31-Q151 WeakPolarHBondContact OD1-CB 3.19Å; N31-Q151 WeakPolarHBondContact OD1-CG 3.45Å; N31-I154 HydrophobicContact CB-CD1 3.77Å
32A97.4Very high96.3Very high2 Ų211 Ų112%0.0176%0.058CC..Hα-helixtrans-65.6-37.7178.800000112.8S28 F29 W35 N182 V186S28-A32 VanDerWaalsContact O-CB 3.27Å; S28-A32 WeakPolarHBondContact O-CB 3.5Å; S28-A32 PolarHBondContact O-N 3.01Å; F29-A32 PolarHBondContact O-N 3.11Å; A32-W35 PolarHBondContact O-N 2.91Å; A32-N182 WeakPolarHBondContact CB-O 3.33Å; A32-V186 HydrophobicContact CB-CG2 3.78Å
33Y97.9Very high96.2Very high0 Ų06.9 Ų6.90%04%0.036CC..Hα-helixtrans-58.6-50.1170.7176.3-92.4000110.9F29 W35 I36 H37 G185 F188 G189 V192 F233 S234 L237F29-Y33 WeakPolarHBondContact O-CB 3.47Å; F29-Y33 PolarHBondContact O-N 3.05Å; Y33-W35 PolarHBondContact O-N 3.43Å; Y33-I36 PolarHBondContact O-N 3.25Å; Y33-H37 HydrophobicContact CD1-CB 4.31Å; Y33-H37 AromaticContact CD1-ND1 3.79Å; Y33-H37 HydrophobicContact CD2-CB 4.5Å; Y33-H37 HydrophobicContact CE1-CB 4.02Å; Y33-H37 AromaticContact CE1-CG 3.83Å; Y33-H37 AromaticContact CE1-ND1 3.16Å; Y33-H37 WeakPolarHBondContact CE1-ND1 3.29Å; Y33-H37 HydrophobicContact CE2-CB 4.19Å; Y33-H37 AromaticContact CZ-ND1 3.71Å; Y33-H37 WeakPolarHBondContact O-CB 3.37Å; Y33-H37 PolarHBondContact O-N 3.3Å; Y33-H37 VanDerWaalsContact O-N 3.08Å; Y33-G185 WeakPolarHBondContact CA-O 3.49Å; Y33-F188 HydrophobicContact CD2-CB 4.27Å; Y33-G189 VanDerWaalsContact CD2-CA 3.48Å; Y33-V192 HydrophobicContact CE2-CB 4.1Å; Y33-V192 HydrophobicContact CE2-CG2 4.49Å; Y33-F233 HydrophobicContact CE2-CE1 4.21Å; Y33-F233 AromaticContact CZ-CE1 3.95Å; Y33-S234 WeakPolarHBondContact CE1-OG 3.44Å; Y33-L237 HydrophobicContact CD1-CD2 3.74Å; Y33-L237 HydrophobicContact CD2-CD2 4.28Å; Y33-L237 HydrophobicContact CE1-CD2 4.32Å; Y33-L237 HydrophobicContact CG-CD2 3.72Å
34Q97.6Very high96.3Very high0 Ų06.9 Ų6.90%04%0.036CC..Hα-helixtrans-63-25.9-178.3-67.2-80.217.800113.7G30 N31 H37 Y72 Q144 C147 S234 N238G30-Q34 WeakPolarHBondContact O-CG 3.4Å; G30-Q34 PolarHBondContact O-N 3.25Å; G30-Q34 VanDerWaalsContact O-N 3.13Å; N31-Q34 PolarHBondContact O-N 3.32Å; Q34-H37 PolarHBondContact O-CD2 2.69Å; Q34-H37 VanDerWaalsContact O-CD2 3.27Å; Q34-H37 PolarHBondContact OE1-CE1 3.14Å; Q34-H37 PolarHBondContact OE1-NE2 3Å; Q34-Y72 VanDerWaalsContact C-OH 3.3Å; Q34-Y72 WeakPolarHBondContact CB-OH 3.36Å; Q34-Y72 PolarHBondContact O-OH 3.11Å; Q34-Q144 PolarHBondContact O-NE2 3.47Å; Q34-Q144 PolarHBondContact O-OE1 3.04Å; Q34-C147 HydrophobicContact CB-CB 4.41Å; Q34-S234 PolarHBondContact NE2-O 3.28Å; Q34-S234 PolarHBondContact NE2-OG 2.93Å; Q34-S234 PolarHBondContact OE1-OG 3.4Å; Q34-N238 WeakPolarHBondContact CG-ND2 3.49Å; Q34-N238 PolarHBondContact NE2-ND2 3.3Å
35W97.8Very high96.4Very high20 Ų206.9 Ų6.98%0.0764%0.036CC..Hα-helixtrans-65.4-48.2178.2168.452.4000112.1N31 A32 Y33 S69 Y72 M73 V186 Y405N31-W35 PolarHBondContact O-N 2.77Å; N31-W35 VanDerWaalsContact O-N 3.12Å; A32-W35 PolarHBondContact O-N 2.91Å; Y33-W35 PolarHBondContact O-N 3.43Å; W35-S69 PolarHBondContact NE1-O 3.45Å; W35-Y72 HydrophobicContact CB-CD1 3.78Å; W35-Y72 HydrophobicContact CB-CE1 3.66Å; W35-Y72 HydrophobicContact CB-CG 4.26Å; W35-Y72 AromaticContact CD1-CD1 3.91Å; W35-Y72 AromaticContact CD1-CG 3.62Å; W35-Y72 HydrophobicContact CG-CD1 4.09Å; W35-Y72 HydrophobicContact CG-CE1 4.45Å; W35-Y72 HydrophobicContact CG-CG 4.24Å; W35-Y72 PolarHBondContact N-OH 2.89Å; W35-M73 HydrophobicContact CZ2-CE 4.25Å; W35-V186 HydrophobicContact CE3-CG1 4.39Å; W35-V186 HydrophobicContact CE3-CG2 4.1Å; W35-V186 HydrophobicContact CZ3-CG1 3.94Å; W35-V186 HydrophobicContact CZ3-CG2 4.04Å; W35-Y405 AromaticContact CH2-CD1 3.65Å; W35-Y405 HydrophobicContact CH2-CD1 3.65Å; W35-Y405 HydrophobicContact CH2-CE1 4.07Å; W35-Y405 HydrophobicContact CH2-CG 4.28Å; W35-Y405 AromaticContact CZ2-CD1 4Å; W35-Y405 HydrophobicContact CZ2-CD1 4Å; W35-Y405 HydrophobicContact CZ2-CG 4.17Å
36I97.1Very high96.4Very high0 Ų06.3 Ų6.30%03%0.032CC..Hα-helixtrans-107.6-20.4-166.2-157.362.6000114.5Y33 L38 N39 I40 V186 F190Y33-I36 PolarHBondContact O-N 3.25Å; I36-L38 PolarHBondContact O-N 3.46Å; I36-N39 HydrophobicContact CD1-CB 4.42Å; I36-N39 PolarHBondContact O-N 2.87Å; I36-I40 PolarHBondContact O-N 2.96Å; I36-V186 HydrophobicContact CG2-CG1 4.12Å; I36-F190 HydrophobicContact CD1-CZ 4.17Å; I36-F190 HydrophobicContact CG1-CE1 3.89Å; I36-F190 HydrophobicContact CG1-CE2 3.96Å; I36-F190 HydrophobicContact CG1-CZ 3.55Å; I36-F190 HydrophobicContact CG2-CD2 4.47Å; I36-F190 HydrophobicContact CG2-CE2 4.45Å
37H97.4Very high96.4Very high0 Ų03.8 Ų3.80%02%0.018CC..THydrogen-bonded Turntrans-60-22.5-168.172.5150.5000116.2Y33 Q34 I41 K110 G189 P193 S234Y33-H37 HydrophobicContact CD1-CB 4.31Å; Y33-H37 AromaticContact CD1-ND1 3.79Å; Y33-H37 HydrophobicContact CD2-CB 4.5Å; Y33-H37 HydrophobicContact CE1-CB 4.02Å; Y33-H37 AromaticContact CE1-CG 3.83Å; Y33-H37 AromaticContact CE1-ND1 3.16Å; Y33-H37 WeakPolarHBondContact CE1-ND1 3.29Å; Y33-H37 HydrophobicContact CE2-CB 4.19Å; Y33-H37 AromaticContact CZ-ND1 3.71Å; Y33-H37 WeakPolarHBondContact O-CB 3.37Å; Y33-H37 PolarHBondContact O-N 3.3Å; Y33-H37 VanDerWaalsContact O-N 3.08Å; Q34-H37 PolarHBondContact O-CD2 2.69Å; Q34-H37 VanDerWaalsContact O-CD2 3.27Å; Q34-H37 PolarHBondContact OE1-CE1 3.14Å; Q34-H37 PolarHBondContact OE1-NE2 3Å; H37-I41 WeakPolarHBondContact O-CG1 3.42Å; H37-K110 PolarHBondContact NE2-NZ 3.39Å; H37-G189 WeakPolarHBondContact CA-O 3.21Å; H37-P193 HydrophobicContact CB-CG 3.76Å; H37-P193 WeakPolarHBondContact O-CB 3.34Å; H37-P193 VanDerWaalsContact O-CG 3.24Å; H37-P193 WeakPolarHBondContact O-CG 3.27Å; H37-S234 PolarHBondContact CE1-OG 3.49Å
38L97.5Very high96.4Very high0 Ų03.7 Ų3.70%02%0.018CC..THydrogen-bonded Turntrans-91.4-29.5177.6-71.5162.9000111.9I36 I41 V45 W49 L68 L140 M230I36-L38 PolarHBondContact O-N 3.46Å; L38-I41 HydrophobicContact CD2-CD1 4.45Å; L38-I41 CarbonylContact O-C 3.51Å; L38-I41 WeakPolarHBondContact O-CG1 3.34Å; L38-I41 PolarHBondContact O-N 3.37Å; L38-V45 HydrophobicContact CB-CG2 4.23Å; L38-V45 HydrophobicContact CD2-CG2 3.97Å; L38-V45 WeakPolarHBondContact O-CG2 2.97Å; L38-W49 HydrophobicContact CD2-CH2 4.46Å; L38-W49 HydrophobicContact CD2-CZ3 4.23Å; L38-L68 HydrophobicContact CB-CD1 3.89Å; L38-L68 HydrophobicContact CD1-CD1 4.17Å; L38-L140 HydrophobicContact CD1-CD1 3.81Å; L38-L140 HydrophobicContact CD1-CD2 4.27Å; L38-L140 HydrophobicContact CD1-CG 4.3Å; L38-M230 HydrophobicContact CD2-CE 4Å
39N96.7Very high96.4Very high0 Ų03.6 Ų3.60%02%0.017CC..G310 helixtrans-75.5-30.8-179.2-71.190.2000112.5I36 I41 S42 V65 D66 S69 T409I36-N39 HydrophobicContact CD1-CB 4.42Å; I36-N39 PolarHBondContact O-N 2.87Å; N39-I41 PolarHBondContact O-N 3.07Å; N39-S42 VanDerWaalsContact O-CB 3.31Å; N39-S42 WeakPolarHBondContact O-CB 3.31Å; N39-S42 PolarHBondContact O-N 3.07Å; N39-S42 VanDerWaalsContact O-N 3.14Å; N39-V65 PolarHBondContact ND2-O 3.3Å; N39-D66 WeakPolarHBondContact ND2-CA 3.39Å; N39-S69 WeakPolarHBondContact OD1-CB 3.23Å; N39-S69 PolarHBondContact OD1-N 3.45Å; N39-T409 HydrophobicContact CB-CG2 4.23Å
40I96.4Very high96.2Very high0 Ų02.6 Ų2.60%01%0.013CC..G310 helixtrans-68.2-15.3175.1-168.454.9000114I36 G189 F190 P193 P194 L411 N412I36-I40 PolarHBondContact O-N 2.96Å; I40-G189 WeakPolarHBondContact CG2-O 3.38Å; I40-F190 HydrophobicContact CB-CD1 3.94Å; I40-F190 HydrophobicContact CB-CE1 4.36Å; I40-F190 HydrophobicContact CD1-CD1 3.54Å; I40-F190 HydrophobicContact CD1-CE1 3.89Å; I40-F190 HydrophobicContact CG1-CD1 3.62Å; I40-F190 HydrophobicContact CG1-CE1 4.3Å; I40-P193 HydrophobicContact CG2-CB 4.27Å; I40-P193 HydrophobicContact CG2-CG 4.19Å; I40-P194 HydrophobicContact CG1-CG 3.97Å; I40-P194 HydrophobicContact CG2-CG 4.17Å; I40-L411 HydrophobicContact CD1-CB 4.23Å; I40-L411 HydrophobicContact CD1-CD2 4.15Å; I40-L411 HydrophobicContact CD1-CG 4.39Å; I40-N412 HydrophobicContact CD1-CB 4.33Å; I40-N412 VanDerWaalsContact O-CB 3.24Å; I40-N412 WeakPolarHBondContact O-CB 3.32Å; I40-N412 VanDerWaalsContact O-CG 3.31Å; I40-N412 PolarHBondContact O-ND2 3.36Å
41I95.5Very high95.9Very high0 Ų03.4 Ų3.40%02%0.02CC..G310 helixtrans-11735.217452.7165.1000110.1H37 L38 N39 D43 I44 V45 P193 P194 L197 M227 M230H37-I41 WeakPolarHBondContact O-CG1 3.42Å; L38-I41 HydrophobicContact CD2-CD1 4.45Å; L38-I41 CarbonylContact O-C 3.51Å; L38-I41 WeakPolarHBondContact O-CG1 3.34Å; L38-I41 PolarHBondContact O-N 3.37Å; N39-I41 PolarHBondContact O-N 3.07Å; I41-D43 PolarHBondContact O-N 2.93Å; I41-D43 VanDerWaalsContact O-N 3.13Å; I41-I44 HydrophobicContact CB-CB 4.25Å; I41-I44 HydrophobicContact CB-CD1 4.09Å; I41-I44 HydrophobicContact CB-CG1 4.3Å; I41-I44 HydrophobicContact CG2-CD1 4.02Å; I41-I44 PolarHBondContact O-N 2.94Å; I41-V45 HydrophobicContact CD1-CG2 4.18Å; I41-V45 HydrophobicContact CG1-CG2 4.05Å; I41-V45 PolarHBondContact O-N 3.09Å; I41-P193 HydrophobicContact CD1-CB 3.98Å; I41-P193 HydrophobicContact CG1-CB 4.24Å; I41-P193 HydrophobicContact CG2-CB 3.74Å; I41-P194 HydrophobicContact CG2-CB 4.4Å; I41-P194 HydrophobicContact CG2-CG 3.79Å; I41-L197 HydrophobicContact CD1-CD1 3.37Å; I41-L197 HydrophobicContact CG2-CD1 4.33Å; I41-M227 HydrophobicContact CD1-CE 4.18Å; I41-M230 HydrophobicContact CD1-CE 4.14Å; I41-M230 HydrophobicContact CD1-SD 4.03Å
42S94.8Very high95.7Very high7 Ų74 Ų45%0.0492%0.024CC..Hα-helixtrans-54.8-34.5-172.963.20000113.5N39 V45 L46 N412 S413N39-S42 VanDerWaalsContact O-CB 3.31Å; N39-S42 WeakPolarHBondContact O-CB 3.31Å; N39-S42 PolarHBondContact O-N 3.07Å; N39-S42 VanDerWaalsContact O-N 3.14Å; S42-V45 PolarHBondContact O-N 3.27Å; S42-L46 VanDerWaalsContact O-CB 3.23Å; S42-L46 WeakPolarHBondContact O-CB 3.3Å; S42-L46 PolarHBondContact O-N 3.29Å; S42-N412 PolarHBondContact OG-OD1 3.28Å; S42-S413 PolarHBondContact OG-OG 3.05Å
43D92.9Very high95.6Very high7 Ų74.3 Ų4.34%0.0373%0.025CC..Hα-helixtrans-61.7-43.3173.659.6-49.2000113.1I41 L46 F47 Y202 N412 L416I41-D43 PolarHBondContact O-N 2.93Å; I41-D43 VanDerWaalsContact O-N 3.13Å; D43-L46 PolarHBondContact O-N 3.31Å; D43-F47 WeakPolarHBondContact O-CB 3.4Å; D43-F47 PolarHBondContact O-N 3.1Å; D43-Y202 HydrophobicContact CB-CE2 4.3Å; D43-Y202 WeakPolarHBondContact CB-OH 3.28Å; D43-N412 PolarHBondContact N-OD1 3.4Å; D43-N412 PolarHBondContact OD1-ND2 3.33Å; D43-N412 PolarHBondContact OD1-OD1 2.98Å; D43-L416 HydrophobicContact CB-CD1 3.52Å
44I95.5Very high95.4Very high0 Ų07.9 Ų7.90%05%0.049CC..Hα-helixtrans-73.5-37.5179.1-48.7177.9000110.7I41 L46 F47 F48 L197 I200 V223 M227I41-I44 HydrophobicContact CB-CB 4.25Å; I41-I44 HydrophobicContact CB-CD1 4.09Å; I41-I44 HydrophobicContact CB-CG1 4.3Å; I41-I44 HydrophobicContact CG2-CD1 4.02Å; I41-I44 PolarHBondContact O-N 2.94Å; I44-L46 VanDerWaalsContact C-N 3.34Å; I44-F47 PolarHBondContact O-N 2.95Å; I44-F48 VanDerWaalsContact O-CB 3.23Å; I44-F48 WeakPolarHBondContact O-CB 3.41Å; I44-F48 PolarHBondContact O-N 2.81Å; I44-L197 HydrophobicContact CD1-CB 3.63Å; I44-L197 HydrophobicContact CG2-CD2 3.98Å; I44-I200 HydrophobicContact CG1-CD1 4.46Å; I44-I200 HydrophobicContact CG1-CG1 4.15Å; I44-I200 HydrophobicContact CG2-CD1 4.49Å; I44-V223 HydrophobicContact CG2-CG1 3.67Å; I44-V223 HydrophobicContact CG2-CG2 4.5Å; I44-M227 HydrophobicContact CG2-CE 4.18Å
45V96.6Very high95Very high0 Ų09.7 Ų9.70%07%0.067CC..Hα-helixtrans-62.3-44.7173.4172.70000110.4L38 I41 S42 F48 W49 V65 L68L38-V45 HydrophobicContact CB-CG2 4.23Å; L38-V45 HydrophobicContact CD2-CG2 3.97Å; L38-V45 WeakPolarHBondContact O-CG2 2.97Å; I41-V45 HydrophobicContact CD1-CG2 4.18Å; I41-V45 HydrophobicContact CG1-CG2 4.05Å; I41-V45 PolarHBondContact O-N 3.09Å; S42-V45 PolarHBondContact O-N 3.27Å; V45-F48 PolarHBondContact O-N 3.36Å; V45-W49 HydrophobicContact CB-CE3 4.34Å; V45-W49 HydrophobicContact CG1-CE3 3.8Å; V45-W49 HydrophobicContact CG1-CZ3 4.21Å; V45-W49 HydrophobicContact CG2-CZ3 4.2Å; V45-W49 PolarHBondContact O-N 3.15Å; V45-V65 HydrophobicContact CB-CG1 4.33Å; V45-V65 HydrophobicContact CG1-CG1 3.99Å; V45-V65 HydrophobicContact CG1-CG2 3.91Å; V45-L68 HydrophobicContact CG1-CD1 4.11Å
46L94.6Very high94.4Very high8 Ų814.9 Ų14.94%0.04211%0.106CC..Hα-helixtrans-61.4-46.1176.9-175.568.1000111S42 D43 I44 D50 I53 V58 K61 F122S42-L46 VanDerWaalsContact O-CB 3.23Å; S42-L46 WeakPolarHBondContact O-CB 3.3Å; S42-L46 PolarHBondContact O-N 3.29Å; D43-L46 PolarHBondContact O-N 3.31Å; I44-L46 VanDerWaalsContact C-N 3.34Å; L46-D50 VanDerWaalsContact O-CA 3.24Å; L46-D50 WeakPolarHBondContact O-CA 3.42Å; L46-D50 WeakPolarHBondContact O-CB 3.39Å; L46-D50 PolarHBondContact O-N 3.24Å; L46-D50 VanDerWaalsContact O-N 3.1Å; L46-I53 HydrophobicContact CD1-CD1 4.01Å; L46-V58 HydrophobicContact CD2-CG1 3.9Å; L46-K61 HydrophobicContact CD1-CB 3.5Å; L46-K61 VanDerWaalsContact CD1-CB 3.5Å; L46-K61 HydrophobicContact CD1-CD 4.19Å; L46-K61 HydrophobicContact CD1-CG 4.49Å; L46-F122 HydrophobicContact CD2-CE2 3.71Å; L46-F122 HydrophobicContact CG-CD2 4.19Å; L46-F122 HydrophobicContact CG-CE2 3.82Å
47F94.5Very high94Very high0 Ų017 Ų170%012%0.121CC..Hα-helixtrans-62.1-49.1174.7172.9-95.2000112.3D43 I44 T120 F122 I200 L210 V216 L219 F220 V223D43-F47 WeakPolarHBondContact O-CB 3.4Å; D43-F47 PolarHBondContact O-N 3.1Å; I44-F47 PolarHBondContact O-N 2.95Å; F47-T120 HydrophobicContact CD2-CG2 4.44Å; F47-T120 HydrophobicContact CE1-CG2 4.34Å; F47-T120 HydrophobicContact CE2-CG2 3.78Å; F47-T120 HydrophobicContact CZ-CG2 3.71Å; F47-T120 VanDerWaalsContact O-CB 3.27Å; F47-T120 WeakPolarHBondContact O-CB 3.31Å; F47-T120 PolarHBondContact O-OG1 3.23Å; F47-F122 HydrophobicContact CB-CG 4.41Å; F47-F122 HydrophobicContact CD2-CB 3.81Å; F47-F122 AromaticContact CD2-CD1 3.92Å; F47-F122 HydrophobicContact CD2-CD1 3.92Å; F47-F122 AromaticContact CD2-CG 3.95Å; F47-F122 HydrophobicContact CD2-CG 3.95Å; F47-F122 HydrophobicContact CE2-CB 4.45Å; F47-I200 HydrophobicContact CB-CD1 3.82Å; F47-I200 HydrophobicContact CB-CG1 4.22Å; F47-I200 HydrophobicContact CD1-CD1 3.72Å; F47-I200 HydrophobicContact CD2-CD1 4.22Å; F47-I200 HydrophobicContact CE1-CD1 4.33Å; F47-I200 HydrophobicContact CG-CD1 3.65Å; F47-I200 HydrophobicContact CG-CG1 4.49Å; F47-L210 HydrophobicContact CE2-CD1 4.13Å; F47-L210 HydrophobicContact CE2-CD2 4.49Å; F47-V216 HydrophobicContact CE2-CG1 4.41Å; F47-L219 HydrophobicContact CE1-CD2 4.28Å; F47-L219 HydrophobicContact CE1-CG 4.08Å; F47-L219 HydrophobicContact CE2-CD2 3.82Å; F47-L219 HydrophobicContact CE2-CG 4.42Å; F47-L219 HydrophobicContact CZ-CB 4.29Å; F47-L219 HydrophobicContact CZ-CD2 3.62Å; F47-L219 HydrophobicContact CZ-CG 3.71Å; F47-F220 HydrophobicContact CE1-CB 4.32Å; F47-F220 HydrophobicContact CE1-CD2 4.31Å; F47-F220 HydrophobicContact CZ-CB 4.25Å; F47-V223 HydrophobicContact CD1-CB 4.47Å; F47-V223 HydrophobicContact CD1-CG1 4.29Å; F47-V223 HydrophobicContact CD1-CG2 4.15Å; F47-V223 HydrophobicContact CE1-CB 4.19Å; F47-V223 HydrophobicContact CE1-CG1 4.47Å; F47-V223 HydrophobicContact CE1-CG2 3.89Å
48F95.7Very high93.5Very high0 Ų019.3 Ų19.30%014%0.136CC..Hα-helixtrans-71.4-41.2-171-175.9-118.2000113I44 V45 T117 F220 V223 K224 M227I44-F48 VanDerWaalsContact O-CB 3.23Å; I44-F48 WeakPolarHBondContact O-CB 3.41Å; I44-F48 PolarHBondContact O-N 2.81Å; V45-F48 PolarHBondContact O-N 3.36Å; F48-T117 HydrophobicContact CD1-CG2 4.47Å; F48-T117 HydrophobicContact CD2-CG2 4.39Å; F48-T117 HydrophobicContact CE1-CG2 4.12Å; F48-T117 HydrophobicContact CE2-CG2 4.02Å; F48-T117 HydrophobicContact CZ-CG2 3.88Å; F48-T117 VanDerWaalsContact O-CG2 3.23Å; F48-T117 WeakPolarHBondContact O-CG2 3.25Å; F48-F220 HydrophobicContact CD2-CD2 4.14Å; F48-F220 AromaticContact CD2-CE2 3.51Å; F48-F220 HydrophobicContact CD2-CE2 3.51Å; F48-F220 HydrophobicContact CD2-CZ 4Å; F48-F220 HydrophobicContact CE2-CD2 4.48Å; F48-F220 HydrophobicContact CE2-CE1 4.45Å; F48-F220 AromaticContact CE2-CE2 3.63Å; F48-F220 HydrophobicContact CE2-CE2 3.63Å; F48-F220 AromaticContact CE2-CZ 3.59Å; F48-F220 HydrophobicContact CE2-CZ 3.59Å; F48-V223 HydrophobicContact CB-CG1 4.04Å; F48-V223 HydrophobicContact CD2-CG1 3.94Å; F48-V223 HydrophobicContact CG-CG1 4.19Å; F48-K224 HydrophobicContact CE2-CB 3.65Å; F48-K224 HydrophobicContact CE2-CD 4.43Å; F48-K224 HydrophobicContact CE2-CG 3.86Å; F48-K224 HydrophobicContact CZ-CB 4.25Å; F48-K224 HydrophobicContact CZ-CG 4Å; F48-M227 HydrophobicContact CB-CE 4.47Å; F48-M227 HydrophobicContact CD1-CE 4.25Å; F48-M227 HydrophobicContact CD1-CG 3.92Å; F48-M227 HydrophobicContact CE1-CB 4.45Å; F48-M227 HydrophobicContact CE1-CG 3.81Å; F48-M227 HydrophobicContact CZ-CG 4.43Å
49W95.7Very high93.1Very high0 Ų021.6 Ų21.60%015%0.148CC..Hα-helixtrans-103.110.9-177.7-78.3-68.8000114.4L38 V45 A51 S52 I53 A113 T117 F137 L140 M227 L231L38-W49 HydrophobicContact CD2-CH2 4.46Å; L38-W49 HydrophobicContact CD2-CZ3 4.23Å; V45-W49 HydrophobicContact CB-CE3 4.34Å; V45-W49 HydrophobicContact CG1-CE3 3.8Å; V45-W49 HydrophobicContact CG1-CZ3 4.21Å; V45-W49 HydrophobicContact CG2-CZ3 4.2Å; V45-W49 PolarHBondContact O-N 3.15Å; W49-A51 PolarHBondContact O-N 3.17Å; W49-S52 PolarHBondContact O-N 3.05Å; W49-S52 PolarHBondContact O-OG 3.44Å; W49-I53 HydrophobicContact CB-CD1 4.06Å; W49-I53 HydrophobicContact CB-CG1 4Å; W49-I53 WeakPolarHBondContact O-CG1 3.5Å; W49-I53 PolarHBondContact O-N 3.38Å; W49-I53 VanDerWaalsContact O-N 3.12Å; W49-A113 PolarHBondContact NE1-O 3.36Å; W49-T117 VanDerWaalsContact CD1-OG1 3.25Å; W49-T117 PolarHBondContact NE1-OG1 2.9Å; W49-T117 VanDerWaalsContact NE1-OG1 3.07Å; W49-F137 HydrophobicContact CB-CB 4.23Å; W49-F137 HydrophobicContact CB-CD2 4.33Å; W49-F137 HydrophobicContact CG-CB 4.45Å; W49-L140 HydrophobicContact CD2-CD2 4.08Å; W49-L140 HydrophobicContact CE3-CD2 3.88Å; W49-L140 HydrophobicContact CH2-CD1 4.01Å; W49-L140 HydrophobicContact CH2-CD2 3.94Å; W49-L140 HydrophobicContact CZ2-CD1 4.13Å; W49-L140 HydrophobicContact CZ2-CD2 4.14Å; W49-L140 HydrophobicContact CZ3-CD2 3.81Å; W49-M227 HydrophobicContact CH2-CE 4.27Å; W49-M227 HydrophobicContact CH2-CG 4.06Å; W49-M227 HydrophobicContact CH2-SD 3.87Å; W49-M227 HydrophobicContact CZ3-CE 3.88Å; W49-M227 HydrophobicContact CZ3-SD 4.05Å; W49-L231 HydrophobicContact CH2-CD1 4.33Å; W49-L231 HydrophobicContact CZ2-CD1 4.43Å
50D93.5Very high92.8Very high10 Ų1024 Ų245%0.05316%0.162CC..THydrogen-bonded Turntrans-43.4-43.9-173-172.366.3000114L46 S52 K61 T121 F122L46-D50 VanDerWaalsContact O-CA 3.24Å; L46-D50 WeakPolarHBondContact O-CA 3.42Å; L46-D50 WeakPolarHBondContact O-CB 3.39Å; L46-D50 PolarHBondContact O-N 3.24Å; L46-D50 VanDerWaalsContact O-N 3.1Å; D50-S52 PolarHBondContact O-N 3.07Å; D50-K61 PolarHBondContact O-NZ 3.28Å; D50-K61 WeakPolarHBondContact OD1-CD 3.5Å; D50-K61 IonicContact OD1-NZ 3.13Å; D50-K61 PolarHBondContact OD1-NZ 3.35Å; D50-K61 IonicContact OD2-NZ 2.73Å; D50-K61 PolarHBondContact OD2-NZ 2.92Å; D50-T121 PolarHBondContact OD2-OG1 3.05Å; D50-F122 HydrophobicContact CB-CB 3.99Å; D50-F122 HydrophobicContact CB-CD2 4.43Å; D50-F122 PolarHBondContact OD2-N 3.49Å
51A91.4Very high92.7Very high18 Ų1825.3 Ų25.315%0.14917%0.168CC..THydrogen-bonded Turntrans-60.3-26.2-18000000115.2W49 T121 I129W49-A51 PolarHBondContact O-N 3.17Å; A51-T121 VanDerWaalsContact CA-OG1 3.31Å; A51-T121 WeakPolarHBondContact CA-OG1 3.41Å; A51-T121 HydrophobicContact CB-CG2 4.23Å; A51-T121 PolarHBondContact N-OG1 2.84Å; A51-I129 HydrophobicContact CB-CD1 3.76Å; A51-I129 HydrophobicContact CB-CG2 4.22Å
52S94.4Very high92.6Very high12 Ų1226 Ų268%0.08417%0.172CC..THydrogen-bonded Turntrans-115.6-12.8-171.461.70000113.8W49 D50 H133 K134 F137W49-S52 PolarHBondContact O-N 3.05Å; W49-S52 PolarHBondContact O-OG 3.44Å; D50-S52 PolarHBondContact O-N 3.07Å; S52-H133 WeakPolarHBondContact CB-O 3.27Å; S52-K134 WeakPolarHBondContact CB-O 3.43Å; S52-F137 WeakPolarHBondContact OG-CB 3.4Å; S52-F137 PolarHBondContact OG-N 3.45Å
53I95.1Very high92.6Very high8 Ų827.3 Ų27.34%0.04118%0.179CC..SBendtrans-71.3126.8177.1-64.4164.4000108.6L46 W49 G55 K61 V65 F137L46-I53 HydrophobicContact CD1-CD1 4.01Å; W49-I53 HydrophobicContact CB-CD1 4.06Å; W49-I53 HydrophobicContact CB-CG1 4Å; W49-I53 WeakPolarHBondContact O-CG1 3.5Å; W49-I53 PolarHBondContact O-N 3.38Å; W49-I53 VanDerWaalsContact O-N 3.12Å; I53-G55 PolarHBondContact O-N 3.08Å; I53-K61 HydrophobicContact CB-CB 4.36Å; I53-K61 HydrophobicContact CB-CD 4.27Å; I53-K61 HydrophobicContact CB-CG 4.19Å; I53-K61 HydrophobicContact CG2-CB 3.6Å; I53-K61 HydrophobicContact CG2-CD 4.37Å; I53-K61 HydrophobicContact CG2-CG 3.77Å; I53-V65 HydrophobicContact CD1-CG2 3.94Å; I53-F137 HydrophobicContact CB-CG 4.41Å; I53-F137 HydrophobicContact CD1-CD2 4.33Å; I53-F137 HydrophobicContact CG1-CB 4.04Å; I53-F137 HydrophobicContact CG1-CD1 4.39Å; I53-F137 HydrophobicContact CG1-CD2 3.5Å; I53-F137 HydrophobicContact CG1-CE2 4.01Å; I53-F137 HydrophobicContact CG1-CG 3.72Å
54P93Very high92.7Very high76 Ų7627.9 Ų27.949%0.49418%0.183SC..SBendtrans-66.9130176.224.8-29.4000110.6S64P54-S64 PolarHBondContact O-OG 3.36Å
55G89.1Confident92.8Very high38 Ų3828 Ų2839%0.39218%0.183SC..  trans144.7144.6179.800000111.8I53 T60 K61I53-G55 PolarHBondContact O-N 3.08Å; G55-T60 VanDerWaalsContact CA-OG1 3.3Å; G55-T60 WeakPolarHBondContact CA-OG1 3.31Å; G55-K61 WeakPolarHBondContact O-CE 2.99Å
56S85.3Confident92.8Very high128 Ų12828 Ų2890%0.89518%0.184SC*.SBendtrans-91.5-19.1175.954.30000113T60S56-T60 PolarHBondContact N-OG1 2.88Å
57S88.1Confident92.9Very high44 Ų4431.2 Ų31.231%0.30820%0.195SC..SBendtrans-122.8158.3-179.1680000111.1D59 T60 K61S57-D59 PolarHBondContact O-N 2.95Å; S57-T60 PolarHBondContact N-OG1 3.42Å; S57-T60 VanDerWaalsContact N-OG1 3.1Å; S57-T60 PolarHBondContact O-N 2.79Å; S57-T60 PolarHBondContact O-OG1 2.78Å; S57-T60 PolarHBondContact OG-N 2.83Å; S57-T60 PolarHBondContact OG-OG1 3.38Å; S57-K61 WeakPolarHBondContact O-CG 3.29Å; S57-K61 PolarHBondContact O-N 3.28Å
58V87.5Confident93.1Very high50 Ų5031.2 Ų31.230%0.30320%0.195SC..Hα-helixtrans-54.8-38173169.60000111.4L46 K61 T62L46-V58 HydrophobicContact CD2-CG1 3.9Å; V58-K61 PolarHBondContact O-N 3.31Å; V58-T62 WeakPolarHBondContact O-CB 3.42Å; V58-T62 PolarHBondContact O-N 3.01Å; V58-T62 PolarHBondContact O-OG1 3.2Å
59D88.1Confident93.2Very high47 Ų4731.2 Ų31.225%0.25120%0.195SC..Hα-helixtrans-63.1-48.4179.2-57.6-19.7000112.2S57 K61 T62 I63 T541 H542S57-D59 PolarHBondContact O-N 2.95Å; D59-K61 VanDerWaalsContact C-N 3.34Å; D59-K61 PolarHBondContact O-N 3.03Å; D59-T62 WeakPolarHBondContact O-CB 3.37Å; D59-T62 PolarHBondContact O-N 3.25Å; D59-I63 PolarHBondContact O-N 3.26Å; D59-I63 VanDerWaalsContact O-N 3.11Å; D59-T541 HydrophobicContact CB-CG2 4.26Å; D59-H542 IonicContact OD2-CE1 2.92Å; D59-H542 IonicContact OD2-ND1 3.47Å
60T91.8Very high93.3Very high51 Ų5131.3 Ų31.331%0.31320%0.196SC..Hα-helixtrans-67.2-37.3178.9500000111.5G55 S56 S57 T62 I63 S64G55-T60 VanDerWaalsContact CA-OG1 3.3Å; G55-T60 WeakPolarHBondContact CA-OG1 3.31Å; S56-T60 PolarHBondContact N-OG1 2.88Å; S57-T60 PolarHBondContact N-OG1 3.42Å; S57-T60 VanDerWaalsContact N-OG1 3.1Å; S57-T60 PolarHBondContact O-N 2.79Å; S57-T60 PolarHBondContact O-OG1 2.78Å; S57-T60 PolarHBondContact OG-N 2.83Å; S57-T60 PolarHBondContact OG-OG1 3.38Å; T60-T62 VanDerWaalsContact C-N 3.33Å; T60-T62 PolarHBondContact O-N 3.01Å; T60-I63 PolarHBondContact O-N 2.99Å; T60-S64 PolarHBondContact O-N 2.97Å; T60-S64 VanDerWaalsContact O-N 3.15Å; T60-S64 PolarHBondContact O-OG 3.25Å
61K93.9Very high93.5Very high27 Ų2731.6 Ų31.612%0.11720%0.197CC..Hα-helixtrans-64.7-36.2172.5-68.5-172-172.4-169.40112.3L46 D50 I53 G55 S57 V58 D59 S64 V65L46-K61 HydrophobicContact CD1-CB 3.5Å; L46-K61 VanDerWaalsContact CD1-CB 3.5Å; L46-K61 HydrophobicContact CD1-CD 4.19Å; L46-K61 HydrophobicContact CD1-CG 4.49Å; D50-K61 PolarHBondContact O-NZ 3.28Å; D50-K61 WeakPolarHBondContact OD1-CD 3.5Å; D50-K61 IonicContact OD1-NZ 3.13Å; D50-K61 PolarHBondContact OD1-NZ 3.35Å; D50-K61 IonicContact OD2-NZ 2.73Å; D50-K61 PolarHBondContact OD2-NZ 2.92Å; I53-K61 HydrophobicContact CB-CB 4.36Å; I53-K61 HydrophobicContact CB-CD 4.27Å; I53-K61 HydrophobicContact CB-CG 4.19Å; I53-K61 HydrophobicContact CG2-CB 3.6Å; I53-K61 HydrophobicContact CG2-CD 4.37Å; I53-K61 HydrophobicContact CG2-CG 3.77Å; G55-K61 WeakPolarHBondContact O-CE 2.99Å; S57-K61 WeakPolarHBondContact O-CG 3.29Å; S57-K61 PolarHBondContact O-N 3.28Å; V58-K61 PolarHBondContact O-N 3.31Å; D59-K61 VanDerWaalsContact C-N 3.34Å; D59-K61 PolarHBondContact O-N 3.03Å; K61-S64 WeakPolarHBondContact O-CB 3.38Å; K61-S64 PolarHBondContact O-N 3.38Å; K61-V65 WeakPolarHBondContact O-CG2 3.25Å; K61-V65 PolarHBondContact O-N 2.84Å
62T93.6Very high93.8Very high14 Ų1430.7 Ų30.79%0.08619%0.19CC..Hα-helixtrans-63.6-43.3176.2-58.60000111.5V58 D59 T60 S64 V65 D66 T537 R540 T541V58-T62 WeakPolarHBondContact O-CB 3.42Å; V58-T62 PolarHBondContact O-N 3.01Å; V58-T62 PolarHBondContact O-OG1 3.2Å; D59-T62 WeakPolarHBondContact O-CB 3.37Å; D59-T62 PolarHBondContact O-N 3.25Å; T60-T62 VanDerWaalsContact C-N 3.33Å; T60-T62 PolarHBondContact O-N 3.01Å; T62-S64 VanDerWaalsContact C-N 3.27Å; T62-S64 PolarHBondContact O-N 3Å; T62-V65 WeakPolarHBondContact O-CB 3.3Å; T62-V65 PolarHBondContact O-N 3.35Å; T62-V65 VanDerWaalsContact O-N 3.1Å; T62-D66 PolarHBondContact O-N 3.02Å; T62-T537 HydrophobicContact CG2-CG2 4.26Å; T62-R540 VanDerWaalsContact CG2-NH2 3.32Å; T62-T541 HydrophobicContact CG2-CG2 4.24Å
63I94.3Very high93.9Very high36 Ų3630.1 Ų30.119%0.18519%0.186CC..Hα-helixtrans-58-43.2172.9-63.3165.3000110.4D59 T60 V65 D66 W67 T537 P538D59-I63 PolarHBondContact O-N 3.26Å; D59-I63 VanDerWaalsContact O-N 3.11Å; T60-I63 PolarHBondContact O-N 2.99Å; I63-V65 VanDerWaalsContact C-N 3.33Å; I63-V65 PolarHBondContact O-N 3.44Å; I63-D66 PolarHBondContact O-N 3.3Å; I63-W67 PolarHBondContact O-N 2.89Å; I63-T537 HydrophobicContact CB-CG2 4.37Å; I63-T537 HydrophobicContact CG1-CG2 3.52Å; I63-P538 HydrophobicContact CD1-CG 3.97Å
64S95.8Very high94Very high19 Ų1933.3 Ų33.313%0.13320%0.203CC..Hα-helixtrans-60.8-39.5175.7-61.60000112.3P54 T60 K61 T62 W67 F137P54-S64 PolarHBondContact O-OG 3.36Å; T60-S64 PolarHBondContact O-N 2.97Å; T60-S64 VanDerWaalsContact O-N 3.15Å; T60-S64 PolarHBondContact O-OG 3.25Å; K61-S64 WeakPolarHBondContact O-CB 3.38Å; K61-S64 PolarHBondContact O-N 3.38Å; T62-S64 VanDerWaalsContact C-N 3.27Å; T62-S64 PolarHBondContact O-N 3Å; S64-W67 WeakPolarHBondContact O-CB 3.47Å; S64-W67 PolarHBondContact O-N 3.47Å; S64-F137 VanDerWaalsContact O-CZ 3.29Å; S64-F137 WeakPolarHBondContact O-CZ 3.46Å
65V97.1Very high94.2Very high1 Ų130.4 Ų30.41%0.00618%0.183CC..Hα-helixtrans-64.7-38.5174173.20000111.6N39 V45 I53 K61 T62 I63 W67 L68 F137N39-V65 PolarHBondContact ND2-O 3.3Å; V45-V65 HydrophobicContact CB-CG1 4.33Å; V45-V65 HydrophobicContact CG1-CG1 3.99Å; V45-V65 HydrophobicContact CG1-CG2 3.91Å; I53-V65 HydrophobicContact CD1-CG2 3.94Å; K61-V65 WeakPolarHBondContact O-CG2 3.25Å; K61-V65 PolarHBondContact O-N 2.84Å; T62-V65 WeakPolarHBondContact O-CB 3.3Å; T62-V65 PolarHBondContact O-N 3.35Å; T62-V65 VanDerWaalsContact O-N 3.1Å; I63-V65 VanDerWaalsContact C-N 3.33Å; I63-V65 PolarHBondContact O-N 3.44Å; V65-W67 PolarHBondContact O-N 2.97Å; V65-L68 HydrophobicContact CG1-CD1 4.36Å; V65-L68 VanDerWaalsContact O-CB 3.25Å; V65-L68 WeakPolarHBondContact O-CB 3.46Å; V65-L68 WeakPolarHBondContact O-CG 3.32Å; V65-L68 PolarHBondContact O-N 3.24Å; V65-F137 HydrophobicContact CG2-CE2 4.45Å
66D96.8Very high94.4Very high1 Ų128.6 Ų28.61%0.00517%0.165CC..Hα-helixtrans-63.7-28.7177.5-69.1-25.7000112.9N39 T62 I63 L68 S69 M70 T409 L410 I533 T537N39-D66 WeakPolarHBondContact ND2-CA 3.39Å; T62-D66 PolarHBondContact O-N 3.02Å; I63-D66 PolarHBondContact O-N 3.3Å; D66-L68 PolarHBondContact O-N 3.07Å; D66-L68 VanDerWaalsContact O-N 3.14Å; D66-S69 PolarHBondContact O-N 3.48Å; D66-S69 PolarHBondContact O-OG 2.9Å; D66-M70 HydrophobicContact CB-SD 4.39Å; D66-M70 PolarHBondContact O-N 3.29Å; D66-M70 VanDerWaalsContact O-N 3.13Å; D66-T409 HydrophobicContact CB-CG2 4.46Å; D66-L410 VanDerWaalsContact OD2-CD2 3.28Å; D66-L410 WeakPolarHBondContact OD2-CD2 3.5Å; D66-I533 HydrophobicContact CB-CG2 4.07Å; D66-T537 WeakPolarHBondContact OD2-CB 3.48Å; D66-T537 WeakPolarHBondContact OD2-CG2 3.3Å; D66-T537 PolarHBondContact OD2-OG1 3.24Å
67W97.4Very high94.9Very high75 Ų7524.6 Ų24.628%0.28413%0.133SC..Hα-helixtrans-59.5-22.3172.7-84.699.8000114.2I63 S64 V65 S69 M70 I71 L74 M141 L530I63-W67 PolarHBondContact O-N 2.89Å; S64-W67 WeakPolarHBondContact O-CB 3.47Å; S64-W67 PolarHBondContact O-N 3.47Å; V65-W67 PolarHBondContact O-N 2.97Å; W67-S69 PolarHBondContact O-N 3.39Å; W67-M70 HydrophobicContact CD2-CB 4.4Å; W67-M70 HydrophobicContact CD2-CE 4.35Å; W67-M70 HydrophobicContact CD2-SD 4.44Å; W67-M70 HydrophobicContact CE3-CB 4Å; W67-M70 HydrophobicContact CH2-CE 4.32Å; W67-M70 HydrophobicContact CZ2-CE 4.09Å; W67-M70 HydrophobicContact CZ3-CB 4.44Å; W67-M70 PolarHBondContact O-N 3.01Å; W67-I71 WeakPolarHBondContact O-CB 3.34Å; W67-I71 WeakPolarHBondContact O-CG2 3.39Å; W67-I71 PolarHBondContact O-N 3.23Å; W67-L74 HydrophobicContact CH2-CD2 4.47Å; W67-L74 HydrophobicContact CZ3-CD2 3.91Å; W67-M141 HydrophobicContact CB-CE 4.01Å; W67-L530 HydrophobicContact CZ3-CD1 4.43Å
68L97.9Very high95.1Very high0 Ų026 Ų260%014%0.141CC..Hα-helixtrans-58.6-37.3172.6-66.3170.2000111.3L38 V45 V65 D66 I71 F137 L140 M141 Q144L38-L68 HydrophobicContact CB-CD1 3.89Å; L38-L68 HydrophobicContact CD1-CD1 4.17Å; V45-L68 HydrophobicContact CG1-CD1 4.11Å; V65-L68 HydrophobicContact CG1-CD1 4.36Å; V65-L68 VanDerWaalsContact O-CB 3.25Å; V65-L68 WeakPolarHBondContact O-CB 3.46Å; V65-L68 WeakPolarHBondContact O-CG 3.32Å; V65-L68 PolarHBondContact O-N 3.24Å; D66-L68 PolarHBondContact O-N 3.07Å; D66-L68 VanDerWaalsContact O-N 3.14Å; L68-I71 WeakPolarHBondContact O-CG2 3.35Å; L68-F137 HydrophobicContact CD1-CE2 4.12Å; L68-F137 HydrophobicContact CD2-CE2 4.31Å; L68-F137 HydrophobicContact CD2-CZ 4.36Å; L68-F137 HydrophobicContact CG-CE2 4.24Å; L68-F137 HydrophobicContact CG-CZ 4.3Å; L68-L140 HydrophobicContact CD1-CD2 4.08Å; L68-L140 HydrophobicContact CD2-CD2 3.95Å; L68-L140 HydrophobicContact CD2-CG 4.06Å; L68-M141 HydrophobicContact CD2-SD 3.97Å; L68-Q144 HydrophobicContact CB-CG 4.28Å; L68-Q144 HydrophobicContact CD2-CB 4.11Å; L68-Q144 HydrophobicContact CD2-CG 4.06Å; L68-Q144 WeakPolarHBondContact O-CG 3.3Å; L68-Q144 PolarHBondContact O-NE2 3.19Å
69S97.3Very high95.4Very high0 Ų026 Ų260%014%0.139CC..Hα-helixtrans-85.1-41.2173.871.50000112.2W35 N39 D66 W67 I71 Y72 T409W35-S69 PolarHBondContact NE1-O 3.45Å; N39-S69 WeakPolarHBondContact OD1-CB 3.23Å; N39-S69 PolarHBondContact OD1-N 3.45Å; D66-S69 PolarHBondContact O-N 3.48Å; D66-S69 PolarHBondContact O-OG 2.9Å; W67-S69 PolarHBondContact O-N 3.39Å; S69-I71 PolarHBondContact O-N 2.95Å; S69-Y72 WeakPolarHBondContact O-CB 3.14Å; S69-Y72 PolarHBondContact O-N 3.44Å; S69-T409 WeakPolarHBondContact CB-OG1 3.46Å; S69-T409 WeakPolarHBondContact OG-CG2 3.25Å; S69-T409 PolarHBondContact OG-OG1 2.9Å
70M97.6Very high95.4Very high2 Ų224.1 Ų24.11%0.0113%0.129CC..Hα-helixtrans-66-26.8-174.4-65.6168.562.500112.7D66 W67 Y72 M73 L74 L530 I533 H534D66-M70 HydrophobicContact CB-SD 4.39Å; D66-M70 PolarHBondContact O-N 3.29Å; D66-M70 VanDerWaalsContact O-N 3.13Å; W67-M70 HydrophobicContact CD2-CB 4.4Å; W67-M70 HydrophobicContact CD2-CE 4.35Å; W67-M70 HydrophobicContact CD2-SD 4.44Å; W67-M70 HydrophobicContact CE3-CB 4Å; W67-M70 HydrophobicContact CH2-CE 4.32Å; W67-M70 HydrophobicContact CZ2-CE 4.09Å; W67-M70 HydrophobicContact CZ3-CB 4.44Å; W67-M70 PolarHBondContact O-N 3.01Å; M70-Y72 PolarHBondContact O-N 3.49Å; M70-M73 WeakPolarHBondContact O-CB 3.34Å; M70-M73 PolarHBondContact O-N 3.49Å; M70-L74 PolarHBondContact O-N 3.03Å; M70-L530 HydrophobicContact CB-CD1 3.73Å; M70-L530 HydrophobicContact CE-CD1 3.46Å; M70-L530 VanDerWaalsContact CE-CD1 3.46Å; M70-L530 HydrophobicContact CE-CG 4.36Å; M70-L530 HydrophobicContact CG-CD1 4.25Å; M70-I533 HydrophobicContact CG-CB 4.04Å; M70-I533 HydrophobicContact CG-CD1 4.15Å; M70-I533 HydrophobicContact CG-CG2 3.71Å; M70-I533 HydrophobicContact SD-CB 4.06Å; M70-I533 HydrophobicContact SD-CG2 3.48Å; M70-I533 WeakPolarHBondContact SD-CG2 3.4Å; M70-H534 HydrophobicContact CE-CB 3.69Å
71I97.7Very high95Very high16 Ų1627.1 Ų27.18%0.08214%0.138CC..Hα-helixtrans-63.3-28177.4-164.761.2000112.9W67 L68 S69 M73 L74 T75 M141 Q144 T145W67-I71 WeakPolarHBondContact O-CB 3.34Å; W67-I71 WeakPolarHBondContact O-CG2 3.39Å; W67-I71 PolarHBondContact O-N 3.23Å; L68-I71 WeakPolarHBondContact O-CG2 3.35Å; S69-I71 PolarHBondContact O-N 2.95Å; I71-M73 VanDerWaalsContact C-N 3.34Å; I71-L74 HydrophobicContact CD1-CD2 4.09Å; I71-T75 HydrophobicContact CD1-CG2 4.29Å; I71-T75 HydrophobicContact CG1-CG2 4.22Å; I71-T75 WeakPolarHBondContact O-CB 3.31Å; I71-T75 VanDerWaalsContact O-CG2 3.25Å; I71-T75 WeakPolarHBondContact O-CG2 3.49Å; I71-T75 PolarHBondContact O-N 2.98Å; I71-T75 PolarHBondContact O-OG1 3.28Å; I71-M141 HydrophobicContact CB-CE 3.59Å; I71-M141 HydrophobicContact CD1-CE 4Å; I71-M141 HydrophobicContact CG1-CE 3.76Å; I71-M141 HydrophobicContact CG2-CE 4.02Å; I71-Q144 HydrophobicContact CG2-CB 4.34Å; I71-Q144 HydrophobicContact CG2-CG 3.56Å; I71-T145 HydrophobicContact CD1-CG2 4.34Å; I71-T145 HydrophobicContact CG1-CG2 4.06Å
72Y97.5Very high94.8Very high0 Ų028.7 Ų28.70%015%0.151CC..Hα-helixtrans-64.2-43.4171.9-84.5-120.4000110.6Q34 W35 S69 M70 T75 Y76 Q144 C147 Q151Q34-Y72 VanDerWaalsContact C-OH 3.3Å; Q34-Y72 WeakPolarHBondContact CB-OH 3.36Å; Q34-Y72 PolarHBondContact O-OH 3.11Å; W35-Y72 HydrophobicContact CB-CD1 3.78Å; W35-Y72 HydrophobicContact CB-CE1 3.66Å; W35-Y72 HydrophobicContact CB-CG 4.26Å; W35-Y72 AromaticContact CD1-CD1 3.91Å; W35-Y72 AromaticContact CD1-CG 3.62Å; W35-Y72 HydrophobicContact CG-CD1 4.09Å; W35-Y72 HydrophobicContact CG-CE1 4.45Å; W35-Y72 HydrophobicContact CG-CG 4.24Å; W35-Y72 PolarHBondContact N-OH 2.89Å; S69-Y72 WeakPolarHBondContact O-CB 3.14Å; S69-Y72 PolarHBondContact O-N 3.44Å; M70-Y72 PolarHBondContact O-N 3.49Å; Y72-T75 PolarHBondContact O-N 2.96Å; Y72-T75 PolarHBondContact O-OG1 3.01Å; Y72-T75 VanDerWaalsContact O-OG1 3.1Å; Y72-Y76 WeakPolarHBondContact O-CB 3.46Å; Y72-Y76 PolarHBondContact O-N 3.38Å; Y72-Q144 HydrophobicContact CD2-CG 4.46Å; Y72-Q144 HydrophobicContact CE2-CG 4.01Å; Y72-C147 HydrophobicContact CE2-CB 4.18Å; Y72-C147 WeakPolarHBondContact OH-CB 3.36Å; Y72-Q151 HydrophobicContact CD1-CB 4.02Å; Y72-Q151 HydrophobicContact CD1-CG 4.3Å; Y72-Q151 HydrophobicContact CE1-CB 4.37Å; Y72-Q151 PolarHBondContact O-OE1 3.41Å
73M96.9Very high94.6Very high0 Ų028.7 Ų28.70%015%0.151CC..Hα-helixtrans-65.2-47.1178.4-45.8-178.4171.200110.8W35 M70 I71 T75 Y76 I77 Y405 Q526 L530 I533W35-M73 HydrophobicContact CZ2-CE 4.25Å; M70-M73 WeakPolarHBondContact O-CB 3.34Å; M70-M73 PolarHBondContact O-N 3.49Å; I71-M73 VanDerWaalsContact C-N 3.34Å; M73-T75 PolarHBondContact O-N 3.4Å; M73-Y76 PolarHBondContact O-N 3.5Å; M73-I77 WeakPolarHBondContact O-CD1 3.29Å; M73-I77 WeakPolarHBondContact O-CG1 3.4Å; M73-I77 PolarHBondContact O-N 2.93Å; M73-Y405 HydrophobicContact CE-CD2 3.69Å; M73-Y405 HydrophobicContact CE-CG 3.94Å; M73-Q526 VanDerWaalsContact CA-OE1 3.32Å; M73-Q526 HydrophobicContact CB-CB 4.24Å; M73-Q526 VanDerWaalsContact CG-OE1 3.24Å; M73-L530 HydrophobicContact CB-CB 4.18Å; M73-L530 HydrophobicContact SD-CB 4.25Å; M73-L530 PolarHBondContact SD-N 2.99Å; M73-I533 HydrophobicContact CE-CD1 3.46Å; M73-I533 VanDerWaalsContact CE-CD1 3.46Å; M73-I533 HydrophobicContact SD-CD1 4.03Å
74L97.2Very high94Very high75 Ų7529.9 Ų29.939%0.39316%0.158SC..Hα-helixtrans-62.1-43.5178.918061.6000112W67 M70 I71 P78 L530W67-L74 HydrophobicContact CH2-CD2 4.47Å; W67-L74 HydrophobicContact CZ3-CD2 3.91Å; M70-L74 PolarHBondContact O-N 3.03Å; I71-L74 HydrophobicContact CD1-CD2 4.09Å; L74-P78 WeakPolarHBondContact O-CD 3.34Å; L74-L530 HydrophobicContact CD1-CD2 4.36Å
75T96.8Very high93.5Very high14 Ų1435.8 Ų35.89%0.08618%0.178CC..Hα-helixtrans-70.8-35.6-18050.30000112.1I71 Y72 M73 I77 P78 L79 T145 G148 I149I71-T75 HydrophobicContact CD1-CG2 4.29Å; I71-T75 HydrophobicContact CG1-CG2 4.22Å; I71-T75 WeakPolarHBondContact O-CB 3.31Å; I71-T75 VanDerWaalsContact O-CG2 3.25Å; I71-T75 WeakPolarHBondContact O-CG2 3.49Å; I71-T75 PolarHBondContact O-N 2.98Å; I71-T75 PolarHBondContact O-OG1 3.28Å; Y72-T75 PolarHBondContact O-N 2.96Å; Y72-T75 PolarHBondContact O-OG1 3.01Å; Y72-T75 VanDerWaalsContact O-OG1 3.1Å; M73-T75 PolarHBondContact O-N 3.4Å; T75-I77 PolarHBondContact O-N 3.46Å; T75-P78 WeakPolarHBondContact O-CD 3.4Å; T75-L79 WeakPolarHBondContact O-CB 3.35Å; T75-L79 WeakPolarHBondContact O-CD1 3.19Å; T75-L79 WeakPolarHBondContact O-CG 3.49Å; T75-L79 PolarHBondContact O-N 3.09Å; T75-T145 HydrophobicContact CG2-CG2 4.2Å; T75-G148 WeakPolarHBondContact OG1-CA 3.49Å; T75-G148 PolarHBondContact OG1-O 2.86Å; T75-I149 HydrophobicContact CG2-CG1 4.01Å
76Y94.9Very high93Very high1 Ų137.6 Ų37.60%0.00419%0.187CC..Hα-helixtrans-60.8-46.5178.8-174.9-82.6000113Y72 M73 L79 I80 Q151 L155 N522 Q526Y72-Y76 WeakPolarHBondContact O-CB 3.46Å; Y72-Y76 PolarHBondContact O-N 3.38Å; M73-Y76 PolarHBondContact O-N 3.5Å; Y76-L79 PolarHBondContact O-N 3.3Å; Y76-I80 HydrophobicContact CD1-CB 4.43Å; Y76-I80 HydrophobicContact CE1-CB 4.11Å; Y76-I80 HydrophobicContact CE1-CD1 4.31Å; Y76-I80 HydrophobicContact CE1-CG1 4.12Å; Y76-I80 HydrophobicContact CE2-CD1 4.12Å; Y76-I80 WeakPolarHBondContact O-CB 3.33Å; Y76-I80 PolarHBondContact O-N 3.43Å; Y76-I80 WeakPolarHBondContact OH-CD1 3.48Å; Y76-Q151 HydrophobicContact CD2-CG 4.48Å; Y76-L155 HydrophobicContact CD2-CD2 4.38Å; Y76-L155 HydrophobicContact CE2-CB 4.03Å; Y76-L155 HydrophobicContact CE2-CD2 3.79Å; Y76-L155 HydrophobicContact CE2-CG 4.47Å; Y76-N522 HydrophobicContact CE1-CB 4.24Å; Y76-N522 WeakPolarHBondContact OH-CB 3.4Å; Y76-Q526 HydrophobicContact CD1-CB 4.31Å; Y76-Q526 HydrophobicContact CD1-CG 3.55Å; Y76-Q526 HydrophobicContact CE1-CG 4.12Å; Y76-Q526 HydrophobicContact CG-CG 3.84Å
77I93.9Very high92.5Very high43 Ų4338 Ų3822%0.22119%0.189CC..Hα-helixtrans-52.6-52.9-172.9-66.6160.6000113.1M73 T75 I80 Q526 I527 L530M73-I77 WeakPolarHBondContact O-CD1 3.29Å; M73-I77 WeakPolarHBondContact O-CG1 3.4Å; M73-I77 PolarHBondContact O-N 2.93Å; T75-I77 PolarHBondContact O-N 3.46Å; I77-I80 WeakPolarHBondContact O-CG2 3.48Å; I77-Q526 HydrophobicContact CD1-CB 4.44Å; I77-Q526 HydrophobicContact CG1-CB 4.04Å; I77-I527 HydrophobicContact CD1-CG1 3.71Å; I77-I527 HydrophobicContact CG1-CG1 4.01Å; I77-L530 HydrophobicContact CD1-CD2 4.44Å
78P92.6Very high91.7Very high75 Ų7540.5 Ų40.549%0.48721%0.208SC..Hα-helixtrans-79.4-32.4176.729.4-33.3000113.1L74 T75 P82L74-P78 WeakPolarHBondContact O-CD 3.34Å; T75-P78 WeakPolarHBondContact O-CD 3.4Å; P78-P82 WeakPolarHBondContact O-CD 3.4Å
79L93.7Very high91.1Very high49 Ų4949.1 Ų49.126%0.25724%0.24SC..Hα-helixtrans-85.5-11-169.7-62.5176.7000114.4T75 Y76 F81 P82 S83 I149 S152T75-L79 WeakPolarHBondContact O-CB 3.35Å; T75-L79 WeakPolarHBondContact O-CD1 3.19Å; T75-L79 WeakPolarHBondContact O-CG 3.49Å; T75-L79 PolarHBondContact O-N 3.09Å; Y76-L79 PolarHBondContact O-N 3.3Å; L79-F81 PolarHBondContact O-N 3.22Å; L79-P82 HydrophobicContact CD2-CG 4.34Å; L79-P82 WeakPolarHBondContact O-CD 3.35Å; L79-S83 VanDerWaalsContact O-CB 3.29Å; L79-S83 WeakPolarHBondContact O-CB 3.48Å; L79-S83 PolarHBondContact O-N 2.99Å; L79-S83 PolarHBondContact O-OG 3.4Å; L79-S83 VanDerWaalsContact O-OG 3.04Å; L79-I149 HydrophobicContact CD1-CB 4.07Å; L79-I149 HydrophobicContact CD1-CG1 3.74Å; L79-I149 HydrophobicContact CD1-CG2 3.91Å; L79-S152 WeakPolarHBondContact CB-OG 3.34Å
80I88.3Confident90.6Very high8 Ų855.8 Ų55.84%0.04127%0.265CS..Hα-helixtrans-58.2-36.2173.8-170.254.5000112.4Y76 I77 N84Y76-I80 HydrophobicContact CD1-CB 4.43Å; Y76-I80 HydrophobicContact CE1-CB 4.11Å; Y76-I80 HydrophobicContact CE1-CD1 4.31Å; Y76-I80 HydrophobicContact CE1-CG1 4.12Å; Y76-I80 HydrophobicContact CE2-CD1 4.12Å; Y76-I80 WeakPolarHBondContact O-CB 3.33Å; Y76-I80 PolarHBondContact O-N 3.43Å; Y76-I80 WeakPolarHBondContact OH-CD1 3.48Å; I77-I80 WeakPolarHBondContact O-CG2 3.48Å; I80-N84 VanDerWaalsContact O-CB 3.3Å; I80-N84 WeakPolarHBondContact O-CB 3.45Å; I80-N84 VanDerWaalsContact O-CG 3.29Å; I80-N84 PolarHBondContact O-N 3.41Å; I80-N84 PolarHBondContact O-ND2 3.14Å; I80-N84 VanDerWaalsContact O-ND2 3.09Å
81F84.7Confident90Very high114 Ų11456.7 Ų56.750%0.528%0.275SS..Hα-helixtrans-70.2-52.2178.1-55.1-82.4000112.3L79 S83 N84 W85L79-F81 PolarHBondContact O-N 3.22Å; F81-S83 VanDerWaalsContact C-N 3.34Å; F81-S83 PolarHBondContact O-N 2.91Å; F81-N84 PolarHBondContact O-N 2.94Å; F81-W85 PolarHBondContact O-N 3.18Å
82P89Confident89.5Confident59 Ų5956 Ų5638%0.38327%0.272SS..Hα-helixtrans-53.9-44.3169.7-27.733.2000114P78 L79 N84 W85 I86P78-P82 WeakPolarHBondContact O-CD 3.4Å; L79-P82 HydrophobicContact CD2-CG 4.34Å; L79-P82 WeakPolarHBondContact O-CD 3.35Å; P82-N84 PolarHBondContact O-N 2.88Å; P82-W85 WeakPolarHBondContact O-CB 3.35Å; P82-W85 PolarHBondContact O-N 3.31Å; P82-I86 WeakPolarHBondContact O-CG1 3.46Å; P82-I86 PolarHBondContact O-N 3.23Å
83S88.6Confident89.3Confident15 Ų1560.5 Ų60.511%0.10529%0.289CS..Hα-helixtrans-63.6-41.6-180-68.30000112.2L79 F81 I86 L87 S152 G153L79-S83 VanDerWaalsContact O-CB 3.29Å; L79-S83 WeakPolarHBondContact O-CB 3.48Å; L79-S83 PolarHBondContact O-N 2.99Å; L79-S83 PolarHBondContact O-OG 3.4Å; L79-S83 VanDerWaalsContact O-OG 3.04Å; F81-S83 VanDerWaalsContact C-N 3.34Å; F81-S83 PolarHBondContact O-N 2.91Å; S83-I86 PolarHBondContact O-N 3.46Å; S83-L87 WeakPolarHBondContact O-CB 3.46Å; S83-L87 PolarHBondContact O-N 3.12Å; S83-S152 VanDerWaalsContact CB-O 3.23Å; S83-S152 WeakPolarHBondContact CB-O 3.05Å; S83-S152 WeakPolarHBondContact OG-CB 3.33Å; S83-S152 PolarHBondContact OG-OG 3.43Å; S83-G153 PolarHBondContact OG-N 3.02Å
84N82.5Confident89Confident60 Ų6063 Ų6332%0.32130%0.304SS..Hα-helixtrans-65.8-37.6173-79.4-35.4000112.3I80 F81 P82 L87 N88I80-N84 VanDerWaalsContact O-CB 3.3Å; I80-N84 WeakPolarHBondContact O-CB 3.45Å; I80-N84 VanDerWaalsContact O-CG 3.29Å; I80-N84 PolarHBondContact O-N 3.41Å; I80-N84 PolarHBondContact O-ND2 3.14Å; I80-N84 VanDerWaalsContact O-ND2 3.09Å; F81-N84 PolarHBondContact O-N 2.94Å; P82-N84 PolarHBondContact O-N 2.88Å; N84-L87 PolarHBondContact O-N 3.32Å; N84-N88 WeakPolarHBondContact O-CB 3.34Å; N84-N88 VanDerWaalsContact O-CG 3.27Å; N84-N88 PolarHBondContact O-N 3.19Å; N84-N88 PolarHBondContact O-ND2 3.45Å
85W84.3Confident88.8Confident144 Ų14459.7 Ų59.755%0.54529%0.287SS..Hα-helixtrans-62.1-46.1174.1178.588.3000111.5F81 P82 L87 N88 R89 W90F81-W85 PolarHBondContact O-N 3.18Å; P82-W85 WeakPolarHBondContact O-CB 3.35Å; P82-W85 PolarHBondContact O-N 3.31Å; W85-L87 PolarHBondContact O-N 3Å; W85-N88 PolarHBondContact O-N 3.17Å; W85-R89 HydrophobicContact CH2-CG 4.45Å; W85-R89 HydrophobicContact CZ2-CG 4.2Å; W85-R89 WeakPolarHBondContact O-CB 3.43Å; W85-R89 PolarHBondContact O-N 3.24Å; W85-W90 HydrophobicContact CH2-CH2 4.38Å; W85-W90 HydrophobicContact CH2-CZ2 4.11Å; W85-W90 HydrophobicContact CZ3-CH2 4.05Å; W85-W90 HydrophobicContact CZ3-CZ2 4.18Å; W85-W90 HydrophobicContact CZ3-CZ3 4.46Å
86I88.1Confident88.6Confident38 Ų3859 Ų5920%0.19528%0.283CS..Hα-helixtrans-58.7-47.5174.6-70.1171.8000110.6P82 S83 N88 R89 W90P82-I86 WeakPolarHBondContact O-CG1 3.46Å; P82-I86 PolarHBondContact O-N 3.23Å; S83-I86 PolarHBondContact O-N 3.46Å; I86-N88 PolarHBondContact O-N 3.47Å; I86-R89 PolarHBondContact O-N 2.7Å; I86-W90 HydrophobicContact CB-CE3 4.46Å; I86-W90 HydrophobicContact CG1-CE3 4.28Å; I86-W90 HydrophobicContact CG1-CZ3 4.11Å; I86-W90 HydrophobicContact CG2-CE3 3.85Å; I86-W90 HydrophobicContact CG2-CZ3 4.39Å; I86-W90 PolarHBondContact O-N 2.77Å
87L85.9Confident88.6Confident11 Ų1160.7 Ų60.76%0.05829%0.291CS..Hα-helixtrans-58.7-45.4178.418063.7000112.3S83 N84 W85 G91 L92 T95S83-L87 WeakPolarHBondContact O-CB 3.46Å; S83-L87 PolarHBondContact O-N 3.12Å; N84-L87 PolarHBondContact O-N 3.32Å; W85-L87 PolarHBondContact O-N 3Å; L87-G91 WeakPolarHBondContact O-CA 3.47Å; L87-G91 PolarHBondContact O-N 2.71Å; L87-L92 HydrophobicContact CD1-CB 4.37Å; L87-L92 HydrophobicContact CD1-CD1 4.39Å; L87-T95 WeakPolarHBondContact CA-OG1 3.37Å; L87-T95 HydrophobicContact CB-CG2 4.41Å; L87-T95 HydrophobicContact CD1-CG2 4.49Å; L87-T95 PolarHBondContact N-OG1 3.11Å
88N81.2Confident88.6Confident126 Ų12661.8 Ų61.867%0.67430%0.3SS*.Hα-helixtrans-73.8-34.7-179.1-70.9-30.6000112.7N84 W85 I86N84-N88 WeakPolarHBondContact O-CB 3.34Å; N84-N88 VanDerWaalsContact O-CG 3.27Å; N84-N88 PolarHBondContact O-N 3.19Å; N84-N88 PolarHBondContact O-ND2 3.45Å; W85-N88 PolarHBondContact O-N 3.17Å; I86-N88 PolarHBondContact O-N 3.47Å
89R84.2Confident88.8Confident181 Ų18158.3 Ų58.368%0.68328%0.278SS*.Hα-helixtrans-83.4-44.9-174.9-175.762.9173.8171.4-0.1113W85 I86W85-R89 HydrophobicContact CH2-CG 4.45Å; W85-R89 HydrophobicContact CZ2-CG 4.2Å; W85-R89 WeakPolarHBondContact O-CB 3.43Å; W85-R89 PolarHBondContact O-N 3.24Å; I86-R89 PolarHBondContact O-N 2.7Å
90W86.4Confident88.9Confident140 Ų14056.1 Ų56.153%0.5327%0.267SS..Hα-helixtrans-112.2-8.7-173.5-61.4-31.5000113.6W85 I86 V94W85-W90 HydrophobicContact CH2-CH2 4.38Å; W85-W90 HydrophobicContact CH2-CZ2 4.11Å; W85-W90 HydrophobicContact CZ3-CH2 4.05Å; W85-W90 HydrophobicContact CZ3-CZ2 4.18Å; W85-W90 HydrophobicContact CZ3-CZ3 4.46Å; I86-W90 HydrophobicContact CB-CE3 4.46Å; I86-W90 HydrophobicContact CG1-CE3 4.28Å; I86-W90 HydrophobicContact CG1-CZ3 4.11Å; I86-W90 HydrophobicContact CG2-CE3 3.85Å; I86-W90 HydrophobicContact CG2-CZ3 4.39Å; I86-W90 PolarHBondContact O-N 2.77Å; W90-V94 HydrophobicContact CB-CB 3.79Å; W90-V94 HydrophobicContact CB-CG1 3.91Å; W90-V94 HydrophobicContact CB-CG2 3.96Å; W90-V94 HydrophobicContact CD2-CG1 4.39Å; W90-V94 HydrophobicContact CE3-CG1 3.81Å; W90-V94 HydrophobicContact CG-CG1 4.47Å
91G85.8Confident89.3Confident21 Ų2157.1 Ų57.122%0.21628%0.276CS..  trans83168.5173.800000114.2L87 R93 V94 T95L87-G91 WeakPolarHBondContact O-CA 3.47Å; L87-G91 PolarHBondContact O-N 2.71Å; G91-R93 VanDerWaalsContact C-N 3.28Å; G91-R93 PolarHBondContact O-N 2.61Å; G91-R93 VanDerWaalsContact O-N 3.13Å; G91-V94 PolarHBondContact O-N 3.47Å; G91-V94 VanDerWaalsContact O-N 3.17Å; G91-T95 PolarHBondContact O-N 2.76Å; G91-T95 PolarHBondContact O-OG1 3.38Å
92L87.8Confident89.9Confident3 Ų354.3 Ų54.32%0.01627%0.266CS..Hα-helixtrans-50.6-39.7-173.8177.966.7000114.9L87 L96 I157 L161L87-L92 HydrophobicContact CD1-CB 4.37Å; L87-L92 HydrophobicContact CD1-CD1 4.39Å; L92-L96 HydrophobicContact CD1-CD1 3.73Å; L92-L96 HydrophobicContact CD1-CG 4.15Å; L92-L96 HydrophobicContact CG-CD1 4.11Å; L92-L96 PolarHBondContact O-N 3.08Å; L92-L96 VanDerWaalsContact O-N 3.1Å; L92-I157 HydrophobicContact CD1-CD1 4.04Å; L92-I157 HydrophobicContact CD1-CG1 4.43Å; L92-I157 HydrophobicContact CD1-CG2 3.54Å; L92-L161 HydrophobicContact CD2-CD1 3.43Å; L92-L161 VanDerWaalsContact CD2-CD1 3.43Å
93R91.8Very high90.2Very high94 Ų9451.6 Ų51.636%0.35525%0.248SC..Hα-helixtrans-63.2-47.3-177.8-176.4-179.4-176.3169.44.4111.4G91 L97 L246 L249 A251G91-R93 VanDerWaalsContact C-N 3.28Å; G91-R93 PolarHBondContact O-N 2.61Å; G91-R93 VanDerWaalsContact O-N 3.13Å; R93-L97 HydrophobicContact CG-CD1 3.87Å; R93-L97 HydrophobicContact CG-CG 4.39Å; R93-L97 WeakPolarHBondContact O-CB 3.47Å; R93-L97 VanDerWaalsContact O-CG 3.24Å; R93-L97 WeakPolarHBondContact O-CG 3.41Å; R93-L97 PolarHBondContact O-N 2.86Å; R93-L246 PolarHBondContact NH2-O 3.1Å; R93-L249 HydrophobicContact CB-CD2 4.46Å; R93-L249 VanDerWaalsContact CD-O 3.26Å; R93-L249 WeakPolarHBondContact CD-O 3.44Å; R93-L249 HydrophobicContact CG-CD2 4.39Å; R93-L249 HydrophobicContact CG-CG 4.46Å; R93-L249 PolarHBondContact NE-O 2.8Å; R93-L249 VanDerWaalsContact NE-O 3.12Å; R93-A251 HydrophobicContact CB-CB 3.95Å
94V92.3Very high90.7Very high53 Ų5351.3 Ų51.332%0.32125%0.247SC..Hα-helixtrans-67.5-44.3-176.5177.30000110W90 G91 L96 L97 V98W90-V94 HydrophobicContact CB-CB 3.79Å; W90-V94 HydrophobicContact CB-CG1 3.91Å; W90-V94 HydrophobicContact CB-CG2 3.96Å; W90-V94 HydrophobicContact CD2-CG1 4.39Å; W90-V94 HydrophobicContact CE3-CG1 3.81Å; W90-V94 HydrophobicContact CG-CG1 4.47Å; G91-V94 PolarHBondContact O-N 3.47Å; G91-V94 VanDerWaalsContact O-N 3.17Å; V94-L96 PolarHBondContact O-N 2.92Å; V94-L97 PolarHBondContact O-N 3.05Å; V94-V98 HydrophobicContact CG1-CG2 4.34Å; V94-V98 WeakPolarHBondContact O-CG2 3.13Å; V94-V98 PolarHBondContact O-N 2.84Å
95T92.1Very high91.4Very high5 Ų552 Ų523%0.03125%0.253CS..Hα-helixtrans-55.5-49.4176.9-49.50000112.1L87 G91 V98 A99 G153 I157L87-T95 WeakPolarHBondContact CA-OG1 3.37Å; L87-T95 HydrophobicContact CB-CG2 4.41Å; L87-T95 HydrophobicContact CD1-CG2 4.49Å; L87-T95 PolarHBondContact N-OG1 3.11Å; G91-T95 PolarHBondContact O-N 2.76Å; G91-T95 PolarHBondContact O-OG1 3.38Å; T95-V98 PolarHBondContact O-N 3.26Å; T95-A99 WeakPolarHBondContact O-CB 3.26Å; T95-A99 PolarHBondContact O-N 3.2Å; T95-G153 WeakPolarHBondContact CG2-O 3.41Å; T95-I157 HydrophobicContact CG2-CD1 4.08Å
96L93Very high92.1Very high0 Ų045.1 Ų45.10%023%0.227CC..Hα-helixtrans-70.7-33-178.7-76.1177000113.3F24 L92 V94 S100 I157 L249F24-L96 HydrophobicContact CB-CD1 4.46Å; F24-L96 HydrophobicContact CD2-CD1 4.18Å; F24-L96 HydrophobicContact CD2-CD2 3.85Å; F24-L96 HydrophobicContact CE2-CD2 4.33Å; L92-L96 HydrophobicContact CD1-CD1 3.73Å; L92-L96 HydrophobicContact CD1-CG 4.15Å; L92-L96 HydrophobicContact CG-CD1 4.11Å; L92-L96 PolarHBondContact O-N 3.08Å; L92-L96 VanDerWaalsContact O-N 3.1Å; V94-L96 PolarHBondContact O-N 2.92Å; L96-S100 VanDerWaalsContact O-CB 3.29Å; L96-S100 WeakPolarHBondContact O-CB 3.31Å; L96-S100 PolarHBondContact O-N 3.24Å; L96-S100 PolarHBondContact O-OG 3.33Å; L96-I157 HydrophobicContact CD1-CD1 4.45Å; L96-I157 HydrophobicContact CD2-CD1 3.47Å; L96-I157 VanDerWaalsContact CD2-CD1 3.47Å; L96-I157 HydrophobicContact CG-CD1 3.74Å; L96-L249 HydrophobicContact CB-CD2 3.55Å; L96-L249 HydrophobicContact CD1-CD1 4.37Å; L96-L249 HydrophobicContact CD1-CD2 3.56Å; L96-L249 HydrophobicContact CG-CD2 4.16Å
97L94.8Very high92.5Very high35 Ų3543.4 Ų43.418%0.18322%0.218CC..Hα-helixtrans-65.2-46.3174-74.4172.6000111.7R93 V94 S100 A101 A245 L246R93-L97 HydrophobicContact CG-CD1 3.87Å; R93-L97 HydrophobicContact CG-CG 4.39Å; R93-L97 WeakPolarHBondContact O-CB 3.47Å; R93-L97 VanDerWaalsContact O-CG 3.24Å; R93-L97 WeakPolarHBondContact O-CG 3.41Å; R93-L97 PolarHBondContact O-N 2.86Å; V94-L97 PolarHBondContact O-N 3.05Å; L97-S100 PolarHBondContact O-OG 3.37Å; L97-A101 WeakPolarHBondContact O-CB 3.37Å; L97-A101 PolarHBondContact O-N 3.24Å; L97-A245 HydrophobicContact CD2-CB 3.83Å; L97-L246 HydrophobicContact CD2-CB 4.22Å; L97-L246 HydrophobicContact CD2-CD1 4.2Å
98V94.7Very high93.1Very high66 Ų6645.5 Ų45.540%0.423%0.233SC..Hα-helixtrans-62.3-48.2177.5173.30000110.1V94 T95 A101 L102V94-V98 HydrophobicContact CG1-CG2 4.34Å; V94-V98 WeakPolarHBondContact O-CG2 3.13Å; V94-V98 PolarHBondContact O-N 2.84Å; T95-V98 PolarHBondContact O-N 3.26Å; V98-A101 PolarHBondContact O-N 3.24Å; V98-L102 HydrophobicContact CG1-CD1 3.98Å; V98-L102 VanDerWaalsContact O-CG 3.29Å; V98-L102 WeakPolarHBondContact O-CG 3.43Å; V98-L102 PolarHBondContact O-N 3.25Å
99A95.5Very high94Very high3 Ų340.8 Ų40.83%0.02521%0.208CC..Hα-helixtrans-64.2-44.8-17900000112.8T95 L102 N103 A150 I154T95-A99 WeakPolarHBondContact O-CB 3.26Å; T95-A99 PolarHBondContact O-N 3.2Å; A99-L102 PolarHBondContact O-N 2.82Å; A99-N103 PolarHBondContact O-N 3.29Å; A99-A150 HydrophobicContact CB-CB 4.45Å; A99-A150 VanDerWaalsContact O-CB 3.28Å; A99-A150 WeakPolarHBondContact O-CB 3.27Å; A99-I154 HydrophobicContact CB-CD1 3.98Å; A99-I154 HydrophobicContact CB-CG1 3.7Å
100S95.5Very high94.6Very high3 Ų332.1 Ų32.12%0.02118%0.175CC..Hα-helixtrans-68.4-34.6177.955.50000112.9L96 L97 N103 A104L96-S100 VanDerWaalsContact O-CB 3.29Å; L96-S100 WeakPolarHBondContact O-CB 3.31Å; L96-S100 PolarHBondContact O-N 3.24Å; L96-S100 PolarHBondContact O-OG 3.33Å; L97-S100 PolarHBondContact O-OG 3.37Å; S100-N103 PolarHBondContact O-N 3.34Å; S100-A104 WeakPolarHBondContact O-CB 3.23Å; S100-A104 PolarHBondContact O-N 3.1Å
101A96.9Very high95.2Very high28 Ų2826.1 Ų26.123%0.23115%0.154CC..Hα-helixtrans-62.6-47.2172.400000111.7L97 V98 N103 A104 V105 F242L97-A101 WeakPolarHBondContact O-CB 3.37Å; L97-A101 PolarHBondContact O-N 3.24Å; V98-A101 PolarHBondContact O-N 3.24Å; A101-N103 PolarHBondContact O-N 3.25Å; A101-A104 PolarHBondContact O-N 2.91Å; A101-V105 VanDerWaalsContact O-CG2 3.32Å; A101-V105 WeakPolarHBondContact O-CG2 3.47Å; A101-V105 PolarHBondContact O-N 3.32Å; A101-F242 HydrophobicContact CB-CD2 3.87Å; A101-F242 HydrophobicContact CB-CE2 3.6Å; A101-F242 HydrophobicContact CB-CZ 4.25Å
102L97.5Very high95.7Very high55 Ų5529.5 Ų29.529%0.28817%0.167SC..Hα-helixtrans-59.2-46.1176.8-71.4170.4000111V98 A99 A104 V105 G106 I146 I149 A150V98-L102 HydrophobicContact CG1-CD1 3.98Å; V98-L102 VanDerWaalsContact O-CG 3.29Å; V98-L102 WeakPolarHBondContact O-CG 3.43Å; V98-L102 PolarHBondContact O-N 3.25Å; A99-L102 PolarHBondContact O-N 2.82Å; L102-A104 PolarHBondContact O-N 3.42Å; L102-V105 PolarHBondContact O-N 3.45Å; L102-G106 PolarHBondContact O-N 3.22Å; L102-I146 HydrophobicContact CB-CG2 4.05Å; L102-I146 HydrophobicContact CD2-CG2 3.98Å; L102-I146 WeakPolarHBondContact O-CG2 3.24Å; L102-I149 HydrophobicContact CD1-CG2 3.89Å; L102-A150 HydrophobicContact CB-CB 3.83Å
103N96.4Very high96.2Very high2 Ų229.4 Ų29.41%0.01117%0.166CC..Hα-helixtrans-59-43.9175.3-82.5-29.2000113.2N31 A99 S100 A101 G106 G107 C147 A150 I154 N238N31-N103 WeakPolarHBondContact CB-ND2 3.49Å; N31-N103 PolarHBondContact ND2-ND2 3.29Å; N31-N103 PolarHBondContact ND2-OD1 3.32Å; A99-N103 PolarHBondContact O-N 3.29Å; S100-N103 PolarHBondContact O-N 3.34Å; A101-N103 PolarHBondContact O-N 3.25Å; N103-G106 PolarHBondContact O-N 3.32Å; N103-G107 PolarHBondContact O-N 3.05Å; N103-C147 PolarHBondContact OD1-O 3.29Å; N103-A150 HydrophobicContact CB-CB 4.46Å; N103-A150 WeakPolarHBondContact OD1-CB 3.22Å; N103-I154 VanDerWaalsContact ND2-CD1 3.28Å; N103-I154 WeakPolarHBondContact ND2-CD1 3.43Å; N103-N238 HydrophobicContact CB-CB 4.25Å
104A97.4Very high96.4Very high9 Ų924.9 Ų24.97%0.07415%0.149CC..Hα-helixtrans-62.5-46.7177.500000111.3S100 A101 L102 G107 C108 I239S100-A104 WeakPolarHBondContact O-CB 3.23Å; S100-A104 PolarHBondContact O-N 3.1Å; A101-A104 PolarHBondContact O-N 2.91Å; L102-A104 PolarHBondContact O-N 3.42Å; A104-G107 PolarHBondContact O-N 3.27Å; A104-C108 PolarHBondContact O-N 3.29Å; A104-C108 PolarHBondContact O-SG 2.78Å; A104-I239 HydrophobicContact CB-CG1 4Å
105V98.2Very high96.5Very high75 Ų7524.3 Ų24.346%0.45515%0.15SC..Hα-helixtrans-61.2-47.1177.1170.70000111.2A101 L102 G107 C108 I109 I146A101-V105 VanDerWaalsContact O-CG2 3.32Å; A101-V105 WeakPolarHBondContact O-CG2 3.47Å; A101-V105 PolarHBondContact O-N 3.32Å; L102-V105 PolarHBondContact O-N 3.45Å; V105-G107 VanDerWaalsContact C-N 3.35Å; V105-G107 PolarHBondContact O-N 3.36Å; V105-C108 PolarHBondContact O-N 2.9Å; V105-I109 HydrophobicContact CG1-CD1 3.73Å; V105-I109 HydrophobicContact CG1-CG1 4.45Å; V105-I109 WeakPolarHBondContact O-CG1 3.39Å; V105-I109 PolarHBondContact O-N 3.42Å; V105-I146 HydrophobicContact CG1-CD1 4.44Å
106G98.4Very high96.6Very high0 Ų025.8 Ų25.80%016%0.158CC..Hα-helixtrans-61.1-41.717800000112.5L102 N103 I109 K110 G143L102-G106 PolarHBondContact O-N 3.22Å; N103-G106 PolarHBondContact O-N 3.32Å; G106-I109 PolarHBondContact O-N 3.43Å; G106-K110 WeakPolarHBondContact O-CG 3.34Å; G106-K110 PolarHBondContact O-N 3.25Å; G106-K110 VanDerWaalsContact O-N 3.11Å; G106-G143 WeakPolarHBondContact CA-O 3.18Å
107G97.9Very high96.6Very high1 Ų126 Ų261%0.0116%0.16CC..Hα-helixtrans-60.8-43.3173.300000113.3N103 A104 V105 K110 C111N103-G107 PolarHBondContact O-N 3.05Å; A104-G107 PolarHBondContact O-N 3.27Å; V105-G107 VanDerWaalsContact C-N 3.35Å; V105-G107 PolarHBondContact O-N 3.36Å; G107-K110 PolarHBondContact O-N 2.82Å; G107-C111 PolarHBondContact O-N 3.21Å; G107-C111 PolarHBondContact O-SG 3.45Å; G107-C111 VanDerWaalsContact O-SG 3.39Å
108C98.3Very high96.3Very high55 Ų5530.7 Ų30.737%0.37218%0.176SC..Hα-helixtrans-63.8-41.8175.5-69.20000112.4A104 V105 K110 C111 I112A104-C108 PolarHBondContact O-N 3.29Å; A104-C108 PolarHBondContact O-SG 2.78Å; V105-C108 PolarHBondContact O-N 2.9Å; C108-K110 VanDerWaalsContact C-N 3.3Å; C108-K110 PolarHBondContact O-N 2.81Å; C108-C111 VanDerWaalsContact O-CB 3.28Å; C108-C111 WeakPolarHBondContact O-CB 3.18Å; C108-C111 PolarHBondContact O-N 2.73Å; C108-C111 VanDerWaalsContact O-N 3.08Å; C108-I112 PolarHBondContact O-N 3.2Å
109I98.4Very high96Very high27 Ų2730.7 Ų30.714%0.13817%0.172CC..Hα-helixtrans-61.9-38.8177.7-71.8166000111.2V105 G106 C111 I112 A113 I139 F142 I146V105-I109 HydrophobicContact CG1-CD1 3.73Å; V105-I109 HydrophobicContact CG1-CG1 4.45Å; V105-I109 WeakPolarHBondContact O-CG1 3.39Å; V105-I109 PolarHBondContact O-N 3.42Å; G106-I109 PolarHBondContact O-N 3.43Å; I109-C111 VanDerWaalsContact C-N 3.25Å; I109-C111 PolarHBondContact O-N 2.8Å; I109-I112 WeakPolarHBondContact O-CA 3.49Å; I109-I112 VanDerWaalsContact O-CB 3.32Å; I109-I112 WeakPolarHBondContact O-CB 3.5Å; I109-I112 PolarHBondContact O-N 3.32Å; I109-A113 PolarHBondContact O-N 3.33Å; I109-I139 HydrophobicContact CG2-CG2 3.77Å; I109-I139 WeakPolarHBondContact CG2-O 3.23Å; I109-F142 HydrophobicContact CD1-CD1 4.13Å; I109-F142 HydrophobicContact CD1-CE1 3.98Å; I109-F142 HydrophobicContact CG2-CD1 4.14Å; I109-I146 HydrophobicContact CD1-CD1 3.4Å; I109-I146 VanDerWaalsContact CD1-CD1 3.4Å
110K98.2Very high95.7Very high0 Ų030.9 Ų30.90%017%0.173CC..Hα-helixtrans-62.6-31.9174.8-65.9176.5177.7-175.90112.7H37 G106 G107 C108 I112 A113 G114 L140 L231H37-K110 PolarHBondContact NE2-NZ 3.39Å; G106-K110 WeakPolarHBondContact O-CG 3.34Å; G106-K110 PolarHBondContact O-N 3.25Å; G106-K110 VanDerWaalsContact O-N 3.11Å; G107-K110 PolarHBondContact O-N 2.82Å; C108-K110 VanDerWaalsContact C-N 3.3Å; C108-K110 PolarHBondContact O-N 2.81Å; K110-I112 VanDerWaalsContact C-N 3.29Å; K110-I112 PolarHBondContact O-N 2.71Å; K110-A113 VanDerWaalsContact O-CB 3.29Å; K110-A113 WeakPolarHBondContact O-CB 3.45Å; K110-A113 PolarHBondContact O-N 3.2Å; K110-G114 PolarHBondContact O-N 3.4Å; K110-G114 VanDerWaalsContact O-N 3.1Å; K110-L140 HydrophobicContact CB-CD1 3.99Å; K110-L140 HydrophobicContact CD-CD1 4.18Å; K110-L140 HydrophobicContact CG-CD1 3.76Å; K110-L231 HydrophobicContact CB-CD2 3.99Å
111C98.1Very high95.4Very high14 Ų1431.3 Ų31.310%0.09518%0.175CC..Hα-helixtrans-63.6-38173.2-590000111.3G107 C108 I109 A113 G114 A115 L231 Y232G107-C111 PolarHBondContact O-N 3.21Å; G107-C111 PolarHBondContact O-SG 3.45Å; G107-C111 VanDerWaalsContact O-SG 3.39Å; C108-C111 VanDerWaalsContact O-CB 3.28Å; C108-C111 WeakPolarHBondContact O-CB 3.18Å; C108-C111 PolarHBondContact O-N 2.73Å; C108-C111 VanDerWaalsContact O-N 3.08Å; I109-C111 VanDerWaalsContact C-N 3.25Å; I109-C111 PolarHBondContact O-N 2.8Å; C111-A113 VanDerWaalsContact C-N 3.33Å; C111-G114 PolarHBondContact O-N 2.84Å; C111-A115 WeakPolarHBondContact O-CB 3.27Å; C111-A115 PolarHBondContact O-N 2.84Å; C111-L231 VanDerWaalsContact SG-C 3.59Å; C111-L231 PolarHBondContact SG-O 3.21Å; C111-L231 VanDerWaalsContact SG-O 3.39Å; C111-Y232 HydrophobicContact CB-CD1 4.2Å; C111-Y232 HydrophobicContact CB-CE1 4.05Å
112I97.1Very high95Very high92 Ų9230.3 Ų30.347%0.47217%0.165SC..Hα-helixtrans-62.6-43.5173.4-56.3172.8000109.8C108 I109 K110 G114 A115 V116 I139C108-I112 PolarHBondContact O-N 3.2Å; I109-I112 WeakPolarHBondContact O-CA 3.49Å; I109-I112 VanDerWaalsContact O-CB 3.32Å; I109-I112 WeakPolarHBondContact O-CB 3.5Å; I109-I112 PolarHBondContact O-N 3.32Å; K110-I112 VanDerWaalsContact C-N 3.29Å; K110-I112 PolarHBondContact O-N 2.71Å; I112-G114 VanDerWaalsContact C-N 3.3Å; I112-G114 PolarHBondContact O-N 3.4Å; I112-A115 PolarHBondContact O-N 3.19Å; I112-A115 VanDerWaalsContact O-N 3.11Å; I112-V116 HydrophobicContact CG2-CG1 4.25Å; I112-V116 WeakPolarHBondContact O-CG1 3.09Å; I112-V116 WeakPolarHBondContact O-CG2 3.39Å; I112-V116 PolarHBondContact O-N 3.16Å; I112-V116 VanDerWaalsContact O-N 3.07Å; I112-I139 HydrophobicContact CB-CG2 4.42Å; I112-I139 HydrophobicContact CG2-CG2 4.45Å
113A96.9Very high94.2Very high0 Ų031.4 Ų31.40%019%0.19CC..Hα-helixtrans-56.9-40.2177.400000113.4W49 I109 K110 C111 V116 T117 G136 I139 L140W49-A113 PolarHBondContact NE1-O 3.36Å; I109-A113 PolarHBondContact O-N 3.33Å; K110-A113 VanDerWaalsContact O-CB 3.29Å; K110-A113 WeakPolarHBondContact O-CB 3.45Å; K110-A113 PolarHBondContact O-N 3.2Å; C111-A113 VanDerWaalsContact C-N 3.33Å; A113-V116 WeakPolarHBondContact O-CG2 3.1Å; A113-T117 PolarHBondContact O-OG1 2.95Å; A113-T117 VanDerWaalsContact O-OG1 3.06Å; A113-G136 WeakPolarHBondContact CB-O 3.46Å; A113-I139 HydrophobicContact CB-CB 4.01Å; A113-I139 HydrophobicContact CB-CG2 3.84Å; A113-L140 HydrophobicContact CB-CB 3.72Å; A113-L140 HydrophobicContact CB-CD1 4.4Å
114G96.1Very high93.4Very high0 Ų035.2 Ų35.20%021%0.208CC..Hα-helixtrans-73.1-35.8174.700000113.4K110 C111 I112 T117K110-G114 PolarHBondContact O-N 3.4Å; K110-G114 VanDerWaalsContact O-N 3.1Å; C111-G114 PolarHBondContact O-N 2.84Å; I112-G114 VanDerWaalsContact C-N 3.3Å; I112-G114 PolarHBondContact O-N 3.4Å; G114-T117 PolarHBondContact O-N 3.39Å
115A95.1Very high91.9Very high41 Ų4139.4 Ų39.434%0.33924%0.237SC..Hα-helixtrans-66.3-38.3-179.100000112.8C111 I112 T117 M228C111-A115 WeakPolarHBondContact O-CB 3.27Å; C111-A115 PolarHBondContact O-N 2.84Å; I112-A115 PolarHBondContact O-N 3.19Å; I112-A115 VanDerWaalsContact O-N 3.11Å; A115-T117 VanDerWaalsContact C-N 3.28Å; A115-T117 PolarHBondContact O-N 2.97Å; A115-M228 HydrophobicContact CB-CE 4.22Å
116V93.9Very high90.3Very high35 Ų3543.7 Ų43.721%0.21226%0.257CS..THydrogen-bonded Turntrans-77.4-7.3-179.2-59.20000114.3I112 A113 Y118 I139I112-V116 HydrophobicContact CG2-CG1 4.25Å; I112-V116 WeakPolarHBondContact O-CG1 3.09Å; I112-V116 WeakPolarHBondContact O-CG2 3.39Å; I112-V116 PolarHBondContact O-N 3.16Å; I112-V116 VanDerWaalsContact O-N 3.07Å; A113-V116 WeakPolarHBondContact O-CG2 3.1Å; V116-Y118 WeakPolarHBondContact O-CD2 3.33Å; V116-Y118 WeakPolarHBondContact O-CE2 3.19Å; V116-I139 HydrophobicContact CG2-CD1 4.21Å
117T93.3Very high89.1Confident4 Ų447.4 Ų47.43%0.02528%0.276CS..  trans-91.6117.9179.1-58.90000110F48 W49 A113 G114 A115 F220 K224F48-T117 HydrophobicContact CD1-CG2 4.47Å; F48-T117 HydrophobicContact CD2-CG2 4.39Å; F48-T117 HydrophobicContact CE1-CG2 4.12Å; F48-T117 HydrophobicContact CE2-CG2 4.02Å; F48-T117 HydrophobicContact CZ-CG2 3.88Å; F48-T117 VanDerWaalsContact O-CG2 3.23Å; F48-T117 WeakPolarHBondContact O-CG2 3.25Å; W49-T117 VanDerWaalsContact CD1-OG1 3.25Å; W49-T117 PolarHBondContact NE1-OG1 2.9Å; W49-T117 VanDerWaalsContact NE1-OG1 3.07Å; A113-T117 PolarHBondContact O-OG1 2.95Å; A113-T117 VanDerWaalsContact O-OG1 3.06Å; G114-T117 PolarHBondContact O-N 3.39Å; A115-T117 VanDerWaalsContact C-N 3.28Å; A115-T117 PolarHBondContact O-N 2.97Å; T117-F220 HydrophobicContact CG2-CE2 4.17Å; T117-F220 HydrophobicContact CG2-CZ 4.01Å; T117-K224 WeakPolarHBondContact O-CD 3.43Å; T117-K224 WeakPolarHBondContact O-CE 3.35Å; T117-K224 PolarHBondContact O-NZ 3.18Å
118Y87.5Confident88Confident134 Ų13452.9 Ų52.953%0.52531%0.314SS..  trans-116.7-18.8-172.2-62.1-85.3000115.3V116 H133 F220V116-Y118 WeakPolarHBondContact O-CD2 3.33Å; V116-Y118 WeakPolarHBondContact O-CE2 3.19Å; Y118-H133 AromaticContact CD2-NE2 3.92Å; Y118-F220 WeakPolarHBondContact O-CE1 3.38Å
119E88.5Confident86.8Confident67 Ų6751.8 Ų51.831%0.31330%0.304SS..  trans-150.9163.4176.873-161162.800110.2H133 F220E119-H133 IonicContact OE1-CE1 3.32Å; E119-H133 PolarHBondContact OE1-CE1 2.73Å; E119-H133 IonicContact OE1-ND1 3.16Å; E119-H133 PolarHBondContact OE1-ND1 3.27Å; E119-H133 VanDerWaalsContact OE1-ND1 3.13Å; E119-F220 VanDerWaalsContact N-CZ 3.28Å
120T90.1Very high85.8Confident7 Ų753.4 Ų53.44%0.04332%0.317CS..  trans-110147172.5-179.40000110.4F47 F122 Q124 V216 F220F47-T120 HydrophobicContact CD2-CG2 4.44Å; F47-T120 HydrophobicContact CE1-CG2 4.34Å; F47-T120 HydrophobicContact CE2-CG2 3.78Å; F47-T120 HydrophobicContact CZ-CG2 3.71Å; F47-T120 VanDerWaalsContact O-CB 3.27Å; F47-T120 WeakPolarHBondContact O-CB 3.31Å; F47-T120 PolarHBondContact O-OG1 3.23Å; T120-F122 VanDerWaalsContact OG1-CB 3.23Å; T120-F122 WeakPolarHBondContact OG1-CB 3.33Å; T120-F122 PolarHBondContact OG1-N 3Å; T120-Q124 PolarHBondContact O-OE1 3.35Å; T120-V216 HydrophobicContact CG2-CG1 3.67Å; T120-F220 HydrophobicContact CG2-CB 4.22Å; T120-F220 HydrophobicContact CG2-CD2 3.82Å; T120-F220 HydrophobicContact CG2-CG 4.34Å
121T89.1Confident84.9Confident12 Ų1260.8 Ų60.87%0.07435%0.349CS..  trans-106.211.2168.353.40000112.7D50 A51 G123 Q124 I127 I129D50-T121 PolarHBondContact OD2-OG1 3.05Å; A51-T121 VanDerWaalsContact CA-OG1 3.31Å; A51-T121 WeakPolarHBondContact CA-OG1 3.41Å; A51-T121 HydrophobicContact CB-CG2 4.23Å; A51-T121 PolarHBondContact N-OG1 2.84Å; T121-G123 PolarHBondContact O-N 2.77Å; T121-Q124 PolarHBondContact O-N 3.42Å; T121-I127 HydrophobicContact CG2-CB 4.44Å; T121-I129 HydrophobicContact CG2-CD1 3.29Å; T121-I129 HydrophobicContact CG2-CG1 3.53Å
122F88.5Confident83.8Confident6 Ų663 Ų633%0.02637%0.365CS..THydrogen-bonded Turntrans-60.6121.6-176.8-171.1-92000110.6L46 F47 D50 T120 Q124 Y202 N208 L210L46-F122 HydrophobicContact CD2-CE2 3.71Å; L46-F122 HydrophobicContact CG-CD2 4.19Å; L46-F122 HydrophobicContact CG-CE2 3.82Å; F47-F122 HydrophobicContact CB-CG 4.41Å; F47-F122 HydrophobicContact CD2-CB 3.81Å; F47-F122 AromaticContact CD2-CD1 3.92Å; F47-F122 HydrophobicContact CD2-CD1 3.92Å; F47-F122 AromaticContact CD2-CG 3.95Å; F47-F122 HydrophobicContact CD2-CG 3.95Å; F47-F122 HydrophobicContact CE2-CB 4.45Å; D50-F122 HydrophobicContact CB-CB 3.99Å; D50-F122 HydrophobicContact CB-CD2 4.43Å; D50-F122 PolarHBondContact OD2-N 3.49Å; T120-F122 VanDerWaalsContact OG1-CB 3.23Å; T120-F122 WeakPolarHBondContact OG1-CB 3.33Å; T120-F122 PolarHBondContact OG1-N 3Å; F122-Q124 PolarHBondContact O-N 3.19Å; F122-Y202 HydrophobicContact CE1-CE1 4.23Å; F122-Y202 HydrophobicContact CZ-CE1 4.23Å; F122-N208 HydrophobicContact CZ-CB 4.43Å; F122-L210 HydrophobicContact CD1-CD1 4.15Å; F122-L210 HydrophobicContact CD1-CG 4.19Å; F122-L210 HydrophobicContact CE1-CG 4.31Å
123G80.1Confident82.6Confident79 Ų7959.9 Ų59.981%0.81435%0.348SS*.THydrogen-bonded Turntrans75.43.4-177.600000115.2T121T121-G123 PolarHBondContact O-N 2.77Å
124Q79.7Confident82Confident81 Ų8164.8 Ų64.838%0.37937%0.37SS..  trans-105.2128179.1-63.9173.6-12.800110.1T120 T121 F122 I127T120-Q124 PolarHBondContact O-OE1 3.35Å; T121-Q124 PolarHBondContact O-N 3.42Å; F122-Q124 PolarHBondContact O-N 3.19Å; Q124-I127 HydrophobicContact CB-CD1 3.66Å; Q124-I127 HydrophobicContact CB-CG1 4.46Å; Q124-I127 HydrophobicContact CG-CD1 4.15Å
125S67.1Low81.8Confident98 Ų9868 Ų6869%0.68539%0.386SS*.  trans-93.114716953.50000110.2
126D64.6Low81.8Confident164 Ų16466 Ų6688%0.87737%0.37SS*.SBendtrans67.242.2167-52.5-39.7000117.5
127I72Confident81.9Confident78 Ų7864.8 Ų64.840%0.436%0.362SS..  trans-103.1126.4170.7-61.3175.6000110.8T121 Q124 I129T121-I127 HydrophobicContact CG2-CB 4.44Å; Q124-I127 HydrophobicContact CB-CD1 3.66Å; Q124-I127 HydrophobicContact CB-CG1 4.46Å; Q124-I127 HydrophobicContact CG-CD1 4.15Å; I127-I129 HydrophobicContact CG2-CG1 4.26Å; I127-I129 PolarHBondContact O-N 3.01Å; I127-I129 VanDerWaalsContact O-N 3.14Å
128S74.8Confident82.1Confident116 Ų11667.8 Ų67.881%0.81138%0.381SS*.  trans-75.398.1169.759.30000110
129I73.2Confident82.6Confident32 Ų3263.4 Ų63.416%0.16437%0.367CS..  trans-85.9128.3-178.2-53.4159.7000110.3A51 T121 I127 H133A51-I129 HydrophobicContact CB-CD1 3.76Å; A51-I129 HydrophobicContact CB-CG2 4.22Å; T121-I129 HydrophobicContact CG2-CD1 3.29Å; T121-I129 HydrophobicContact CG2-CG1 3.53Å; I127-I129 HydrophobicContact CG2-CG1 4.26Å; I127-I129 PolarHBondContact O-N 3.01Å; I127-I129 VanDerWaalsContact O-N 3.14Å; I129-H133 HydrophobicContact CG2-CB 3.39Å
130P77.1Confident83Confident61 Ų6160.2 Ų60.240%0.39635%0.352SS..  trans-56.1146.7175-24.133.6000112.5S132 H133P130-S132 VanDerWaalsContact C-N 3.25Å; P130-S132 PolarHBondContact O-N 3.36Å; P130-H133 WeakPolarHBondContact O-CB 3.18Å; P130-H133 PolarHBondContact O-N 3.28Å
131F80Confident83.4Confident155 Ų15561.7 Ų61.768%0.6836%0.359SS*.G310 helixtrans-56.8-37.4-177.1179.2-97.3000113.4H133 K134 L135F131-H133 PolarHBondContact O-N 2.94Å; F131-K134 WeakPolarHBondContact O-CB 3.43Å; F131-K134 PolarHBondContact O-N 2.83Å; F131-L135 HydrophobicContact CE1-CD1 4.37Å; F131-L135 HydrophobicContact CE1-CD2 4.06Å; F131-L135 HydrophobicContact CE1-CG 4.35Å; F131-L135 HydrophobicContact CZ-CD2 4.16Å
132S74.5Confident83.9Confident62 Ų6267 Ų6743%0.43438%0.381SS..G310 helixtrans-57.3-33.2177.846.10000113.1P130 K134 L135P130-S132 VanDerWaalsContact C-N 3.25Å; P130-S132 PolarHBondContact O-N 3.36Å; S132-K134 VanDerWaalsContact C-N 3.28Å; S132-K134 PolarHBondContact O-N 2.86Å; S132-L135 PolarHBondContact O-N 3.22Å
133H72.2Confident84.3Confident25 Ų2566.7 Ų66.712%0.11638%0.38CS..G310 helixtrans-72.7-24178.9-69.8-139.6000111.7S52 Y118 E119 I129 P130 F131 L135S52-H133 WeakPolarHBondContact CB-O 3.27Å; Y118-H133 AromaticContact CD2-NE2 3.92Å; E119-H133 IonicContact OE1-CE1 3.32Å; E119-H133 PolarHBondContact OE1-CE1 2.73Å; E119-H133 IonicContact OE1-ND1 3.16Å; E119-H133 PolarHBondContact OE1-ND1 3.27Å; E119-H133 VanDerWaalsContact OE1-ND1 3.13Å; I129-H133 HydrophobicContact CG2-CB 3.39Å; P130-H133 WeakPolarHBondContact O-CB 3.18Å; P130-H133 PolarHBondContact O-N 3.28Å; F131-H133 PolarHBondContact O-N 2.94Å; H133-L135 PolarHBondContact O-N 3.5Å
134K85Confident85.2Confident104 Ų10463 Ų6345%0.45234%0.341SS..G310 helixtrans-75.6-6.3177.5-57.9-174.1179.6-175.80113.3S52 F131 S132 P138S52-K134 WeakPolarHBondContact CB-O 3.43Å; F131-K134 WeakPolarHBondContact O-CB 3.43Å; F131-K134 PolarHBondContact O-N 2.83Å; S132-K134 VanDerWaalsContact C-N 3.28Å; S132-K134 PolarHBondContact O-N 2.86Å; K134-P138 WeakPolarHBondContact O-CD 3.33Å; K134-P138 WeakPolarHBondContact O-CG 3.49Å
135L91.6Very high86.1Confident67 Ų6760.8 Ų60.835%0.35133%0.333SS..G310 helixtrans-87-17-178.4-63.5177.5000114.2F131 S132 H133 P138 I139F131-L135 HydrophobicContact CE1-CD1 4.37Å; F131-L135 HydrophobicContact CE1-CD2 4.06Å; F131-L135 HydrophobicContact CE1-CG 4.35Å; F131-L135 HydrophobicContact CZ-CD2 4.16Å; S132-L135 PolarHBondContact O-N 3.22Å; H133-L135 PolarHBondContact O-N 3.5Å; L135-P138 WeakPolarHBondContact O-CD 3.45Å; L135-I139 HydrophobicContact CB-CD1 3.87Å; L135-I139 HydrophobicContact CB-CG1 4.43Å; L135-I139 WeakPolarHBondContact O-CB 3.32Å; L135-I139 WeakPolarHBondContact O-CG1 3.08Å; L135-I139 PolarHBondContact O-N 3.33Å
136G94.8Very high87.6Confident0 Ų057.1 Ų57.10%031%0.306CS..Hα-helixtrans-53.1-64.2-174.100000113.3A113 I139 L140A113-G136 WeakPolarHBondContact CB-O 3.46Å; G136-I139 PolarHBondContact O-N 3.45Å; G136-L140 PolarHBondContact O-N 3.02Å
137F96.5Very high89.2Confident9 Ų949.3 Ų49.34%0.03926%0.264CS..Hα-helixtrans-63-42.4-179.8-171.5-92.8000113.9W49 S52 I53 S64 V65 L68 I139 L140 M141W49-F137 HydrophobicContact CB-CB 4.23Å; W49-F137 HydrophobicContact CB-CD2 4.33Å; W49-F137 HydrophobicContact CG-CB 4.45Å; S52-F137 WeakPolarHBondContact OG-CB 3.4Å; S52-F137 PolarHBondContact OG-N 3.45Å; I53-F137 HydrophobicContact CB-CG 4.41Å; I53-F137 HydrophobicContact CD1-CD2 4.33Å; I53-F137 HydrophobicContact CG1-CB 4.04Å; I53-F137 HydrophobicContact CG1-CD1 4.39Å; I53-F137 HydrophobicContact CG1-CD2 3.5Å; I53-F137 HydrophobicContact CG1-CE2 4.01Å; I53-F137 HydrophobicContact CG1-CG 3.72Å; S64-F137 VanDerWaalsContact O-CZ 3.29Å; S64-F137 WeakPolarHBondContact O-CZ 3.46Å; V65-F137 HydrophobicContact CG2-CE2 4.45Å; L68-F137 HydrophobicContact CD1-CE2 4.12Å; L68-F137 HydrophobicContact CD2-CE2 4.31Å; L68-F137 HydrophobicContact CD2-CZ 4.36Å; L68-F137 HydrophobicContact CG-CE2 4.24Å; L68-F137 HydrophobicContact CG-CZ 4.3Å; F137-I139 VanDerWaalsContact C-N 3.34Å; F137-I139 PolarHBondContact O-N 3.18Å; F137-L140 HydrophobicContact CD2-CD2 4.07Å; F137-L140 HydrophobicContact CE2-CD2 4.3Å; F137-L140 WeakPolarHBondContact O-CB 3.28Å; F137-L140 PolarHBondContact O-N 2.95Å; F137-M141 HydrophobicContact CE1-CB 4.47Å; F137-M141 WeakPolarHBondContact O-CB 3.44Å; F137-M141 PolarHBondContact O-N 3.27Å
138P97.1Very high90.4Very high66 Ų6645.6 Ų45.643%0.42925%0.245SC..Hα-helixtrans-55.8-42.2172.1-29.736000114.3K134 L135 M141 F142K134-P138 WeakPolarHBondContact O-CD 3.33Å; K134-P138 WeakPolarHBondContact O-CG 3.49Å; L135-P138 WeakPolarHBondContact O-CD 3.45Å; P138-M141 PolarHBondContact O-N 3.35Å; P138-F142 WeakPolarHBondContact O-CB 3.47Å; P138-F142 PolarHBondContact O-N 3.24Å
139I97.7Very high91.5Very high43 Ų4343.1 Ų43.122%0.22122%0.222CC..Hα-helixtrans-67.5-41.2175.9-65.3168000110.4I109 I112 A113 V116 L135 G136 F137 M141 F142 G143I109-I139 HydrophobicContact CG2-CG2 3.77Å; I109-I139 WeakPolarHBondContact CG2-O 3.23Å; I112-I139 HydrophobicContact CB-CG2 4.42Å; I112-I139 HydrophobicContact CG2-CG2 4.45Å; A113-I139 HydrophobicContact CB-CB 4.01Å; A113-I139 HydrophobicContact CB-CG2 3.84Å; V116-I139 HydrophobicContact CG2-CD1 4.21Å; L135-I139 HydrophobicContact CB-CD1 3.87Å; L135-I139 HydrophobicContact CB-CG1 4.43Å; L135-I139 WeakPolarHBondContact O-CB 3.32Å; L135-I139 WeakPolarHBondContact O-CG1 3.08Å; L135-I139 PolarHBondContact O-N 3.33Å; G136-I139 PolarHBondContact O-N 3.45Å; F137-I139 VanDerWaalsContact C-N 3.34Å; F137-I139 PolarHBondContact O-N 3.18Å; I139-M141 VanDerWaalsContact C-N 3.33Å; I139-M141 PolarHBondContact O-N 3.27Å; I139-F142 PolarHBondContact O-N 3.43Å; I139-G143 PolarHBondContact O-N 3.01Å
140L98.2Very high92.6Very high0 Ų041.6 Ų41.60%021%0.214CC..Hα-helixtrans-57.3-48.8175.2179.971.8000110.6L38 W49 L68 K110 A113 G136 F137 F142 G143 Q144L38-L140 HydrophobicContact CD1-CD1 3.81Å; L38-L140 HydrophobicContact CD1-CD2 4.27Å; L38-L140 HydrophobicContact CD1-CG 4.3Å; W49-L140 HydrophobicContact CD2-CD2 4.08Å; W49-L140 HydrophobicContact CE3-CD2 3.88Å; W49-L140 HydrophobicContact CH2-CD1 4.01Å; W49-L140 HydrophobicContact CH2-CD2 3.94Å; W49-L140 HydrophobicContact CZ2-CD1 4.13Å; W49-L140 HydrophobicContact CZ2-CD2 4.14Å; W49-L140 HydrophobicContact CZ3-CD2 3.81Å; L68-L140 HydrophobicContact CD1-CD2 4.08Å; L68-L140 HydrophobicContact CD2-CD2 3.95Å; L68-L140 HydrophobicContact CD2-CG 4.06Å; K110-L140 HydrophobicContact CB-CD1 3.99Å; K110-L140 HydrophobicContact CD-CD1 4.18Å; K110-L140 HydrophobicContact CG-CD1 3.76Å; A113-L140 HydrophobicContact CB-CB 3.72Å; A113-L140 HydrophobicContact CB-CD1 4.4Å; G136-L140 PolarHBondContact O-N 3.02Å; F137-L140 HydrophobicContact CD2-CD2 4.07Å; F137-L140 HydrophobicContact CE2-CD2 4.3Å; F137-L140 WeakPolarHBondContact O-CB 3.28Å; F137-L140 PolarHBondContact O-N 2.95Å; L140-F142 VanDerWaalsContact C-N 3.33Å; L140-F142 PolarHBondContact O-N 3.13Å; L140-G143 PolarHBondContact O-N 3.1Å; L140-Q144 WeakPolarHBondContact O-CB 3.49Å; L140-Q144 PolarHBondContact O-N 3.25Å
141M98.2Very high93.5Very high37 Ų3739.3 Ų39.318%0.18220%0.198CC..Hα-helixtrans-64.4-37.2179.8-171.760.1-17500112W67 L68 I71 F137 P138 I139 Q144 T145W67-M141 HydrophobicContact CB-CE 4.01Å; L68-M141 HydrophobicContact CD2-SD 3.97Å; I71-M141 HydrophobicContact CB-CE 3.59Å; I71-M141 HydrophobicContact CD1-CE 4Å; I71-M141 HydrophobicContact CG1-CE 3.76Å; I71-M141 HydrophobicContact CG2-CE 4.02Å; F137-M141 HydrophobicContact CE1-CB 4.47Å; F137-M141 WeakPolarHBondContact O-CB 3.44Å; F137-M141 PolarHBondContact O-N 3.27Å; P138-M141 PolarHBondContact O-N 3.35Å; I139-M141 VanDerWaalsContact C-N 3.33Å; I139-M141 PolarHBondContact O-N 3.27Å; M141-Q144 PolarHBondContact O-N 2.88Å; M141-T145 WeakPolarHBondContact O-CB 3.5Å; M141-T145 PolarHBondContact O-N 3.21Å; M141-T145 PolarHBondContact O-OG1 3.45Å
142F98.4Very high94.1Very high124 Ų12432.2 Ų32.254%0.54417%0.168SC..Hα-helixtrans-62.8-46.9173-176.3-111.8000111.6I109 P138 I139 L140 Q144 T145 I146I109-F142 HydrophobicContact CD1-CD1 4.13Å; I109-F142 HydrophobicContact CD1-CE1 3.98Å; I109-F142 HydrophobicContact CG2-CD1 4.14Å; P138-F142 WeakPolarHBondContact O-CB 3.47Å; P138-F142 PolarHBondContact O-N 3.24Å; I139-F142 PolarHBondContact O-N 3.43Å; L140-F142 VanDerWaalsContact C-N 3.33Å; L140-F142 PolarHBondContact O-N 3.13Å; F142-Q144 VanDerWaalsContact C-N 3.35Å; F142-Q144 PolarHBondContact O-N 2.9Å; F142-T145 WeakPolarHBondContact O-CB 3.32Å; F142-T145 PolarHBondContact O-N 2.82Å; F142-I146 HydrophobicContact CD1-CD1 4.07Å; F142-I146 HydrophobicContact CE1-CD1 3.65Å; F142-I146 HydrophobicContact CZ-CD1 3.91Å; F142-I146 WeakPolarHBondContact O-CG1 3.29Å; F142-I146 PolarHBondContact O-N 3.46Å; F142-I146 VanDerWaalsContact O-N 3.11Å
143G98.4Very high94.8Very high0 Ų029.6 Ų29.60%015%0.151CC..Hα-helixtrans-61.1-40.517400000113.1G106 I139 L140 I146 C147G106-G143 WeakPolarHBondContact CA-O 3.18Å; I139-G143 PolarHBondContact O-N 3.01Å; L140-G143 PolarHBondContact O-N 3.1Å; G143-I146 PolarHBondContact O-N 3.24Å; G143-C147 PolarHBondContact O-N 2.69Å; G143-C147 PolarHBondContact O-SG 3.39Å
144Q98.2Very high95.8Very high0 Ų028.4 Ų28.40%015%0.146CC..Hα-helixtrans-61.8-43.8174.5-169.972.910.600111.7Q34 L68 I71 Y72 L140 M141 F142 I146 C147 G148Q34-Q144 PolarHBondContact O-NE2 3.47Å; Q34-Q144 PolarHBondContact O-OE1 3.04Å; L68-Q144 HydrophobicContact CB-CG 4.28Å; L68-Q144 HydrophobicContact CD2-CB 4.11Å; L68-Q144 HydrophobicContact CD2-CG 4.06Å; L68-Q144 WeakPolarHBondContact O-CG 3.3Å; L68-Q144 PolarHBondContact O-NE2 3.19Å; I71-Q144 HydrophobicContact CG2-CB 4.34Å; I71-Q144 HydrophobicContact CG2-CG 3.56Å; Y72-Q144 HydrophobicContact CD2-CG 4.46Å; Y72-Q144 HydrophobicContact CE2-CG 4.01Å; L140-Q144 WeakPolarHBondContact O-CB 3.49Å; L140-Q144 PolarHBondContact O-N 3.25Å; M141-Q144 PolarHBondContact O-N 2.88Å; F142-Q144 VanDerWaalsContact C-N 3.35Å; F142-Q144 PolarHBondContact O-N 2.9Å; Q144-I146 VanDerWaalsContact C-N 3.35Å; Q144-I146 PolarHBondContact O-N 2.79Å; Q144-C147 PolarHBondContact O-N 2.73Å; Q144-G148 PolarHBondContact O-N 3.49Å
145T98.5Very high95.9Very high36 Ų3625 Ų2522%0.22113%0.132CC..Hα-helixtrans-59.5-45.2177.6-54.60000110.7I71 T75 M141 F142 C147 G148 I149I71-T145 HydrophobicContact CD1-CG2 4.34Å; I71-T145 HydrophobicContact CG1-CG2 4.06Å; T75-T145 HydrophobicContact CG2-CG2 4.2Å; M141-T145 WeakPolarHBondContact O-CB 3.5Å; M141-T145 PolarHBondContact O-N 3.21Å; M141-T145 PolarHBondContact O-OG1 3.45Å; F142-T145 WeakPolarHBondContact O-CB 3.32Å; F142-T145 PolarHBondContact O-N 2.82Å; T145-C147 VanDerWaalsContact C-N 3.31Å; T145-C147 PolarHBondContact O-N 2.93Å; T145-G148 WeakPolarHBondContact O-CA 3.48Å; T145-G148 PolarHBondContact O-N 3.02Å; T145-G148 VanDerWaalsContact O-N 3.07Å; T145-I149 HydrophobicContact CG2-CD1 4.34Å; T145-I149 WeakPolarHBondContact O-CG1 3.25Å; T145-I149 PolarHBondContact O-N 3.4Å
146I98.3Very high95.4Very high20 Ų2023.5 Ų23.510%0.10313%0.133CC..Hα-helixtrans-60.5-41.2177.5-67.5169.1000111.2L102 V105 I109 F142 G143 Q144 G148 I149 A150L102-I146 HydrophobicContact CB-CG2 4.05Å; L102-I146 HydrophobicContact CD2-CG2 3.98Å; L102-I146 WeakPolarHBondContact O-CG2 3.24Å; V105-I146 HydrophobicContact CG1-CD1 4.44Å; I109-I146 HydrophobicContact CD1-CD1 3.4Å; I109-I146 VanDerWaalsContact CD1-CD1 3.4Å; F142-I146 HydrophobicContact CD1-CD1 4.07Å; F142-I146 HydrophobicContact CE1-CD1 3.65Å; F142-I146 HydrophobicContact CZ-CD1 3.91Å; F142-I146 WeakPolarHBondContact O-CG1 3.29Å; F142-I146 PolarHBondContact O-N 3.46Å; F142-I146 VanDerWaalsContact O-N 3.11Å; G143-I146 PolarHBondContact O-N 3.24Å; Q144-I146 VanDerWaalsContact C-N 3.35Å; Q144-I146 PolarHBondContact O-N 2.79Å; I146-G148 VanDerWaalsContact C-N 3.34Å; I146-I149 PolarHBondContact O-N 3.29Å; I146-A150 PolarHBondContact O-N 2.96Å; I146-A150 VanDerWaalsContact O-N 3.15Å
147C98.2Very high95.1Very high0 Ų023.7 Ų23.70%013%0.134CC..Hα-helixtrans-67.4-34.9174.8-56.40000112.1N31 Q34 Y72 N103 G143 Q144 T145 A150 Q151N31-C147 PolarHBondContact ND2-O 3.33Å; Q34-C147 HydrophobicContact CB-CB 4.41Å; Y72-C147 HydrophobicContact CE2-CB 4.18Å; Y72-C147 WeakPolarHBondContact OH-CB 3.36Å; N103-C147 PolarHBondContact OD1-O 3.29Å; G143-C147 PolarHBondContact O-N 2.69Å; G143-C147 PolarHBondContact O-SG 3.39Å; Q144-C147 PolarHBondContact O-N 2.73Å; T145-C147 VanDerWaalsContact C-N 3.31Å; T145-C147 PolarHBondContact O-N 2.93Å; C147-A150 WeakPolarHBondContact O-CB 3.45Å; C147-A150 PolarHBondContact O-N 3.12Å; C147-Q151 PolarHBondContact O-N 2.97Å
148G97.7Very high94.7Very high0 Ų023.8 Ų23.80%014%0.136CC..Hα-helixtrans-62.1-45.2172.500000112.5T75 Q144 T145 I146 A150 Q151T75-G148 WeakPolarHBondContact OG1-CA 3.49Å; T75-G148 PolarHBondContact OG1-O 2.86Å; Q144-G148 PolarHBondContact O-N 3.49Å; T145-G148 WeakPolarHBondContact O-CA 3.48Å; T145-G148 PolarHBondContact O-N 3.02Å; T145-G148 VanDerWaalsContact O-N 3.07Å; I146-G148 VanDerWaalsContact C-N 3.34Å; G148-A150 PolarHBondContact O-N 3.39Å; G148-Q151 WeakPolarHBondContact O-CB 3.37Å; G148-Q151 PolarHBondContact O-N 3.36Å
149I97.3Very high94Very high64 Ų6422.9 Ų22.933%0.32813%0.134SC..Hα-helixtrans-57.4-38.6173.7-66.5171000110.9T75 L79 L102 T145 I146 Q151 S152T75-I149 HydrophobicContact CG2-CG1 4.01Å; L79-I149 HydrophobicContact CD1-CB 4.07Å; L79-I149 HydrophobicContact CD1-CG1 3.74Å; L79-I149 HydrophobicContact CD1-CG2 3.91Å; L102-I149 HydrophobicContact CD1-CG2 3.89Å; T145-I149 HydrophobicContact CG2-CD1 4.34Å; T145-I149 WeakPolarHBondContact O-CG1 3.25Å; T145-I149 PolarHBondContact O-N 3.4Å; I146-I149 PolarHBondContact O-N 3.29Å; I149-Q151 VanDerWaalsContact C-N 3.27Å; I149-Q151 PolarHBondContact O-N 3.05Å; I149-S152 PolarHBondContact O-OG 2.92Å
150A96.6Very high93.2Very high1 Ų123.9 Ų23.91%0.00814%0.137CC..Hα-helixtrans-64.1-30.6176.800000113.2A99 L102 N103 I146 C147 G148 S152 G153 I154A99-A150 HydrophobicContact CB-CB 4.45Å; A99-A150 VanDerWaalsContact O-CB 3.28Å; A99-A150 WeakPolarHBondContact O-CB 3.27Å; L102-A150 HydrophobicContact CB-CB 3.83Å; N103-A150 HydrophobicContact CB-CB 4.46Å; N103-A150 WeakPolarHBondContact OD1-CB 3.22Å; I146-A150 PolarHBondContact O-N 2.96Å; I146-A150 VanDerWaalsContact O-N 3.15Å; C147-A150 WeakPolarHBondContact O-CB 3.45Å; C147-A150 PolarHBondContact O-N 3.12Å; G148-A150 PolarHBondContact O-N 3.39Å; A150-S152 VanDerWaalsContact C-N 3.33Å; A150-S152 PolarHBondContact O-N 3.3Å; A150-G153 PolarHBondContact O-N 3.17Å; A150-G153 VanDerWaalsContact O-N 3.16Å; A150-I154 WeakPolarHBondContact O-CG1 3.5Å
151Q95.7Very high92.7Very high12 Ų1223.9 Ų23.96%0.05614%0.137CC..Hα-helixtrans-60.7-39-176.6-174.9-175.454.600112.5N31 Y72 Y76 C147 G148 I149 G153 I154 L155N31-Q151 WeakPolarHBondContact OD1-CA 3.45Å; N31-Q151 VanDerWaalsContact OD1-CB 3.31Å; N31-Q151 WeakPolarHBondContact OD1-CB 3.19Å; N31-Q151 WeakPolarHBondContact OD1-CG 3.45Å; Y72-Q151 HydrophobicContact CD1-CB 4.02Å; Y72-Q151 HydrophobicContact CD1-CG 4.3Å; Y72-Q151 HydrophobicContact CE1-CB 4.37Å; Y72-Q151 PolarHBondContact O-OE1 3.41Å; Y76-Q151 HydrophobicContact CD2-CG 4.48Å; C147-Q151 PolarHBondContact O-N 2.97Å; G148-Q151 WeakPolarHBondContact O-CB 3.37Å; G148-Q151 PolarHBondContact O-N 3.36Å; I149-Q151 VanDerWaalsContact C-N 3.27Å; I149-Q151 PolarHBondContact O-N 3.05Å; Q151-G153 PolarHBondContact O-N 3.29Å; Q151-I154 PolarHBondContact O-N 3.25Å; Q151-L155 HydrophobicContact CG-CB 4.45Å; Q151-L155 PolarHBondContact O-N 3.27Å
152S92.3Very high92.1Very high6 Ų622.2 Ų22.24%0.04213%0.129CC..Hα-helixtrans-62.4-26.3-179.166.60000112.4L79 S83 I149 A150L79-S152 WeakPolarHBondContact CB-OG 3.34Å; S83-S152 VanDerWaalsContact CB-O 3.23Å; S83-S152 WeakPolarHBondContact CB-O 3.05Å; S83-S152 WeakPolarHBondContact OG-CB 3.33Å; S83-S152 PolarHBondContact OG-OG 3.43Å; I149-S152 PolarHBondContact O-OG 2.92Å; A150-S152 VanDerWaalsContact C-N 3.33Å; A150-S152 PolarHBondContact O-N 3.3Å
153G90.8Very high91.4Very high8 Ų818 Ų188%0.08212%0.118CC..THydrogen-bonded Turntrans-87.12.4173.200000115.1S83 T95 A150 Q151 I157S83-G153 PolarHBondContact OG-N 3.02Å; T95-G153 WeakPolarHBondContact CG2-O 3.41Å; A150-G153 PolarHBondContact O-N 3.17Å; A150-G153 VanDerWaalsContact O-N 3.16Å; Q151-G153 PolarHBondContact O-N 3.29Å; G153-I157 WeakPolarHBondContact O-CD1 3.36Å
154I92.8Very high90.7Very high0 Ų019.1 Ų19.10%012%0.124CC..THydrogen-bonded Turntrans-120.2-50.6-174.8-68.5171.6000111.5F24 N31 A99 N103 A150 Q151 G156 I157F24-I154 HydrophobicContact CE2-CG2 4.19Å; F24-I154 WeakPolarHBondContact CE2-O 3.47Å; N31-I154 HydrophobicContact CB-CD1 3.77Å; A99-I154 HydrophobicContact CB-CD1 3.98Å; A99-I154 HydrophobicContact CB-CG1 3.7Å; N103-I154 VanDerWaalsContact ND2-CD1 3.28Å; N103-I154 WeakPolarHBondContact ND2-CD1 3.43Å; A150-I154 WeakPolarHBondContact O-CG1 3.5Å; Q151-I154 PolarHBondContact O-N 3.25Å; I154-G156 VanDerWaalsContact C-N 3.29Å; I154-G156 PolarHBondContact O-N 3.48Å; I154-I157 WeakPolarHBondContact O-CB 3.06Å; I154-I157 PolarHBondContact O-N 3.32Å; I154-I157 VanDerWaalsContact O-N 3.12Å
155L87.2Confident90.3Very high31 Ų3119.4 Ų19.416%0.16213%0.125CC..THydrogen-bonded Turntrans-63.2-32.4-166-169.264.6000113.4Y76 Q151 P158Y76-L155 HydrophobicContact CD2-CD2 4.38Å; Y76-L155 HydrophobicContact CE2-CB 4.03Å; Y76-L155 HydrophobicContact CE2-CD2 3.79Å; Y76-L155 HydrophobicContact CE2-CG 4.47Å; Q151-L155 HydrophobicContact CG-CB 4.45Å; Q151-L155 PolarHBondContact O-N 3.27Å; L155-P158 VanDerWaalsContact O-CD 3.28Å; L155-P158 WeakPolarHBondContact O-CD 3.5Å
156G81.6Confident89.8Confident37 Ų3717.7 Ų17.738%0.38112%0.115SC..THydrogen-bonded Turntrans-84.3-0.8179.900000115.8I154I154-G156 VanDerWaalsContact C-N 3.29Å; I154-G156 PolarHBondContact O-N 3.48Å
157I87.8Confident89.2Confident3 Ų317 Ų172%0.01511%0.113CC..Hα-helixtrans-80.3-31.6-173-70.3-177.9000116.2F24 L92 T95 L96 G153 I154 A159 H160 L161F24-I157 HydrophobicContact CD2-CB 4.15Å; F24-I157 HydrophobicContact CD2-CG2 3.59Å; F24-I157 HydrophobicContact CE2-CB 3.51Å; F24-I157 HydrophobicContact CE2-CD1 4.49Å; F24-I157 HydrophobicContact CE2-CG2 3.47Å; F24-I157 VanDerWaalsContact CE2-CG2 3.47Å; F24-I157 HydrophobicContact CG-CG2 4.31Å; F24-I157 HydrophobicContact CZ-CB 4.03Å; F24-I157 HydrophobicContact CZ-CG2 4.1Å; L92-I157 HydrophobicContact CD1-CD1 4.04Å; L92-I157 HydrophobicContact CD1-CG1 4.43Å; L92-I157 HydrophobicContact CD1-CG2 3.54Å; T95-I157 HydrophobicContact CG2-CD1 4.08Å; L96-I157 HydrophobicContact CD1-CD1 4.45Å; L96-I157 HydrophobicContact CD2-CD1 3.47Å; L96-I157 VanDerWaalsContact CD2-CD1 3.47Å; L96-I157 HydrophobicContact CG-CD1 3.74Å; G153-I157 WeakPolarHBondContact O-CD1 3.36Å; I154-I157 WeakPolarHBondContact O-CB 3.06Å; I154-I157 PolarHBondContact O-N 3.32Å; I154-I157 VanDerWaalsContact O-N 3.12Å; I157-A159 PolarHBondContact O-N 3.47Å; I157-H160 WeakPolarHBondContact O-CB 3.04Å; I157-H160 PolarHBondContact O-N 3.07Å; I157-L161 HydrophobicContact CG2-CB 3.88Å; I157-L161 WeakPolarHBondContact O-CB 3.33Å; I157-L161 PolarHBondContact O-N 2.87Å
158P87.8Confident88.2Confident12 Ų1222.2 Ų22.28%0.07814%0.144CC..Hα-helixtrans-50.6-50.9-167.7-26.630.5000114.4F24 L155 H160 L161 A162 T175 V179F24-P158 HydrophobicContact CE1-CB 4.2Å; F24-P158 HydrophobicContact CE1-CG 3.72Å; F24-P158 HydrophobicContact CZ-CB 4.49Å; F24-P158 HydrophobicContact CZ-CG 3.64Å; L155-P158 VanDerWaalsContact O-CD 3.28Å; L155-P158 WeakPolarHBondContact O-CD 3.5Å; P158-H160 PolarHBondContact O-N 3.01Å; P158-L161 PolarHBondContact O-N 2.96Å; P158-A162 WeakPolarHBondContact O-CB 3.43Å; P158-A162 PolarHBondContact O-N 2.9Å; P158-T175 HydrophobicContact CB-CG2 4.24Å; P158-V179 HydrophobicContact CB-CG2 4.14Å; P158-V179 HydrophobicContact CG-CG2 4.13Å
159A81.5Confident87.4Confident46 Ų4629.4 Ų29.438%0.3818%0.183SC..Hα-helixtrans-65.9-38.9179.800000112.6I157 A162 A163 T175I157-A159 PolarHBondContact O-N 3.47Å; A159-A162 PolarHBondContact O-N 3.01Å; A159-A163 WeakPolarHBondContact O-CB 3.38Å; A159-A163 PolarHBondContact O-N 3.35Å; A159-T175 HydrophobicContact CB-CG2 4.31Å
160H81.7Confident86.9Confident65 Ų6528.7 Ų28.730%0.30118%0.178SC..Hα-helixtrans-65.9-45.6177.1-175.687.4000111.5I157 P158 A163 V164I157-H160 WeakPolarHBondContact O-CB 3.04Å; I157-H160 PolarHBondContact O-N 3.07Å; P158-H160 PolarHBondContact O-N 3.01Å; H160-A163 PolarHBondContact O-N 3.49Å; H160-V164 VanDerWaalsContact O-CG2 3.29Å; H160-V164 WeakPolarHBondContact O-CG2 3.13Å; H160-V164 PolarHBondContact O-N 3.38Å
161L87.6Confident86.2Confident0 Ų030.7 Ų30.70%019%0.19CC..Hα-helixtrans-59.9-47.4176.2173.370.3000111L21 F24 L92 I157 P158 A163 V164 W165L21-L161 HydrophobicContact CD1-CD2 3.73Å; F24-L161 HydrophobicContact CB-CD2 3.53Å; F24-L161 HydrophobicContact CD1-CD2 3.71Å; F24-L161 HydrophobicContact CD2-CD2 4.48Å; F24-L161 HydrophobicContact CG-CD2 3.61Å; L92-L161 HydrophobicContact CD2-CD1 3.43Å; L92-L161 VanDerWaalsContact CD2-CD1 3.43Å; I157-L161 HydrophobicContact CG2-CB 3.88Å; I157-L161 WeakPolarHBondContact O-CB 3.33Å; I157-L161 PolarHBondContact O-N 2.87Å; P158-L161 PolarHBondContact O-N 2.96Å; L161-A163 PolarHBondContact O-N 3.42Å; L161-V164 PolarHBondContact O-N 3.49Å; L161-W165 HydrophobicContact CD1-CG 4.35Å; L161-W165 WeakPolarHBondContact O-CB 3.26Å; L161-W165 PolarHBondContact O-N 3.5Å
162A86.6Confident85.3Confident1 Ų134.3 Ų34.31%0.00822%0.217CC..Hα-helixtrans-58.5-48.3177.900000111P158 A159 V164 W165 F166 V171 A174 T175P158-A162 WeakPolarHBondContact O-CB 3.43Å; P158-A162 PolarHBondContact O-N 2.9Å; A159-A162 PolarHBondContact O-N 3.01Å; A162-V164 PolarHBondContact O-N 2.96Å; A162-W165 PolarHBondContact O-N 3.12Å; A162-F166 VanDerWaalsContact O-CB 3.3Å; A162-F166 WeakPolarHBondContact O-CB 3.17Å; A162-F166 PolarHBondContact O-N 3.27Å; A162-V171 HydrophobicContact CB-CG1 3.83Å; A162-V171 WeakPolarHBondContact CB-O 3.3Å; A162-A174 HydrophobicContact CB-CB 3.8Å; A162-T175 WeakPolarHBondContact CB-OG1 3.39Å
163A81.8Confident84.9Confident37 Ų3737.5 Ų37.531%0.30624%0.236SC..Hα-helixtrans-57.6-47.8176.700000111.8A159 H160 L161 Q261A159-A163 WeakPolarHBondContact O-CB 3.38Å; A159-A163 PolarHBondContact O-N 3.35Å; H160-A163 PolarHBondContact O-N 3.49Å; L161-A163 PolarHBondContact O-N 3.42Å; A163-Q261 PolarHBondContact O-NE2 3.11Å; A163-Q261 PolarHBondContact O-OE1 3.3Å
164V85.3Confident84.8Confident23 Ų2337.2 Ų37.214%0.13923%0.233CC..Hα-helixtrans-70.9-30.4-174.5173.80000114.1H160 L161 A162 K252 P253 P257 Q261H160-V164 VanDerWaalsContact O-CG2 3.29Å; H160-V164 WeakPolarHBondContact O-CG2 3.13Å; H160-V164 PolarHBondContact O-N 3.38Å; L161-V164 PolarHBondContact O-N 3.49Å; A162-V164 PolarHBondContact O-N 2.96Å; V164-K252 HydrophobicContact CG1-CB 4Å; V164-P253 VanDerWaalsContact O-CD 3.25Å; V164-P253 WeakPolarHBondContact O-CD 3.23Å; V164-P253 WeakPolarHBondContact O-CG 3.02Å; V164-P257 WeakPolarHBondContact O-CG 3.4Å; V164-Q261 VanDerWaalsContact CA-NE2 3.3Å
165W88.4Confident84.5Confident6 Ų638.9 Ų38.92%0.02324%0.243CC..Hα-helixtrans-114.3-18.1-169.8-81.289.8000115.2R16 R17 S20 L161 A162 R250 P253R16-W165 HydrophobicContact CB-CZ3 4.19Å; R16-W165 HydrophobicContact CG-CH2 4.27Å; R16-W165 HydrophobicContact CG-CZ3 4.18Å; R17-W165 HydrophobicContact CB-CB 4.02Å; R17-W165 HydrophobicContact CB-CE3 3.79Å; R17-W165 WeakPolarHBondContact CB-O 3.39Å; S20-W165 WeakPolarHBondContact OG-CZ2 3.48Å; L161-W165 HydrophobicContact CD1-CG 4.35Å; L161-W165 WeakPolarHBondContact O-CB 3.26Å; L161-W165 PolarHBondContact O-N 3.5Å; A162-W165 PolarHBondContact O-N 3.12Å; W165-R250 HydrophobicContact CH2-CB 3.87Å; W165-R250 HydrophobicContact CZ2-CB 3.75Å; W165-R250 WeakPolarHBondContact CZ2-O 3.4Å; W165-P253 HydrophobicContact CE3-CB 4.22Å; W165-P253 HydrophobicContact CE3-CG 4.48Å; W165-P253 HydrophobicContact CZ3-CB 4.17Å
166F89.7Confident84.5Confident0 Ų039.1 Ų39.10%025%0.25CC..SBendtrans-115.2149.8-171.5-67-100.6000112.2R17 W18 L21 A162 E170 V171 A174R17-F166 HydrophobicContact CB-CE1 4.3Å; R17-F166 HydrophobicContact CB-CE2 4.16Å; R17-F166 HydrophobicContact CB-CZ 4.03Å; R17-F166 HydrophobicContact CG-CD1 4.21Å; R17-F166 HydrophobicContact CG-CE1 3.78Å; R17-F166 HydrophobicContact CG-CZ 3.96Å; W18-F166 AromaticContact CD2-CE1 3.95Å; W18-F166 HydrophobicContact CD2-CE1 3.95Å; W18-F166 HydrophobicContact CD2-CZ 4.39Å; W18-F166 AromaticContact CE2-CE1 3.94Å; W18-F166 HydrophobicContact CE3-CE1 4.03Å; W18-F166 HydrophobicContact CE3-CZ 4.29Å; W18-F166 HydrophobicContact CH2-CE1 4.1Å; W18-F166 HydrophobicContact CZ2-CE1 4.03Å; W18-F166 HydrophobicContact CZ3-CE1 4.11Å; L21-F166 HydrophobicContact CB-CE2 4.19Å; L21-F166 HydrophobicContact CB-CZ 3.89Å; L21-F166 HydrophobicContact CD2-CE1 4.43Å; L21-F166 HydrophobicContact CD2-CE2 4.34Å; L21-F166 HydrophobicContact CD2-CZ 3.71Å; L21-F166 HydrophobicContact CG-CZ 4.39Å; A162-F166 VanDerWaalsContact O-CB 3.3Å; A162-F166 WeakPolarHBondContact O-CB 3.17Å; A162-F166 PolarHBondContact O-N 3.27Å; F166-E170 HydrophobicContact CB-CB 4.16Å; F166-E170 HydrophobicContact CD1-CB 3.96Å; F166-V171 HydrophobicContact CB-CG2 4.47Å; F166-A174 HydrophobicContact CB-CB 4.31Å; F166-A174 HydrophobicContact CD1-CB 3.74Å; F166-A174 HydrophobicContact CD2-CB 3.55Å; F166-A174 HydrophobicContact CE1-CB 3.83Å; F166-A174 HydrophobicContact CE2-CB 3.66Å; F166-A174 HydrophobicContact CG-CB 3.58Å; F166-A174 HydrophobicContact CZ-CB 3.8Å
167G83.9Confident84.8Confident6 Ų640.8 Ų40.86%0.06225%0.25CC..  trans-74.7162.8174.900000110.8N169 E170 V171 P257G167-N169 PolarHBondContact O-N 3.34Å; G167-E170 PolarHBondContact O-N 3.43Å; G167-V171 WeakPolarHBondContact O-CG2 3.36Å; G167-V171 PolarHBondContact O-N 3.35Å; G167-P257 WeakPolarHBondContact CA-O 3.27Å
168V78.1Confident85Confident108 Ų10840.7 Ų40.766%0.65525%0.249SC*.THydrogen-bonded Turntrans-49.6-36.8-173.5-176.60000113.1E170V168-E170 VanDerWaalsContact C-N 3.34Å; V168-E170 PolarHBondContact O-N 2.83Å
169N80.5Confident85Confident152 Ų15242.6 Ų42.681%0.81326%0.26SS*.THydrogen-bonded Turntrans-79.5-11-177.6-60.1-20.3000114.4G167G167-N169 PolarHBondContact O-N 3.34Å
170E86.5Confident85.4Confident48 Ų4842.1 Ų42.122%0.22425%0.25CC..THydrogen-bonded Turntrans-117.1-6.3-175-62.8170.2144.500112.8R17 F166 G167 V168 S172 T173 A174R17-E170 IonicContact CZ-OE1 2.72Å; R17-E170 IonicContact CZ-OE2 2.73Å; R17-E170 IonicContact NE-OE2 3.55Å; R17-E170 IonicContact NH1-OE1 3.49Å; R17-E170 IonicContact NH1-OE2 3.6Å; R17-E170 PolarHBondContact NH1-OE2 3.48Å; R17-E170 VanDerWaalsContact NH2-CD 3.27Å; R17-E170 IonicContact NH2-OE1 3.52Å; R17-E170 PolarHBondContact NH2-OE1 2.92Å; R17-E170 IonicContact NH2-OE2 2.74Å; R17-E170 PolarHBondContact NH2-OE2 3Å; F166-E170 HydrophobicContact CB-CB 4.16Å; F166-E170 HydrophobicContact CD1-CB 3.96Å; G167-E170 PolarHBondContact O-N 3.43Å; V168-E170 VanDerWaalsContact C-N 3.34Å; V168-E170 PolarHBondContact O-N 2.83Å; E170-S172 PolarHBondContact O-N 3.25Å; E170-T173 PolarHBondContact O-N 2.9Å; E170-A174 WeakPolarHBondContact O-CB 3.46Å; E170-A174 PolarHBondContact O-N 3.36Å
171V81.7Confident85.9Confident43 Ų4339.3 Ų39.326%0.26124%0.239SC..Hα-helixtrans-58.5-48-177.6177.20000111.2A162 F166 G167 T173 A174 T175A162-V171 HydrophobicContact CB-CG1 3.83Å; A162-V171 WeakPolarHBondContact CB-O 3.3Å; F166-V171 HydrophobicContact CB-CG2 4.47Å; G167-V171 WeakPolarHBondContact O-CG2 3.36Å; G167-V171 PolarHBondContact O-N 3.35Å; V171-T173 VanDerWaalsContact C-N 3.34Å; V171-T173 PolarHBondContact O-N 3.01Å; V171-A174 PolarHBondContact O-N 2.85Å; V171-T175 WeakPolarHBondContact O-CB 3.46Å; V171-T175 PolarHBondContact O-N 3.24Å; V171-T175 PolarHBondContact O-OG1 3.01Å
172S76.7Confident86.3Confident89 Ų8940.2 Ų40.262%0.62224%0.243SC*.Hα-helixtrans-60.8-43.8179.756.80000111.9E170 T175 A176E170-S172 PolarHBondContact O-N 3.25Å; S172-T175 PolarHBondContact O-N 3.03Å; S172-A176 WeakPolarHBondContact O-CB 3.3Å; S172-A176 PolarHBondContact O-N 3.16Å
173T84.9Confident86.6Confident73 Ų7341.2 Ų41.245%0.44825%0.248SC..Hα-helixtrans-64.2-44.1177.6-57.10000111.4E170 V171 A176 L177E170-T173 PolarHBondContact O-N 2.9Å; V171-T173 VanDerWaalsContact C-N 3.34Å; V171-T173 PolarHBondContact O-N 3.01Å; T173-A176 PolarHBondContact O-N 3.24Å; T173-L177 HydrophobicContact CG2-CD1 4.13Å; T173-L177 WeakPolarHBondContact O-CB 3.5Å; T173-L177 WeakPolarHBondContact O-CG 3.29Å; T173-L177 PolarHBondContact O-N 3.47Å
174A88.4Confident87.3Confident1 Ų142.7 Ų42.71%0.00825%0.25CS..Hα-helixtrans-65.3-41.6178.500000112.2L21 A162 F166 E170 V171 G178L21-A174 HydrophobicContact CD2-CB 4.2Å; A162-A174 HydrophobicContact CB-CB 3.8Å; F166-A174 HydrophobicContact CB-CB 4.31Å; F166-A174 HydrophobicContact CD1-CB 3.74Å; F166-A174 HydrophobicContact CD2-CB 3.55Å; F166-A174 HydrophobicContact CE1-CB 3.83Å; F166-A174 HydrophobicContact CE2-CB 3.66Å; F166-A174 HydrophobicContact CG-CB 3.58Å; F166-A174 HydrophobicContact CZ-CB 3.8Å; E170-A174 WeakPolarHBondContact O-CB 3.46Å; E170-A174 PolarHBondContact O-N 3.36Å; V171-A174 PolarHBondContact O-N 2.85Å; A174-G178 PolarHBondContact O-N 2.99Å
175T86.6Confident87.9Confident35 Ų3541.6 Ų41.622%0.21524%0.244CC..Hα-helixtrans-60.8-48.6174-59.80000110.7P158 A159 A162 V171 S172 L177 G178 V179P158-T175 HydrophobicContact CB-CG2 4.24Å; A159-T175 HydrophobicContact CB-CG2 4.31Å; A162-T175 WeakPolarHBondContact CB-OG1 3.39Å; V171-T175 WeakPolarHBondContact O-CB 3.46Å; V171-T175 PolarHBondContact O-N 3.24Å; V171-T175 PolarHBondContact O-OG1 3.01Å; S172-T175 PolarHBondContact O-N 3.03Å; T175-L177 PolarHBondContact O-N 2.73Å; T175-G178 PolarHBondContact O-N 2.8Å; T175-G178 VanDerWaalsContact O-N 3.16Å; T175-V179 WeakPolarHBondContact O-CG2 3.3Å; T175-V179 PolarHBondContact O-N 3.36Å
176A86.4Confident88.3Confident37 Ų3741.5 Ų41.531%0.30624%0.244SC..Hα-helixtrans-58.9-47.4179.100000112.1S172 T173 G178 V179 F180S172-A176 WeakPolarHBondContact O-CB 3.3Å; S172-A176 PolarHBondContact O-N 3.16Å; T173-A176 PolarHBondContact O-N 3.24Å; A176-G178 VanDerWaalsContact C-N 3.31Å; A176-G178 PolarHBondContact O-N 2.96Å; A176-V179 PolarHBondContact O-N 3.18Å; A176-F180 HydrophobicContact CB-CE2 4.07Å; A176-F180 HydrophobicContact CB-CZ 4.25Å; A176-F180 WeakPolarHBondContact O-CD2 3.12Å; A176-F180 WeakPolarHBondContact O-CG 3.25Å; A176-F180 PolarHBondContact O-N 3.4Å
177L89.8Confident88.7Confident72 Ų7241.5 Ų41.538%0.37724%0.244SC..Hα-helixtrans-62.2-37176-72.9172.4000112.8W18 L21 C25 T173 T175 F180 G181W18-L177 HydrophobicContact CH2-CD1 4.4Å; W18-L177 HydrophobicContact CZ3-CD1 3.68Å; L21-L177 HydrophobicContact CD2-CB 4.04Å; L21-L177 HydrophobicContact CD2-CD1 4.09Å; C25-L177 PolarHBondContact SG-O 2.74Å; C25-L177 VanDerWaalsContact SG-O 3.35Å; T173-L177 HydrophobicContact CG2-CD1 4.13Å; T173-L177 WeakPolarHBondContact O-CB 3.5Å; T173-L177 WeakPolarHBondContact O-CG 3.29Å; T173-L177 PolarHBondContact O-N 3.47Å; T175-L177 PolarHBondContact O-N 2.73Å; L177-F180 PolarHBondContact O-N 3.49Å; L177-G181 PolarHBondContact O-N 2.91Å
178G90.2Very high89.3Confident0 Ų045.1 Ų45.10%026%0.258CS..Hα-helixtrans-62.7-42174.100000112.7A174 T175 A176A174-G178 PolarHBondContact O-N 2.99Å; T175-G178 PolarHBondContact O-N 2.8Å; T175-G178 VanDerWaalsContact O-N 3.16Å; A176-G178 VanDerWaalsContact C-N 3.31Å; A176-G178 PolarHBondContact O-N 2.96Å
179V88.5Confident90.3Very high52 Ų5240 Ų4032%0.31523%0.227SC..Hα-helixtrans-67.7-42.7174.6174.30000110.8P158 T175 A176 G181 N182 Q183P158-V179 HydrophobicContact CB-CG2 4.14Å; P158-V179 HydrophobicContact CG-CG2 4.13Å; T175-V179 WeakPolarHBondContact O-CG2 3.3Å; T175-V179 PolarHBondContact O-N 3.36Å; A176-V179 PolarHBondContact O-N 3.18Å; V179-G181 VanDerWaalsContact C-N 3.29Å; V179-G181 PolarHBondContact O-N 3.2Å; V179-N182 WeakPolarHBondContact O-CA 3.27Å; V179-N182 WeakPolarHBondContact O-CB 3.3Å; V179-N182 PolarHBondContact O-N 2.72Å; V179-Q183 PolarHBondContact O-N 3.1Å; V179-Q183 VanDerWaalsContact O-N 3.13Å
180F90.2Very high91.1Very high36 Ų3632.9 Ų32.916%0.15819%0.189CC..Hα-helixtrans-65.3-31.2177.9-61.2-24.4000113.2A176 L177 N182 Q183 L184 I437 S440 V441A176-F180 HydrophobicContact CB-CE2 4.07Å; A176-F180 HydrophobicContact CB-CZ 4.25Å; A176-F180 WeakPolarHBondContact O-CD2 3.12Å; A176-F180 WeakPolarHBondContact O-CG 3.25Å; A176-F180 PolarHBondContact O-N 3.4Å; L177-F180 PolarHBondContact O-N 3.49Å; F180-N182 PolarHBondContact O-N 2.82Å; F180-Q183 PolarHBondContact O-N 2.9Å; F180-L184 WeakPolarHBondContact O-CB 3.43Å; F180-L184 VanDerWaalsContact O-CG 3.31Å; F180-L184 WeakPolarHBondContact O-CG 3.21Å; F180-L184 PolarHBondContact O-N 3.3Å; F180-I437 HydrophobicContact CD1-CG1 4.44Å; F180-I437 HydrophobicContact CD1-CG2 3.92Å; F180-I437 HydrophobicContact CD2-CG2 4.46Å; F180-I437 HydrophobicContact CE1-CG2 4.02Å; F180-I437 HydrophobicContact CG-CG2 4.18Å; F180-I437 HydrophobicContact CZ-CG2 4.34Å; F180-S440 WeakPolarHBondContact CE1-OG 3.28Å; F180-V441 HydrophobicContact CE1-CG2 4.38Å; F180-V441 HydrophobicContact CE2-CG2 3.84Å; F180-V441 HydrophobicContact CZ-CG2 3.39Å
181G93Very high91.5Very high7 Ų731.6 Ų31.67%0.07218%0.183CC..Hα-helixtrans-55.4-40.1170.300000112.2F29 L177 V179 G185F29-G181 WeakPolarHBondContact CA-O 3.37Å; F29-G181 WeakPolarHBondContact CB-O 3.18Å; L177-G181 PolarHBondContact O-N 2.91Å; V179-G181 VanDerWaalsContact C-N 3.29Å; V179-G181 PolarHBondContact O-N 3.2Å; G181-G185 PolarHBondContact O-N 3.34Å
182N94.3Very high92.2Very high18 Ų1830.6 Ų30.610%0.09618%0.177CC..Hα-helixtrans-65.6-52.2173.5-165.6-92.2000111.5S28 A32 V179 F180 L184 G185 V186S28-N182 VanDerWaalsContact OG-CB 3.27Å; S28-N182 WeakPolarHBondContact OG-CB 3.5Å; S28-N182 PolarHBondContact OG-ND2 3.02Å; A32-N182 WeakPolarHBondContact CB-O 3.33Å; V179-N182 WeakPolarHBondContact O-CA 3.27Å; V179-N182 WeakPolarHBondContact O-CB 3.3Å; V179-N182 PolarHBondContact O-N 2.72Å; F180-N182 PolarHBondContact O-N 2.82Å; N182-L184 VanDerWaalsContact C-N 3.3Å; N182-L184 PolarHBondContact O-N 3.33Å; N182-G185 WeakPolarHBondContact O-CA 3.25Å; N182-G185 PolarHBondContact O-N 3.39Å; N182-V186 PolarHBondContact O-N 3.13Å; N182-V186 VanDerWaalsContact O-N 3.1Å
183Q94.5Very high93.1Very high22 Ų2226.3 Ų26.310%0.10315%0.147CC..Hα-helixtrans-59.2-40.2-177.8-62-62.384.900112.1V179 F180 G185 V186 A187 I433 I437V179-Q183 PolarHBondContact O-N 3.1Å; V179-Q183 VanDerWaalsContact O-N 3.13Å; F180-Q183 PolarHBondContact O-N 2.9Å; Q183-G185 VanDerWaalsContact C-N 3.28Å; Q183-G185 PolarHBondContact O-N 2.95Å; Q183-V186 WeakPolarHBondContact O-CB 3.45Å; Q183-V186 PolarHBondContact O-N 3.03Å; Q183-A187 PolarHBondContact O-N 2.98Å; Q183-I433 HydrophobicContact CB-CG2 4.23Å; Q183-I433 WeakPolarHBondContact O-CG2 3.33Å; Q183-I437 HydrophobicContact CB-CD1 3.87Å; Q183-I437 HydrophobicContact CB-CG1 3.76Å; Q183-I437 HydrophobicContact CG-CG1 4.34Å
184L96.4Very high93.6Very high69 Ų6923 Ų2336%0.36113%0.127SC..Hα-helixtrans-62.4-36.7175-72.5173.1000112F29 F180 N182 A187 F188 I434 I437F29-L184 HydrophobicContact CD2-CB 3.87Å; F29-L184 VanDerWaalsContact CE2-C 3.44Å; F29-L184 HydrophobicContact CE2-CB 3.96Å; F29-L184 WeakPolarHBondContact CE2-O 3.48Å; F180-L184 WeakPolarHBondContact O-CB 3.43Å; F180-L184 VanDerWaalsContact O-CG 3.31Å; F180-L184 WeakPolarHBondContact O-CG 3.21Å; F180-L184 PolarHBondContact O-N 3.3Å; N182-L184 VanDerWaalsContact C-N 3.3Å; N182-L184 PolarHBondContact O-N 3.33Å; L184-A187 PolarHBondContact O-N 2.79Å; L184-F188 VanDerWaalsContact O-CD2 3.28Å; L184-F188 WeakPolarHBondContact O-CD2 3.41Å; L184-F188 PolarHBondContact O-N 2.93Å; L184-I434 HydrophobicContact CD2-CD1 4.38Å; L184-I437 HydrophobicContact CD2-CD1 3.97Å; L184-I437 HydrophobicContact CG-CD1 4.25Å
185G97.5Very high93.8Very high0 Ų027.4 Ų27.40%015%0.15CC..Hα-helixtrans-62.3-43.2173.900000112.2F29 Y33 G181 N182 Q183 F188 G189F29-G185 WeakPolarHBondContact O-CA 3.46Å; Y33-G185 WeakPolarHBondContact CA-O 3.49Å; G181-G185 PolarHBondContact O-N 3.34Å; N182-G185 WeakPolarHBondContact O-CA 3.25Å; N182-G185 PolarHBondContact O-N 3.39Å; Q183-G185 VanDerWaalsContact C-N 3.28Å; Q183-G185 PolarHBondContact O-N 2.95Å; G185-F188 PolarHBondContact O-N 3.41Å; G185-G189 PolarHBondContact O-N 3.2Å
186V97.4Very high94.2Very high4 Ų428 Ų282%0.02415%0.151CC..Hα-helixtrans-61.5-46.3173.7-173.80000110.9A32 W35 I36 N182 Q183 F188 G189 F190 I433A32-V186 HydrophobicContact CB-CG2 3.78Å; W35-V186 HydrophobicContact CE3-CG1 4.39Å; W35-V186 HydrophobicContact CE3-CG2 4.1Å; W35-V186 HydrophobicContact CZ3-CG1 3.94Å; W35-V186 HydrophobicContact CZ3-CG2 4.04Å; I36-V186 HydrophobicContact CG2-CG1 4.12Å; N182-V186 PolarHBondContact O-N 3.13Å; N182-V186 VanDerWaalsContact O-N 3.1Å; Q183-V186 WeakPolarHBondContact O-CB 3.45Å; Q183-V186 PolarHBondContact O-N 3.03Å; V186-F188 VanDerWaalsContact C-N 3.35Å; V186-F188 PolarHBondContact O-N 3.12Å; V186-G189 CarbonylContact O-C 3.58Å; V186-G189 WeakPolarHBondContact O-CA 3.15Å; V186-G189 PolarHBondContact O-N 3.48Å; V186-F190 HydrophobicContact CG1-CD2 3.89Å; V186-F190 HydrophobicContact CG1-CE2 3.56Å; V186-F190 VanDerWaalsContact O-CD2 3.29Å; V186-F190 WeakPolarHBondContact O-CD2 3.27Å; V186-F190 PolarHBondContact O-N 3.37Å; V186-I433 HydrophobicContact CB-CD1 4.45Å; V186-I433 HydrophobicContact CB-CG1 4.39Å; V186-I433 HydrophobicContact CB-CG2 4.42Å; V186-I433 HydrophobicContact CG1-CD1 3.69Å; V186-I433 HydrophobicContact CG1-CG1 3.87Å
187A97.7Very high94.7Very high0 Ų026.6 Ų26.60%014%0.139CC..Hα-helixtrans-57.9-47.3179.300000111.5Q183 L184 G189 F190 L191 F430 I433 I434Q183-A187 PolarHBondContact O-N 2.98Å; L184-A187 PolarHBondContact O-N 2.79Å; A187-G189 VanDerWaalsContact C-N 3.28Å; A187-G189 PolarHBondContact O-N 3.03Å; A187-F190 PolarHBondContact O-N 2.98Å; A187-L191 WeakPolarHBondContact O-CB 3.26Å; A187-L191 PolarHBondContact O-N 3.15Å; A187-F430 HydrophobicContact CB-CD2 3.82Å; A187-F430 HydrophobicContact CB-CE2 4.01Å; A187-F430 WeakPolarHBondContact O-CD2 3.18Å; A187-I433 HydrophobicContact CB-CB 3.93Å; A187-I433 HydrophobicContact CB-CG2 3.77Å; A187-I434 HydrophobicContact CB-CD1 4.13Å
188F97.3Very high94.9Very high82 Ų8225 Ų2536%0.3613%0.132SC..Hα-helixtrans-67.1-31.6175.9-84.2-118.3000112.1F29 Y33 L184 G185 V186 F190 L191 V192F29-F188 HydrophobicContact CE2-CB 4.21Å; F29-F188 AromaticContact CE2-CD2 3.96Å; F29-F188 HydrophobicContact CE2-CD2 3.96Å; F29-F188 HydrophobicContact CE2-CE2 4.48Å; F29-F188 AromaticContact CE2-CG 3.99Å; F29-F188 HydrophobicContact CE2-CG 3.99Å; F29-F188 HydrophobicContact CZ-CB 3.65Å; F29-F188 AromaticContact CZ-CD1 3.82Å; F29-F188 HydrophobicContact CZ-CD1 3.82Å; F29-F188 HydrophobicContact CZ-CD2 4.02Å; F29-F188 HydrophobicContact CZ-CE1 4.47Å; F29-F188 AromaticContact CZ-CG 3.56Å; F29-F188 HydrophobicContact CZ-CG 3.56Å; Y33-F188 HydrophobicContact CD2-CB 4.27Å; L184-F188 VanDerWaalsContact O-CD2 3.28Å; L184-F188 WeakPolarHBondContact O-CD2 3.41Å; L184-F188 PolarHBondContact O-N 2.93Å; G185-F188 PolarHBondContact O-N 3.41Å; V186-F188 VanDerWaalsContact C-N 3.35Å; V186-F188 PolarHBondContact O-N 3.12Å; F188-F190 VanDerWaalsContact C-N 3.29Å; F188-F190 PolarHBondContact O-N 3.4Å; F188-L191 PolarHBondContact O-N 3.02Å; F188-V192 HydrophobicContact CB-CG2 4.32Å; F188-V192 HydrophobicContact CD1-CG2 4.02Å; F188-V192 WeakPolarHBondContact O-CB 3.39Å; F188-V192 WeakPolarHBondContact O-CG2 3.43Å; F188-V192 PolarHBondContact O-N 2.93Å
189G97.6Very high94.9Very high0 Ų027.2 Ų27.20%015%0.148CC..Hα-helixtrans-61.4-36.2172.100000112.6Y33 H37 I40 G185 V186 A187 P193Y33-G189 VanDerWaalsContact CD2-CA 3.48Å; H37-G189 WeakPolarHBondContact CA-O 3.21Å; I40-G189 WeakPolarHBondContact CG2-O 3.38Å; G185-G189 PolarHBondContact O-N 3.2Å; V186-G189 CarbonylContact O-C 3.58Å; V186-G189 WeakPolarHBondContact O-CA 3.15Å; V186-G189 PolarHBondContact O-N 3.48Å; A187-G189 VanDerWaalsContact C-N 3.28Å; A187-G189 PolarHBondContact O-N 3.03Å; G189-P193 WeakPolarHBondContact O-CD 3.5Å; G189-P193 VanDerWaalsContact O-CG 3.32Å; G189-P193 WeakPolarHBondContact O-CG 3.37Å
190F97Very high95Very high2 Ų225 Ų251%0.00914%0.135CC..Hα-helixtrans-73.3-37.5172.2-79.3-69.4000113I36 I40 V186 A187 F188 P194 G408 L411 G426 M432 I433I36-F190 HydrophobicContact CD1-CZ 4.17Å; I36-F190 HydrophobicContact CG1-CE1 3.89Å; I36-F190 HydrophobicContact CG1-CE2 3.96Å; I36-F190 HydrophobicContact CG1-CZ 3.55Å; I36-F190 HydrophobicContact CG2-CD2 4.47Å; I36-F190 HydrophobicContact CG2-CE2 4.45Å; I40-F190 HydrophobicContact CB-CD1 3.94Å; I40-F190 HydrophobicContact CB-CE1 4.36Å; I40-F190 HydrophobicContact CD1-CD1 3.54Å; I40-F190 HydrophobicContact CD1-CE1 3.89Å; I40-F190 HydrophobicContact CG1-CD1 3.62Å; I40-F190 HydrophobicContact CG1-CE1 4.3Å; V186-F190 HydrophobicContact CG1-CD2 3.89Å; V186-F190 HydrophobicContact CG1-CE2 3.56Å; V186-F190 VanDerWaalsContact O-CD2 3.29Å; V186-F190 WeakPolarHBondContact O-CD2 3.27Å; V186-F190 PolarHBondContact O-N 3.37Å; A187-F190 PolarHBondContact O-N 2.98Å; F188-F190 VanDerWaalsContact C-N 3.29Å; F188-F190 PolarHBondContact O-N 3.4Å; F190-P194 WeakPolarHBondContact O-CD 3.28Å; F190-P194 WeakPolarHBondContact O-CG 3.42Å; F190-G408 WeakPolarHBondContact CE1-O 3.49Å; F190-L411 HydrophobicContact CD1-CD2 4.36Å; F190-L411 HydrophobicContact CE1-CD2 4.1Å; F190-G426 WeakPolarHBondContact O-CA 3.32Å; F190-M432 HydrophobicContact CE2-CE 4.45Å; F190-M432 HydrophobicContact CZ-CE 4.44Å; F190-I433 HydrophobicContact CD2-CD1 4.23Å; F190-I433 HydrophobicContact CD2-CG1 3.66Å; F190-I433 HydrophobicContact CE2-CD1 3.83Å; F190-I433 HydrophobicContact CE2-CG1 3.79Å
191L95.7Very high95Very high22 Ų2225.6 Ų25.612%0.11514%0.142CC..Hα-helixtrans-85.8-48.8-168.8-176.561.8000113.8A187 F188 P194 L195 W427 F430A187-L191 WeakPolarHBondContact O-CB 3.26Å; A187-L191 PolarHBondContact O-N 3.15Å; F188-L191 PolarHBondContact O-N 3.02Å; L191-P194 WeakPolarHBondContact O-CD 3.28Å; L191-L195 HydrophobicContact CD1-CD1 3.75Å; L191-L195 HydrophobicContact CD1-CG 4.26Å; L191-L195 HydrophobicContact CG-CD1 3.76Å; L191-L195 VanDerWaalsContact O-CG 3.26Å; L191-L195 WeakPolarHBondContact O-CG 2.94Å; L191-W427 HydrophobicContact CD1-CD2 3.65Å; L191-W427 HydrophobicContact CD1-CE3 3.66Å; L191-W427 HydrophobicContact CD1-CG 4.39Å; L191-W427 HydrophobicContact CD1-CH2 3.69Å; L191-W427 HydrophobicContact CD1-CZ2 3.67Å; L191-W427 HydrophobicContact CD1-CZ3 3.68Å; L191-W427 HydrophobicContact CD2-CH2 4.4Å; L191-W427 HydrophobicContact CD2-CZ3 4.41Å; L191-F430 HydrophobicContact CB-CB 4.26Å; L191-F430 HydrophobicContact CB-CD2 3.8Å; L191-F430 HydrophobicContact CB-CG 4.25Å; L191-F430 HydrophobicContact CD1-CG 4.47Å; L191-F430 HydrophobicContact CD2-CD2 3.79Å; L191-F430 HydrophobicContact CD2-CE2 3.78Å; L191-F430 HydrophobicContact CD2-CG 4.29Å; L191-F430 HydrophobicContact CD2-CZ 4.26Å; L191-F430 HydrophobicContact CG-CD2 4.29Å
192V95.7Very high94.7Very high21 Ų2127.2 Ų27.213%0.12715%0.146CC..Hα-helixtrans-66.6-47-168.2173.40000112.7Y33 F188 L195 I196 F233Y33-V192 HydrophobicContact CE2-CB 4.1Å; Y33-V192 HydrophobicContact CE2-CG2 4.49Å; F188-V192 HydrophobicContact CB-CG2 4.32Å; F188-V192 HydrophobicContact CD1-CG2 4.02Å; F188-V192 WeakPolarHBondContact O-CB 3.39Å; F188-V192 WeakPolarHBondContact O-CG2 3.43Å; F188-V192 PolarHBondContact O-N 2.93Å; V192-L195 PolarHBondContact O-N 3.45Å; V192-I196 HydrophobicContact CG1-CD1 3.5Å; V192-I196 VanDerWaalsContact CG1-CD1 3.5Å; V192-I196 HydrophobicContact CG1-CG1 4.31Å; V192-I196 WeakPolarHBondContact O-CG1 3.39Å; V192-I196 PolarHBondContact O-N 3.38Å; V192-F233 HydrophobicContact CG1-CD1 4.3Å; V192-F233 HydrophobicContact CG1-CE1 4.05Å
193P96.6Very high94.2Very high0 Ų027.4 Ų27.40%015%0.148CC..Hα-helixtrans-60.2-50.8-176.9-21.733000113.9H37 I40 I41 G189 L195 I196 L197 M230H37-P193 HydrophobicContact CB-CG 3.76Å; H37-P193 WeakPolarHBondContact O-CB 3.34Å; H37-P193 VanDerWaalsContact O-CG 3.24Å; H37-P193 WeakPolarHBondContact O-CG 3.27Å; I40-P193 HydrophobicContact CG2-CB 4.27Å; I40-P193 HydrophobicContact CG2-CG 4.19Å; I41-P193 HydrophobicContact CD1-CB 3.98Å; I41-P193 HydrophobicContact CG1-CB 4.24Å; I41-P193 HydrophobicContact CG2-CB 3.74Å; G189-P193 WeakPolarHBondContact O-CD 3.5Å; G189-P193 VanDerWaalsContact O-CG 3.32Å; G189-P193 WeakPolarHBondContact O-CG 3.37Å; P193-L195 PolarHBondContact O-N 3.48Å; P193-L195 VanDerWaalsContact O-N 3.17Å; P193-I196 PolarHBondContact O-N 3.18Å; P193-I196 VanDerWaalsContact O-N 3.16Å; P193-L197 HydrophobicContact CB-CD1 4.22Å; P193-L197 WeakPolarHBondContact O-CD1 3.16Å; P193-L197 PolarHBondContact O-N 2.92Å; P193-M230 HydrophobicContact CB-SD 3.54Å; P193-M230 VanDerWaalsContact CB-SD 3.54Å; P193-M230 HydrophobicContact CG-SD 3.88Å
194P94.4Very high93.3Very high2 Ų231.9 Ų31.91%0.01318%0.182CC..Hα-helixtrans-69.4-11.6-179.7-21.336.7000115I40 I41 F190 L191 T423I40-P194 HydrophobicContact CG1-CG 3.97Å; I40-P194 HydrophobicContact CG2-CG 4.17Å; I41-P194 HydrophobicContact CG2-CB 4.4Å; I41-P194 HydrophobicContact CG2-CG 3.79Å; F190-P194 WeakPolarHBondContact O-CD 3.28Å; F190-P194 WeakPolarHBondContact O-CG 3.42Å; L191-P194 WeakPolarHBondContact O-CD 3.28Å; P194-T423 PolarHBondContact O-OG1 3Å
195L94.2Very high91.9Very high95 Ų9535.8 Ų35.850%0.49720%0.204SC..Hα-helixtrans-85.4-31.5172.6-72.4177.6000112.8L191 V192 P193 T423 W427L191-L195 HydrophobicContact CD1-CD1 3.75Å; L191-L195 HydrophobicContact CD1-CG 4.26Å; L191-L195 HydrophobicContact CG-CD1 3.76Å; L191-L195 VanDerWaalsContact O-CG 3.26Å; L191-L195 WeakPolarHBondContact O-CG 2.94Å; V192-L195 PolarHBondContact O-N 3.45Å; P193-L195 PolarHBondContact O-N 3.48Å; P193-L195 VanDerWaalsContact O-N 3.17Å; L195-T423 HydrophobicContact CD2-CG2 4.12Å; L195-W427 HydrophobicContact CD2-CZ2 4.35Å
196I95Very high90.2Very high48 Ų4836.7 Ų36.725%0.24621%0.213CC..Hα-helixtrans-88.3-40.7-176.9-65.7176.1000111V192 P193 Y226 I229V192-I196 HydrophobicContact CG1-CD1 3.5Å; V192-I196 VanDerWaalsContact CG1-CD1 3.5Å; V192-I196 HydrophobicContact CG1-CG1 4.31Å; V192-I196 WeakPolarHBondContact O-CG1 3.39Å; V192-I196 PolarHBondContact O-N 3.38Å; P193-I196 PolarHBondContact O-N 3.18Å; P193-I196 VanDerWaalsContact O-N 3.16Å; I196-Y226 HydrophobicContact CG2-CD1 4.02Å; I196-Y226 WeakPolarHBondContact O-CD1 3.31Å; I196-I229 HydrophobicContact CG2-CG2 4.46Å
197L95.6Very high88.6Confident7 Ų742.8 Ų42.84%0.03725%0.25CS..SBendtrans-87.3139.5-171.3-75.4138.4000112.4I41 I44 P193 V223 M227 M230I41-L197 HydrophobicContact CD1-CD1 3.37Å; I41-L197 HydrophobicContact CG2-CD1 4.33Å; I44-L197 HydrophobicContact CD1-CB 3.63Å; I44-L197 HydrophobicContact CG2-CD2 3.98Å; P193-L197 HydrophobicContact CB-CD1 4.22Å; P193-L197 WeakPolarHBondContact O-CD1 3.16Å; P193-L197 PolarHBondContact O-N 2.92Å; L197-V223 HydrophobicContact CD2-CG1 4.46Å; L197-M227 HydrophobicContact CD1-CE 4.42Å; L197-M227 HydrophobicContact CD2-CB 3.89Å; L197-M227 HydrophobicContact CD2-CE 3.76Å; L197-M227 HydrophobicContact CD2-SD 4.22Å; L197-M230 HydrophobicContact CD1-CE 4.4Å; L197-M230 HydrophobicContact CD1-SD 3.58Å; L197-M230 VanDerWaalsContact CD1-SD 3.58Å
198P93.4Very high87.2Confident37 Ų3746.2 Ų46.224%0.2427%0.269CS..PPolyproline II helixtrans-68.7137.717528.8-33.2000110.8V223 Y226P198-V223 HydrophobicContact CG-CG2 3.75Å; P198-Y226 HydrophobicContact CG-CD2 4.41Å
199S91Very high86.4Confident48 Ų4848 Ų4834%0.33628%0.278SS..PPolyproline II helixtrans-65.6146.3174.8-57.30000111.7S422S199-S422 WeakPolarHBondContact CB-OG 3.46Å; S199-S422 PolarHBondContact OG-OG 2.85Å
200I91.6Very high85.9Confident6 Ų649.4 Ų49.43%0.03129%0.285CS..PPolyproline II helixtrans-76.2123.8174.7-56-54.2000109.4I44 F47 Y202 L210 L219 V223I44-I200 HydrophobicContact CG1-CD1 4.46Å; I44-I200 HydrophobicContact CG1-CG1 4.15Å; I44-I200 HydrophobicContact CG2-CD1 4.49Å; F47-I200 HydrophobicContact CB-CD1 3.82Å; F47-I200 HydrophobicContact CB-CG1 4.22Å; F47-I200 HydrophobicContact CD1-CD1 3.72Å; F47-I200 HydrophobicContact CD2-CD1 4.22Å; F47-I200 HydrophobicContact CE1-CD1 4.33Å; F47-I200 HydrophobicContact CG-CD1 3.65Å; F47-I200 HydrophobicContact CG-CG1 4.49Å; I200-Y202 HydrophobicContact CB-CD2 4.37Å; I200-Y202 HydrophobicContact CB-CE1 4.43Å; I200-Y202 HydrophobicContact CB-CE2 3.84Å; I200-Y202 HydrophobicContact CG2-CD1 4.12Å; I200-Y202 HydrophobicContact CG2-CD2 4.4Å; I200-Y202 HydrophobicContact CG2-CE1 3.68Å; I200-Y202 HydrophobicContact CG2-CE2 4Å; I200-Y202 HydrophobicContact CG2-CG 4.46Å; I200-Y202 PolarHBondContact O-N 3.34Å; I200-L210 HydrophobicContact CG2-CD2 3.42Å; I200-L210 VanDerWaalsContact CG2-CD2 3.42Å; I200-L219 HydrophobicContact CD1-CD2 4.49Å; I200-V223 HydrophobicContact CD1-CG2 4.3Å
201P90.1Very high85.5Confident48 Ų4852.3 Ų52.331%0.31230%0.301SS..  trans-77.287.3-179.531.8-34.2000110D211 T214 L219P201-D211 HydrophobicContact CB-CB 4.47Å; P201-D211 PolarHBondContact O-N 3.21Å; P201-T214 HydrophobicContact CG-CG2 3.73Å; P201-T214 WeakPolarHBondContact CG-OG1 3.47Å; P201-L219 HydrophobicContact CG-CD2 4.04Å
202Y86.2Confident85Confident41 Ų4157 Ų5716%0.16133%0.333CS..BIsolated β-bridgetrans-75.7142175-67.2-62.6000112D43 F122 I200 Q209D43-Y202 HydrophobicContact CB-CE2 4.3Å; D43-Y202 WeakPolarHBondContact CB-OH 3.28Å; F122-Y202 HydrophobicContact CE1-CE1 4.23Å; F122-Y202 HydrophobicContact CZ-CE1 4.23Å; I200-Y202 HydrophobicContact CB-CD2 4.37Å; I200-Y202 HydrophobicContact CB-CE1 4.43Å; I200-Y202 HydrophobicContact CB-CE2 3.84Å; I200-Y202 HydrophobicContact CG2-CD1 4.12Å; I200-Y202 HydrophobicContact CG2-CD2 4.4Å; I200-Y202 HydrophobicContact CG2-CE1 3.68Å; I200-Y202 HydrophobicContact CG2-CE2 4Å; I200-Y202 HydrophobicContact CG2-CG 4.46Å; I200-Y202 PolarHBondContact O-N 3.34Å; Y202-Q209 CarbonylContact C-O 3.55Å; Y202-Q209 WeakPolarHBondContact CA-O 3.4Å
203S82.7Confident84.8Confident21 Ų2160.7 Ų60.715%0.14736%0.359CS..  trans-63.2138173.3177.20000110.8N205 Q209S203-N205 PolarHBondContact O-N 3.3Å; S203-N205 PolarHBondContact OG-N 3.17Å; S203-Q209 WeakPolarHBondContact CB-O 3.1Å; S203-Q209 PolarHBondContact N-O 3.44Å
204S76.1Confident84.6Confident116 Ų11662.2 Ų62.281%0.81137%0.369SS*.THydrogen-bonded Turntrans-65-21173.854.70000113.2
205N66.7Low84.6Confident152 Ų15266.2 Ų66.281%0.81339%0.39SS*.THydrogen-bonded Turntrans-96.3-5.5-173.2-67.8-20.7000113.9S203S203-N205 PolarHBondContact O-N 3.3Å; S203-N205 PolarHBondContact OG-N 3.17Å
206G61.3Low84.5Confident19 Ų1963.2 Ų63.220%0.19638%0.376CS..SBendtrans-156.9132.3-175.600000112.9N208G206-N208 PolarHBondContact O-N 3.1Å
207T64.3Low84.4Confident131 Ų13166.3 Ų66.380%0.80439%0.393SS*.THydrogen-bonded Turntrans-65.8131.9171.851.70000109.8Q209T207-Q209 PolarHBondContact O-N 3.4Å
208N68.4Low84.4Confident72 Ų7271.6 Ų71.639%0.38542%0.417SS..THydrogen-bonded Turntrans6315.4177.6-53.8-32.6000115.7F122 G206F122-N208 HydrophobicContact CZ-CB 4.43Å; G206-N208 PolarHBondContact O-N 3.1Å
209Q80.5Confident84.5Confident120 Ų12070.8 Ų70.856%0.56141%0.411SS*.PPolyproline II helixtrans-97.1131168.9-69-174.8-17.600109Y202 S203 T207Y202-Q209 CarbonylContact C-O 3.55Å; Y202-Q209 WeakPolarHBondContact CA-O 3.4Å; S203-Q209 WeakPolarHBondContact CB-O 3.1Å; S203-Q209 PolarHBondContact N-O 3.44Å; T207-Q209 PolarHBondContact O-N 3.4Å
210L87.3Confident84.7Confident29 Ų2968.8 Ų68.815%0.15240%0.396CS..BIsolated β-bridgetrans-63.7147.3171.7-68.4169000109.5F47 F122 I200 V216 L219F47-L210 HydrophobicContact CE2-CD1 4.13Å; F47-L210 HydrophobicContact CE2-CD2 4.49Å; F122-L210 HydrophobicContact CD1-CD1 4.15Å; F122-L210 HydrophobicContact CD1-CG 4.19Å; F122-L210 HydrophobicContact CE1-CG 4.31Å; I200-L210 HydrophobicContact CG2-CD2 3.42Å; I200-L210 VanDerWaalsContact CG2-CD2 3.42Å; L210-V216 HydrophobicContact CD1-CG2 3.99Å; L210-L219 HydrophobicContact CD2-CD2 4.19Å
211D88.4Confident84.9Confident64 Ų6473.1 Ų73.134%0.34242%0.419SS..PPolyproline II helixtrans-54.2125.4168-179.3-31.4000108.3P201 S213 T214P201-D211 HydrophobicContact CB-CB 4.47Å; P201-D211 PolarHBondContact O-N 3.21Å; D211-S213 PolarHBondContact O-N 3.29Å; D211-S213 WeakPolarHBondContact OD1-CB 3.38Å; D211-S213 PolarHBondContact OD1-N 2.65Å; D211-S213 PolarHBondContact OD1-OG 3.28Å; D211-S213 PolarHBondContact OD2-OG 3.02Å; D211-T214 WeakPolarHBondContact O-CB 3.21Å; D211-T214 PolarHBondContact O-N 2.79Å; D211-T214 PolarHBondContact O-OG1 3.38Å
212P86.6Confident85.3Confident121 Ų12174.4 Ų74.479%0.78642%0.423SS*.THydrogen-bonded Turntrans-55.8-20.7-178-26.434.6000115.1T214P212-T214 VanDerWaalsContact C-N 3.3Å
213S90.6Very high85.8Confident97 Ų9772.4 Ų72.468%0.67842%0.416SS*.THydrogen-bonded Turntrans-80.6-5.7175.866.10000114.3D211 D215D211-S213 PolarHBondContact O-N 3.29Å; D211-S213 WeakPolarHBondContact OD1-CB 3.38Å; D211-S213 PolarHBondContact OD1-N 2.65Å; D211-S213 PolarHBondContact OD1-OG 3.28Å; D211-S213 PolarHBondContact OD2-OG 3.02Å; S213-D215 PolarHBondContact O-N 3.4Å
214T92.2Very high86.5Confident32 Ų3273.3 Ų73.320%0.19642%0.417CS..  trans-74.1121-175.7-54.50000111.7P201 D211 P212 V216 L219P201-T214 HydrophobicContact CG-CG2 3.73Å; P201-T214 WeakPolarHBondContact CG-OG1 3.47Å; D211-T214 WeakPolarHBondContact O-CB 3.21Å; D211-T214 PolarHBondContact O-N 2.79Å; D211-T214 PolarHBondContact O-OG1 3.38Å; P212-T214 VanDerWaalsContact C-N 3.3Å; T214-V216 PolarHBondContact O-N 2.92Å; T214-V216 VanDerWaalsContact O-N 3.09Å; T214-L219 HydrophobicContact CG2-CB 4.14Å; T214-L219 HydrophobicContact CG2-CD2 3.77Å
215D93.7Very high87.5Confident87 Ų8773.1 Ų73.147%0.46540%0.403SS..  trans-71.6100.2162.2-175.5-23.5000109.4S213 N217 Q218 L219S213-D215 PolarHBondContact O-N 3.4Å; D215-N217 VanDerWaalsContact C-N 3.27Å; D215-N217 PolarHBondContact O-N 3.33Å; D215-N217 WeakPolarHBondContact OD1-CB 2.97Å; D215-N217 PolarHBondContact OD1-N 3.45Å; D215-Q218 HydrophobicContact CB-CB 3.9Å; D215-Q218 PolarHBondContact O-N 2.98Å; D215-Q218 PolarHBondContact OD1-N 2.97Å; D215-L219 WeakPolarHBondContact O-CB 3.5Å; D215-L219 PolarHBondContact O-N 3.37Å
216V92.7Very high89Confident31 Ų3170.8 Ų70.819%0.18838%0.384CS..Hα-helixtrans-60.7-35.5-177.1-177.80000111.8F47 T120 L210 T214 F220F47-V216 HydrophobicContact CE2-CG1 4.41Å; T120-V216 HydrophobicContact CG2-CG1 3.67Å; L210-V216 HydrophobicContact CD1-CG2 3.99Å; T214-V216 PolarHBondContact O-N 2.92Å; T214-V216 VanDerWaalsContact O-N 3.09Å; V216-F220 VanDerWaalsContact O-CB 3.22Å; V216-F220 WeakPolarHBondContact O-CB 3.24Å; V216-F220 PolarHBondContact O-N 3.24Å
217N92.7Very high90.7Very high114 Ų11469.9 Ų69.961%0.6137%0.374SS*.Hα-helixtrans-70.6-42.5-179.8-69.5-36.4000110.8D215 F220 N221D215-N217 VanDerWaalsContact C-N 3.27Å; D215-N217 PolarHBondContact O-N 3.33Å; D215-N217 WeakPolarHBondContact OD1-CB 2.97Å; D215-N217 PolarHBondContact OD1-N 3.45Å; N217-F220 PolarHBondContact O-N 3.16Å; N217-N221 PolarHBondContact O-N 3.37Å; N217-N221 PolarHBondContact O-ND2 3.4Å; N217-N221 VanDerWaalsContact O-ND2 3.13Å
218Q95.6Very high92.3Very high118 Ų11864.5 Ų64.555%0.55134%0.34SS*.Hα-helixtrans-64.5-45.9175-170.8-178.510.100111.3D215 F220 N221 N222D215-Q218 HydrophobicContact CB-CB 3.9Å; D215-Q218 PolarHBondContact O-N 2.98Å; D215-Q218 PolarHBondContact OD1-N 2.97Å; Q218-F220 VanDerWaalsContact C-N 3.34Å; Q218-F220 PolarHBondContact O-N 3.17Å; Q218-N221 PolarHBondContact O-N 3.29Å; Q218-N222 PolarHBondContact O-N 2.87Å
219L95.6Very high93.7Very high19 Ų1964.6 Ų64.610%0.09934%0.34CS..Hα-helixtrans-58.9-46.6176.3177.762.9000111F47 I200 P201 L210 T214 D215 N221 N222 V223F47-L219 HydrophobicContact CE1-CD2 4.28Å; F47-L219 HydrophobicContact CE1-CG 4.08Å; F47-L219 HydrophobicContact CE2-CD2 3.82Å; F47-L219 HydrophobicContact CE2-CG 4.42Å; F47-L219 HydrophobicContact CZ-CB 4.29Å; F47-L219 HydrophobicContact CZ-CD2 3.62Å; F47-L219 HydrophobicContact CZ-CG 3.71Å; I200-L219 HydrophobicContact CD1-CD2 4.49Å; P201-L219 HydrophobicContact CG-CD2 4.04Å; L210-L219 HydrophobicContact CD2-CD2 4.19Å; T214-L219 HydrophobicContact CG2-CB 4.14Å; T214-L219 HydrophobicContact CG2-CD2 3.77Å; D215-L219 WeakPolarHBondContact O-CB 3.5Å; D215-L219 PolarHBondContact O-N 3.37Å; L219-N221 PolarHBondContact O-N 2.87Å; L219-N222 PolarHBondContact O-N 3.27Å; L219-V223 HydrophobicContact CD1-CG2 4.11Å; L219-V223 HydrophobicContact CG-CG2 4.36Å; L219-V223 WeakPolarHBondContact O-CG2 3.29Å; L219-V223 PolarHBondContact O-N 3.01Å
220F95.4Very high94.6Very high6 Ų658.9 Ų58.93%0.02631%0.313CS..Hα-helixtrans-59.9-46.4178.4178.5-89.9000112.1F47 F48 T117 Y118 E119 T120 V216 N217 Q218 N222 V223 K224F47-F220 HydrophobicContact CE1-CB 4.32Å; F47-F220 HydrophobicContact CE1-CD2 4.31Å; F47-F220 HydrophobicContact CZ-CB 4.25Å; F48-F220 HydrophobicContact CD2-CD2 4.14Å; F48-F220 AromaticContact CD2-CE2 3.51Å; F48-F220 HydrophobicContact CD2-CE2 3.51Å; F48-F220 HydrophobicContact CD2-CZ 4Å; F48-F220 HydrophobicContact CE2-CD2 4.48Å; F48-F220 HydrophobicContact CE2-CE1 4.45Å; F48-F220 AromaticContact CE2-CE2 3.63Å; F48-F220 HydrophobicContact CE2-CE2 3.63Å; F48-F220 AromaticContact CE2-CZ 3.59Å; F48-F220 HydrophobicContact CE2-CZ 3.59Å; T117-F220 HydrophobicContact CG2-CE2 4.17Å; T117-F220 HydrophobicContact CG2-CZ 4.01Å; Y118-F220 WeakPolarHBondContact O-CE1 3.38Å; E119-F220 VanDerWaalsContact N-CZ 3.28Å; T120-F220 HydrophobicContact CG2-CB 4.22Å; T120-F220 HydrophobicContact CG2-CD2 3.82Å; T120-F220 HydrophobicContact CG2-CG 4.34Å; V216-F220 VanDerWaalsContact O-CB 3.22Å; V216-F220 WeakPolarHBondContact O-CB 3.24Å; V216-F220 PolarHBondContact O-N 3.24Å; N217-F220 PolarHBondContact O-N 3.16Å; Q218-F220 VanDerWaalsContact C-N 3.34Å; Q218-F220 PolarHBondContact O-N 3.17Å; F220-N222 VanDerWaalsContact C-N 3.31Å; F220-N222 PolarHBondContact O-N 3.38Å; F220-V223 PolarHBondContact O-N 3.1Å; F220-K224 HydrophobicContact CE1-CB 4.28Å; F220-K224 HydrophobicContact CE1-CD 3.96Å; F220-K224 HydrophobicContact CZ-CD 4.35Å; F220-K224 VanDerWaalsContact O-CB 3.31Å; F220-K224 WeakPolarHBondContact O-CB 3.47Å; F220-K224 PolarHBondContact O-N 3.46Å
221N96.6Very high95.1Very high97 Ų9757.5 Ų57.552%0.51931%0.306SS..Hα-helixtrans-61.8-39.8178.1-75.7-36.2000112.2N217 Q218 L219 H225N217-N221 PolarHBondContact O-N 3.37Å; N217-N221 PolarHBondContact O-ND2 3.4Å; N217-N221 VanDerWaalsContact O-ND2 3.13Å; Q218-N221 PolarHBondContact O-N 3.29Å; L219-N221 PolarHBondContact O-N 2.87Å; N221-H225 WeakPolarHBondContact O-CB 3.43Å; N221-H225 PolarHBondContact O-N 3.48Å
222N97Very high95.5Very high75 Ų7560.9 Ų60.940%0.40132%0.315SS..Hα-helixtrans-64.8-49.7174.8-72.9-15.1000111.5Q218 L219 F220 K224 H225 Y226Q218-N222 PolarHBondContact O-N 2.87Å; L219-N222 PolarHBondContact O-N 3.27Å; F220-N222 VanDerWaalsContact C-N 3.31Å; F220-N222 PolarHBondContact O-N 3.38Å; N222-K224 VanDerWaalsContact C-N 3.32Å; N222-K224 PolarHBondContact O-N 3.49Å; N222-H225 PolarHBondContact O-N 2.92Å; N222-Y226 VanDerWaalsContact O-CD2 3.26Å; N222-Y226 WeakPolarHBondContact O-CD2 3.28Å; N222-Y226 PolarHBondContact O-N 3.49Å; N222-Y226 VanDerWaalsContact O-N 3.17Å
223V97.2Very high96Very high0 Ų059.2 Ų59.20%030%0.296CS..Hα-helixtrans-57.8-45.9176.1170.90000110.4I44 F47 F48 L197 P198 I200 L219 F220 H225 Y226 M227I44-V223 HydrophobicContact CG2-CG1 3.67Å; I44-V223 HydrophobicContact CG2-CG2 4.5Å; F47-V223 HydrophobicContact CD1-CB 4.47Å; F47-V223 HydrophobicContact CD1-CG1 4.29Å; F47-V223 HydrophobicContact CD1-CG2 4.15Å; F47-V223 HydrophobicContact CE1-CB 4.19Å; F47-V223 HydrophobicContact CE1-CG1 4.47Å; F47-V223 HydrophobicContact CE1-CG2 3.89Å; F48-V223 HydrophobicContact CB-CG1 4.04Å; F48-V223 HydrophobicContact CD2-CG1 3.94Å; F48-V223 HydrophobicContact CG-CG1 4.19Å; L197-V223 HydrophobicContact CD2-CG1 4.46Å; P198-V223 HydrophobicContact CG-CG2 3.75Å; I200-V223 HydrophobicContact CD1-CG2 4.3Å; L219-V223 HydrophobicContact CD1-CG2 4.11Å; L219-V223 HydrophobicContact CG-CG2 4.36Å; L219-V223 WeakPolarHBondContact O-CG2 3.29Å; L219-V223 PolarHBondContact O-N 3.01Å; F220-V223 PolarHBondContact O-N 3.1Å; V223-H225 PolarHBondContact O-N 2.9Å; V223-Y226 PolarHBondContact O-N 3.28Å; V223-M227 WeakPolarHBondContact O-CB 3.35Å; V223-M227 PolarHBondContact O-N 2.77Å
224K97.1Very high96.2Very high40 Ų4054.7 Ų54.717%0.17426%0.264CS..Hα-helixtrans-57.2-48.1178-175169.4177.9169.10111.5F48 T117 F220 N222 M227 M228F48-K224 HydrophobicContact CE2-CB 3.65Å; F48-K224 HydrophobicContact CE2-CD 4.43Å; F48-K224 HydrophobicContact CE2-CG 3.86Å; F48-K224 HydrophobicContact CZ-CB 4.25Å; F48-K224 HydrophobicContact CZ-CG 4Å; T117-K224 WeakPolarHBondContact O-CD 3.43Å; T117-K224 WeakPolarHBondContact O-CE 3.35Å; T117-K224 PolarHBondContact O-NZ 3.18Å; F220-K224 HydrophobicContact CE1-CB 4.28Å; F220-K224 HydrophobicContact CE1-CD 3.96Å; F220-K224 HydrophobicContact CZ-CD 4.35Å; F220-K224 VanDerWaalsContact O-CB 3.31Å; F220-K224 WeakPolarHBondContact O-CB 3.47Å; F220-K224 PolarHBondContact O-N 3.46Å; N222-K224 VanDerWaalsContact C-N 3.32Å; N222-K224 PolarHBondContact O-N 3.49Å; K224-M227 PolarHBondContact O-N 2.93Å; K224-M228 HydrophobicContact CG-CG 4.47Å; K224-M228 WeakPolarHBondContact O-CB 3.24Å; K224-M228 VanDerWaalsContact O-CG 3.26Å; K224-M228 WeakPolarHBondContact O-CG 3.15Å; K224-M228 PolarHBondContact O-N 3.4Å
225H97.7Very high96.4Very high112 Ų11253.5 Ų53.552%0.51926%0.257SS..Hα-helixtrans-57.7-52.1-179.9-179.278.4000111.9N221 N222 V223 M228 I229N221-H225 WeakPolarHBondContact O-CB 3.43Å; N221-H225 PolarHBondContact O-N 3.48Å; N222-H225 PolarHBondContact O-N 2.92Å; V223-H225 PolarHBondContact O-N 2.9Å; H225-M228 PolarHBondContact O-N 2.93Å; H225-I229 WeakPolarHBondContact NE2-CD1 3.41Å; H225-I229 WeakPolarHBondContact O-CG1 3.35Å; H225-I229 PolarHBondContact O-N 3.24Å; H225-I229 VanDerWaalsContact O-N 3.12Å
226Y98Very high96.5Very high103 Ų10352 Ų5240%0.40426%0.257SS..Hα-helixtrans-72.7-32.7-179-73-70.2000113.5I196 P198 N222 V223 I229 M230I196-Y226 HydrophobicContact CG2-CD1 4.02Å; I196-Y226 WeakPolarHBondContact O-CD1 3.31Å; P198-Y226 HydrophobicContact CG-CD2 4.41Å; N222-Y226 VanDerWaalsContact O-CD2 3.26Å; N222-Y226 WeakPolarHBondContact O-CD2 3.28Å; N222-Y226 PolarHBondContact O-N 3.49Å; N222-Y226 VanDerWaalsContact O-N 3.17Å; V223-Y226 PolarHBondContact O-N 3.28Å; Y226-I229 HydrophobicContact CD1-CD1 4.18Å; Y226-I229 PolarHBondContact O-N 3.27Å; Y226-M230 PolarHBondContact O-N 2.89Å
227M97.9Very high96.6Very high0 Ų052.1 Ų52.10%026%0.256CS..Hα-helixtrans-60.8-45.3171.1-175.764.575.200110.8I41 I44 F48 W49 L197 V223 K224 I229 M230 L231I41-M227 HydrophobicContact CD1-CE 4.18Å; I44-M227 HydrophobicContact CG2-CE 4.18Å; F48-M227 HydrophobicContact CB-CE 4.47Å; F48-M227 HydrophobicContact CD1-CE 4.25Å; F48-M227 HydrophobicContact CD1-CG 3.92Å; F48-M227 HydrophobicContact CE1-CB 4.45Å; F48-M227 HydrophobicContact CE1-CG 3.81Å; F48-M227 HydrophobicContact CZ-CG 4.43Å; W49-M227 HydrophobicContact CH2-CE 4.27Å; W49-M227 HydrophobicContact CH2-CG 4.06Å; W49-M227 HydrophobicContact CH2-SD 3.87Å; W49-M227 HydrophobicContact CZ3-CE 3.88Å; W49-M227 HydrophobicContact CZ3-SD 4.05Å; L197-M227 HydrophobicContact CD1-CE 4.42Å; L197-M227 HydrophobicContact CD2-CB 3.89Å; L197-M227 HydrophobicContact CD2-CE 3.76Å; L197-M227 HydrophobicContact CD2-SD 4.22Å; V223-M227 WeakPolarHBondContact O-CB 3.35Å; V223-M227 PolarHBondContact O-N 2.77Å; K224-M227 PolarHBondContact O-N 2.93Å; M227-I229 PolarHBondContact O-N 3.05Å; M227-M230 PolarHBondContact O-N 3.41Å; M227-M230 HydrophobicContact SD-CE 3.49Å; M227-M230 WeakPolarHBondContact SD-CE 3.43Å; M227-L231 HydrophobicContact CG-CD1 3.99Å; M227-L231 HydrophobicContact CG-CG 4.4Å; M227-L231 WeakPolarHBondContact O-CB 3.48Å; M227-L231 VanDerWaalsContact O-CG 3.25Å; M227-L231 WeakPolarHBondContact O-CG 3.4Å; M227-L231 PolarHBondContact O-N 3.21Å; M227-L231 HydrophobicContact SD-CD1 4.49Å; M227-L231 HydrophobicContact SD-CG 4.44Å
228M98Very high96.8Very high18 Ų1846.9 Ų46.99%0.08923%0.228CC..Hα-helixtrans-63.4-42176.8-71-56.1-60.500112A115 K224 H225 M230 L231 Y232A115-M228 HydrophobicContact CB-CE 4.22Å; K224-M228 HydrophobicContact CG-CG 4.47Å; K224-M228 WeakPolarHBondContact O-CB 3.24Å; K224-M228 VanDerWaalsContact O-CG 3.26Å; K224-M228 WeakPolarHBondContact O-CG 3.15Å; K224-M228 PolarHBondContact O-N 3.4Å; H225-M228 PolarHBondContact O-N 2.93Å; M228-M230 VanDerWaalsContact C-N 3.34Å; M228-M230 PolarHBondContact O-N 3.28Å; M228-L231 PolarHBondContact O-N 2.9Å; M228-L231 HydrophobicContact SD-CD1 4.29Å; M228-Y232 HydrophobicContact CB-CD2 4.43Å; M228-Y232 HydrophobicContact CB-CE2 4.03Å; M228-Y232 HydrophobicContact CE-CE1 3.84Å; M228-Y232 HydrophobicContact CE-CE2 3.86Å; M228-Y232 WeakPolarHBondContact CE-OH 3.49Å; M228-Y232 WeakPolarHBondContact O-CB 3.31Å; M228-Y232 WeakPolarHBondContact O-CD2 3.43Å; M228-Y232 VanDerWaalsContact O-CG 3.25Å; M228-Y232 PolarHBondContact O-N 3.29Å
229I97.8Very high96.8Very high73 Ų7344.3 Ų44.337%0.37422%0.217SC..Hα-helixtrans-57-47.8173.5-69.4169.4000110.9I196 H225 Y226 M227 L231 Y232 F233I196-I229 HydrophobicContact CG2-CG2 4.46Å; H225-I229 WeakPolarHBondContact NE2-CD1 3.41Å; H225-I229 WeakPolarHBondContact O-CG1 3.35Å; H225-I229 PolarHBondContact O-N 3.24Å; H225-I229 VanDerWaalsContact O-N 3.12Å; Y226-I229 HydrophobicContact CD1-CD1 4.18Å; Y226-I229 PolarHBondContact O-N 3.27Å; M227-I229 PolarHBondContact O-N 3.05Å; I229-L231 PolarHBondContact O-N 3.17Å; I229-Y232 PolarHBondContact O-N 3.25Å; I229-F233 WeakPolarHBondContact O-CB 3.44Å; I229-F233 PolarHBondContact O-N 3.41Å
230M97.7Very high96.7Very high0 Ų047.4 Ų47.40%023%0.234CC..Hα-helixtrans-62.6-42178.5-175-159.77100112.1L38 I41 P193 L197 Y226 M227 M228 F233 S234L38-M230 HydrophobicContact CD2-CE 4Å; I41-M230 HydrophobicContact CD1-CE 4.14Å; I41-M230 HydrophobicContact CD1-SD 4.03Å; P193-M230 HydrophobicContact CB-SD 3.54Å; P193-M230 VanDerWaalsContact CB-SD 3.54Å; P193-M230 HydrophobicContact CG-SD 3.88Å; L197-M230 HydrophobicContact CD1-CE 4.4Å; L197-M230 HydrophobicContact CD1-SD 3.58Å; L197-M230 VanDerWaalsContact CD1-SD 3.58Å; Y226-M230 PolarHBondContact O-N 2.89Å; M227-M230 PolarHBondContact O-N 3.41Å; M227-M230 HydrophobicContact SD-CE 3.49Å; M227-M230 WeakPolarHBondContact SD-CE 3.43Å; M228-M230 VanDerWaalsContact C-N 3.34Å; M228-M230 PolarHBondContact O-N 3.28Å; M230-F233 PolarHBondContact O-N 2.91Å; M230-S234 WeakPolarHBondContact O-CB 3.17Å; M230-S234 PolarHBondContact O-N 3.41Å
231L98Very high96.5Very high1 Ų147.3 Ų47.31%0.00523%0.234CC..Hα-helixtrans-66.8-41.4178.6-69.6173.5000111.7W49 K110 C111 M227 M228 I229 S234 A235W49-L231 HydrophobicContact CH2-CD1 4.33Å; W49-L231 HydrophobicContact CZ2-CD1 4.43Å; K110-L231 HydrophobicContact CB-CD2 3.99Å; C111-L231 VanDerWaalsContact SG-C 3.59Å; C111-L231 PolarHBondContact SG-O 3.21Å; C111-L231 VanDerWaalsContact SG-O 3.39Å; M227-L231 HydrophobicContact CG-CD1 3.99Å; M227-L231 HydrophobicContact CG-CG 4.4Å; M227-L231 WeakPolarHBondContact O-CB 3.48Å; M227-L231 VanDerWaalsContact O-CG 3.25Å; M227-L231 WeakPolarHBondContact O-CG 3.4Å; M227-L231 PolarHBondContact O-N 3.21Å; M227-L231 HydrophobicContact SD-CD1 4.49Å; M227-L231 HydrophobicContact SD-CG 4.44Å; M228-L231 PolarHBondContact O-N 2.9Å; M228-L231 HydrophobicContact SD-CD1 4.29Å; I229-L231 PolarHBondContact O-N 3.17Å; L231-S234 WeakPolarHBondContact O-CB 3.48Å; L231-S234 PolarHBondContact O-N 3.4Å; L231-A235 PolarHBondContact O-N 3.37Å
232Y97.5Very high96.4Very high135 Ų13545.5 Ų45.553%0.52922%0.221SC..Hα-helixtrans-64.2-43.1173.9-66.9-43.2000112.2C111 M228 I229 S234 A235 A236C111-Y232 HydrophobicContact CB-CD1 4.2Å; C111-Y232 HydrophobicContact CB-CE1 4.05Å; M228-Y232 HydrophobicContact CB-CD2 4.43Å; M228-Y232 HydrophobicContact CB-CE2 4.03Å; M228-Y232 HydrophobicContact CE-CE1 3.84Å; M228-Y232 HydrophobicContact CE-CE2 3.86Å; M228-Y232 WeakPolarHBondContact CE-OH 3.49Å; M228-Y232 WeakPolarHBondContact O-CB 3.31Å; M228-Y232 WeakPolarHBondContact O-CD2 3.43Å; M228-Y232 VanDerWaalsContact O-CG 3.25Å; M228-Y232 PolarHBondContact O-N 3.29Å; I229-Y232 PolarHBondContact O-N 3.25Å; Y232-S234 VanDerWaalsContact C-N 3.3Å; Y232-S234 PolarHBondContact O-N 3.17Å; Y232-A235 PolarHBondContact O-N 3.23Å; Y232-A236 WeakPolarHBondContact O-CB 3.21Å; Y232-A236 PolarHBondContact O-N 3.01Å
233F95.9Very high96.3Very high86 Ų8645.4 Ų45.438%0.37722%0.22SC..Hα-helixtrans-57.3-46172.2169.6-99.9000111Y33 V192 I229 M230 A235 A236 L237Y33-F233 HydrophobicContact CE2-CE1 4.21Å; Y33-F233 AromaticContact CZ-CE1 3.95Å; V192-F233 HydrophobicContact CG1-CD1 4.3Å; V192-F233 HydrophobicContact CG1-CE1 4.05Å; I229-F233 WeakPolarHBondContact O-CB 3.44Å; I229-F233 PolarHBondContact O-N 3.41Å; M230-F233 PolarHBondContact O-N 2.91Å; F233-A235 PolarHBondContact O-N 3.43Å; F233-A236 PolarHBondContact O-N 2.84Å; F233-L237 HydrophobicContact CE1-CD2 4.4Å; F233-L237 VanDerWaalsContact O-CB 3.3Å; F233-L237 WeakPolarHBondContact O-CB 3.41Å; F233-L237 PolarHBondContact O-N 3.38Å
234S95.8Very high96Very high1 Ų149.1 Ų49.11%0.00724%0.236CC..Hα-helixtrans-60.8-43.2177.6-167.30000112.6Y33 Q34 H37 M230 L231 Y232 L237 N238Y33-S234 WeakPolarHBondContact CE1-OG 3.44Å; Q34-S234 PolarHBondContact NE2-O 3.28Å; Q34-S234 PolarHBondContact NE2-OG 2.93Å; Q34-S234 PolarHBondContact OE1-OG 3.4Å; H37-S234 PolarHBondContact CE1-OG 3.49Å; M230-S234 WeakPolarHBondContact O-CB 3.17Å; M230-S234 PolarHBondContact O-N 3.41Å; L231-S234 WeakPolarHBondContact O-CB 3.48Å; L231-S234 PolarHBondContact O-N 3.4Å; Y232-S234 VanDerWaalsContact C-N 3.3Å; Y232-S234 PolarHBondContact O-N 3.17Å; S234-L237 PolarHBondContact O-N 2.84Å; S234-N238 PolarHBondContact O-N 3.42Å; S234-N238 PolarHBondContact O-ND2 3.37Å
235A97.2Very high95.7Very high7 Ų747.2 Ų47.26%0.05823%0.228CC..Hα-helixtrans-64-47.2175.400000111.4L231 Y232 F233 L237 N238 I239L231-A235 PolarHBondContact O-N 3.37Å; Y232-A235 PolarHBondContact O-N 3.23Å; F233-A235 PolarHBondContact O-N 3.43Å; A235-L237 VanDerWaalsContact C-N 3.32Å; A235-L237 PolarHBondContact O-N 2.97Å; A235-N238 PolarHBondContact O-N 3.36Å; A235-I239 VanDerWaalsContact O-CG1 3.32Å; A235-I239 WeakPolarHBondContact O-CG1 3.44Å; A235-I239 PolarHBondContact O-N 2.75Å
236A95.8Very high95.4Very high56 Ų5645.3 Ų45.346%0.46322%0.221SC..Hα-helixtrans-59.5-42177.400000112.2Y232 F233 N238 I239 L240Y232-A236 WeakPolarHBondContact O-CB 3.21Å; Y232-A236 PolarHBondContact O-N 3.01Å; F233-A236 PolarHBondContact O-N 2.84Å; A236-N238 PolarHBondContact O-N 3.23Å; A236-N238 VanDerWaalsContact O-N 3.17Å; A236-I239 PolarHBondContact O-N 3.03Å; A236-L240 PolarHBondContact O-N 3.42Å; A236-L240 VanDerWaalsContact O-N 3.1Å
237L95Very high95Very high34 Ų3448.1 Ų48.118%0.17824%0.236CC..Hα-helixtrans-58.4-26.7176.2-175.270.1000112.7F29 Y33 F233 S234 A235 P241F29-L237 HydrophobicContact CD1-CD1 3.95Å; F29-L237 HydrophobicContact CD1-CD2 4.03Å; F29-L237 HydrophobicContact CD1-CG 4.28Å; F29-L237 HydrophobicContact CE1-CD1 3.69Å; F29-L237 HydrophobicContact CE1-CD2 3.72Å; F29-L237 HydrophobicContact CE1-CG 4.2Å; Y33-L237 HydrophobicContact CD1-CD2 3.74Å; Y33-L237 HydrophobicContact CD2-CD2 4.28Å; Y33-L237 HydrophobicContact CE1-CD2 4.32Å; Y33-L237 HydrophobicContact CG-CD2 3.72Å; F233-L237 HydrophobicContact CE1-CD2 4.4Å; F233-L237 VanDerWaalsContact O-CB 3.3Å; F233-L237 WeakPolarHBondContact O-CB 3.41Å; F233-L237 PolarHBondContact O-N 3.38Å; S234-L237 PolarHBondContact O-N 2.84Å; A235-L237 VanDerWaalsContact C-N 3.32Å; A235-L237 PolarHBondContact O-N 2.97Å; L237-P241 WeakPolarHBondContact O-CD 3.25Å; L237-P241 VanDerWaalsContact O-CG 3.24Å; L237-P241 WeakPolarHBondContact O-CG 3.41Å
238N95Very high94.3Very high4 Ų448.5 Ų48.52%0.02124%0.24CC..Hα-helixtrans-100.2-24.7-179.6-73.3-81.3000113.8G30 Q34 N103 S234 A235 A236G30-N238 VanDerWaalsContact C-OD1 3.24Å; G30-N238 WeakPolarHBondContact CA-OD1 3.25Å; G30-N238 PolarHBondContact O-OD1 3.33Å; Q34-N238 WeakPolarHBondContact CG-ND2 3.49Å; Q34-N238 PolarHBondContact NE2-ND2 3.3Å; N103-N238 HydrophobicContact CB-CB 4.25Å; S234-N238 PolarHBondContact O-N 3.42Å; S234-N238 PolarHBondContact O-ND2 3.37Å; A235-N238 PolarHBondContact O-N 3.36Å; A236-N238 PolarHBondContact O-N 3.23Å; A236-N238 VanDerWaalsContact O-N 3.17Å
239I96.7Very high93.7Very high63 Ų6347.6 Ų47.632%0.32324%0.236SC..Hα-helixtrans-70.1-41.3172.4-68.6163.2000110.9A104 A235 A236 F242 I243A104-I239 HydrophobicContact CB-CG1 4Å; A235-I239 VanDerWaalsContact O-CG1 3.32Å; A235-I239 WeakPolarHBondContact O-CG1 3.44Å; A235-I239 PolarHBondContact O-N 2.75Å; A236-I239 PolarHBondContact O-N 3.03Å; I239-F242 WeakPolarHBondContact O-CB 3.32Å; I239-F242 PolarHBondContact O-N 2.93Å; I239-I243 HydrophobicContact CG2-CD1 3.73Å; I239-I243 HydrophobicContact CG2-CG1 4.25Å; I239-I243 WeakPolarHBondContact O-CG1 3.49Å; I239-I243 PolarHBondContact O-N 3.17Å
240L92.9Very high93Very high84 Ų8449.5 Ų49.544%0.4424%0.238SC..Hα-helixtrans-61.1-47.9-175.8-178.568.7000113.3A236 F242 I243 F244A236-L240 PolarHBondContact O-N 3.42Å; A236-L240 VanDerWaalsContact O-N 3.1Å; L240-F242 VanDerWaalsContact C-N 3.3Å; L240-F242 PolarHBondContact O-N 3.31Å; L240-I243 PolarHBondContact O-N 3.27Å; L240-F244 HydrophobicContact CD1-CD2 4.41Å; L240-F244 HydrophobicContact CD1-CE1 3.96Å; L240-F244 HydrophobicContact CD1-CE2 3.74Å; L240-F244 HydrophobicContact CD1-CZ 3.49Å; L240-F244 VanDerWaalsContact CD1-CZ 3.49Å; L240-F244 HydrophobicContact CD2-CE2 3.94Å; L240-F244 HydrophobicContact CD2-CZ 4.28Å; L240-F244 HydrophobicContact CG-CD2 4.1Å; L240-F244 HydrophobicContact CG-CE2 3.55Å; L240-F244 HydrophobicContact CG-CZ 3.87Å; L240-F244 WeakPolarHBondContact O-CG 3.15Å; L240-F244 PolarHBondContact O-N 2.9Å
241P91Very high92.2Very high4 Ų451.5 Ų51.53%0.02626%0.255CS..Hα-helixtrans-63.6-33.3175.1-19.431.3000113L26 C27 L237 F244 A245L26-P241 HydrophobicContact CB-CB 4.08Å; L26-P241 HydrophobicContact CB-CG 3.96Å; C27-P241 HydrophobicContact CB-CB 4.37Å; C27-P241 WeakPolarHBondContact SG-CB 3.39Å; L237-P241 WeakPolarHBondContact O-CD 3.25Å; L237-P241 VanDerWaalsContact O-CG 3.24Å; L237-P241 WeakPolarHBondContact O-CG 3.41Å; P241-F244 PolarHBondContact O-N 3.02Å; P241-A245 VanDerWaalsContact O-CB 3.28Å; P241-A245 WeakPolarHBondContact O-CB 3.48Å; P241-A245 PolarHBondContact O-N 3.1Å
242F94.5Very high91.5Very high59 Ų5958.1 Ų58.126%0.25928%0.283SS..Hα-helixtrans-62.9-46174171.7-111.6000111.6A101 I239 L240 F244 A245 L246A101-F242 HydrophobicContact CB-CD2 3.87Å; A101-F242 HydrophobicContact CB-CE2 3.6Å; A101-F242 HydrophobicContact CB-CZ 4.25Å; I239-F242 WeakPolarHBondContact O-CB 3.32Å; I239-F242 PolarHBondContact O-N 2.93Å; L240-F242 VanDerWaalsContact C-N 3.3Å; L240-F242 PolarHBondContact O-N 3.31Å; F242-F244 VanDerWaalsContact C-N 3.35Å; F242-F244 PolarHBondContact O-N 3.22Å; F242-A245 PolarHBondContact O-N 3.17Å; F242-L246 WeakPolarHBondContact O-CB 3.03Å; F242-L246 PolarHBondContact O-N 2.94Å
243I94.8Very high90.8Very high73 Ų7352.5 Ų52.537%0.37426%0.263SS..Hα-helixtrans-59.5-47175.1-66.7170.5000110.2I239 L240 A245 L246 F247I239-I243 HydrophobicContact CG2-CD1 3.73Å; I239-I243 HydrophobicContact CG2-CG1 4.25Å; I239-I243 WeakPolarHBondContact O-CG1 3.49Å; I239-I243 PolarHBondContact O-N 3.17Å; L240-I243 PolarHBondContact O-N 3.27Å; I243-A245 VanDerWaalsContact C-N 3.35Å; I243-A245 PolarHBondContact O-N 2.76Å; I243-L246 WeakPolarHBondContact O-CB 3.26Å; I243-L246 PolarHBondContact O-N 3.02Å; I243-F247 HydrophobicContact CG2-CD2 4Å; I243-F247 HydrophobicContact CG2-CE2 4.1Å; I243-F247 VanDerWaalsContact O-CD2 3.29Å; I243-F247 WeakPolarHBondContact O-CD2 3.42Å; I243-F247 PolarHBondContact O-N 3.33Å
244F91.8Very high90.1Very high78 Ų7856.5 Ų56.534%0.34228%0.281SS..Hα-helixtrans-64.2-37.6177.5-65.7-29.3000112.9I23 L26 L240 P241 F242 G248I23-F244 HydrophobicContact CD1-CB 4.35Å; I23-F244 WeakPolarHBondContact CD1-O 3.48Å; I23-F244 HydrophobicContact CG1-CB 4.02Å; L26-F244 HydrophobicContact CD1-CD2 3.9Å; L26-F244 HydrophobicContact CD1-CE2 4.04Å; L240-F244 HydrophobicContact CD1-CD2 4.41Å; L240-F244 HydrophobicContact CD1-CE1 3.96Å; L240-F244 HydrophobicContact CD1-CE2 3.74Å; L240-F244 HydrophobicContact CD1-CZ 3.49Å; L240-F244 VanDerWaalsContact CD1-CZ 3.49Å; L240-F244 HydrophobicContact CD2-CE2 3.94Å; L240-F244 HydrophobicContact CD2-CZ 4.28Å; L240-F244 HydrophobicContact CG-CD2 4.1Å; L240-F244 HydrophobicContact CG-CE2 3.55Å; L240-F244 HydrophobicContact CG-CZ 3.87Å; L240-F244 WeakPolarHBondContact O-CG 3.15Å; L240-F244 PolarHBondContact O-N 2.9Å; P241-F244 PolarHBondContact O-N 3.02Å; F242-F244 VanDerWaalsContact C-N 3.35Å; F242-F244 PolarHBondContact O-N 3.22Å; F244-G248 WeakPolarHBondContact O-CA 3.45Å; F244-G248 PolarHBondContact O-N 3.19Å
245A89.8Confident89.3Confident0 Ų058.4 Ų58.40%029%0.292CS..Hα-helixtrans-64.6-41.4174.900000111.4I23 L97 P241 F242 I243 L249I23-A245 HydrophobicContact CG2-CB 3.97Å; L97-A245 HydrophobicContact CD2-CB 3.83Å; P241-A245 VanDerWaalsContact O-CB 3.28Å; P241-A245 WeakPolarHBondContact O-CB 3.48Å; P241-A245 PolarHBondContact O-N 3.1Å; F242-A245 PolarHBondContact O-N 3.17Å; I243-A245 VanDerWaalsContact C-N 3.35Å; I243-A245 PolarHBondContact O-N 2.76Å; A245-L249 VanDerWaalsContact O-CB 3.23Å; A245-L249 WeakPolarHBondContact O-CB 3.37Å; A245-L249 PolarHBondContact O-N 3.42Å
246L91.5Very high88.5Confident72 Ų7260.3 Ų60.338%0.37730%0.3SS..Hα-helixtrans-58.7-51.1-178.6-170.566000112.1R93 L97 F242 I243R93-L246 PolarHBondContact NH2-O 3.1Å; L97-L246 HydrophobicContact CD2-CB 4.22Å; L97-L246 HydrophobicContact CD2-CD1 4.2Å; F242-L246 WeakPolarHBondContact O-CB 3.03Å; F242-L246 PolarHBondContact O-N 2.94Å; I243-L246 WeakPolarHBondContact O-CB 3.26Å; I243-L246 PolarHBondContact O-N 3.02Å
247F89.4Confident87.8Confident162 Ų16257.8 Ų57.871%0.71128%0.279SS*.Hα-helixtrans-91.6-29.5-176.2-62.5-70.2000113.7I243I243-F247 HydrophobicContact CG2-CD2 4Å; I243-F247 HydrophobicContact CG2-CE2 4.1Å; I243-F247 VanDerWaalsContact O-CD2 3.29Å; I243-F247 WeakPolarHBondContact O-CD2 3.42Å; I243-F247 PolarHBondContact O-N 3.33Å
248G84.3Confident87Confident8 Ų856.7 Ų56.78%0.08227%0.274CS..Hα-helixtrans-103.7-26.1-165.800000115.8R16 F244R16-G248 PolarHBondContact NE-O 2.93Å; R16-G248 PolarHBondContact NH2-O 3.41Å; F244-G248 WeakPolarHBondContact O-CA 3.45Å; F244-G248 PolarHBondContact O-N 3.19Å
249L84.9Confident85.9Confident0 Ų059.2 Ų59.20%029%0.287CS..  trans-85.8129.7-172.4-168.267.1000111.9R93 L96 A245R93-L249 HydrophobicContact CB-CD2 4.46Å; R93-L249 VanDerWaalsContact CD-O 3.26Å; R93-L249 WeakPolarHBondContact CD-O 3.44Å; R93-L249 HydrophobicContact CG-CD2 4.39Å; R93-L249 HydrophobicContact CG-CG 4.46Å; R93-L249 PolarHBondContact NE-O 2.8Å; R93-L249 VanDerWaalsContact NE-O 3.12Å; L96-L249 HydrophobicContact CB-CD2 3.55Å; L96-L249 HydrophobicContact CD1-CD1 4.37Å; L96-L249 HydrophobicContact CD1-CD2 3.56Å; L96-L249 HydrophobicContact CG-CD2 4.16Å; A245-L249 VanDerWaalsContact O-CB 3.23Å; A245-L249 WeakPolarHBondContact O-CB 3.37Å; A245-L249 PolarHBondContact O-N 3.42Å
250R82.9Confident84.6Confident113 Ų11359.6 Ų59.643%0.42630%0.3SS..  trans-107.4150.5167.8-82.3179.9-178.1169.36.7109.2R16 W165R16-R250 VanDerWaalsContact CZ-CD 3.42Å; W165-R250 HydrophobicContact CH2-CB 3.87Å; W165-R250 HydrophobicContact CZ2-CB 3.75Å; W165-R250 WeakPolarHBondContact CZ2-O 3.4Å
251A81.3Confident83.5Confident42 Ų4257 Ų5735%0.34729%0.286SS..SBendtrans-67.4-41.2-179.800000112.1R93R93-A251 HydrophobicContact CB-CB 3.95Å
252K83.1Confident82.5Confident139 Ų13961.5 Ų61.560%0.60430%0.303SS*.SBendtrans-150.5158.8-179.857.6178-177172.90110.9V164V164-K252 HydrophobicContact CG1-CB 4Å
253P83.9Confident81.3Confident18 Ų1864 Ų6412%0.11731%0.313CS..  trans-62.5167.6167.627.1-34.4000111.8Y14 V164 W165 T255Y14-P253 HydrophobicContact CD2-CB 3.76Å; Y14-P253 HydrophobicContact CE2-CB 4.13Å; V164-P253 VanDerWaalsContact O-CD 3.25Å; V164-P253 WeakPolarHBondContact O-CD 3.23Å; V164-P253 WeakPolarHBondContact O-CG 3.02Å; W165-P253 HydrophobicContact CE3-CB 4.22Å; W165-P253 HydrophobicContact CE3-CG 4.48Å; W165-P253 HydrophobicContact CZ3-CB 4.17Å; P253-T255 VanDerWaalsContact C-N 3.32Å; P253-T255 WeakPolarHBondContact CB-O 3.43Å; P253-T255 VanDerWaalsContact CG-O 3.29Å; P253-T255 WeakPolarHBondContact CG-O 3.4Å
254K81Confident79.9Confident169 Ų16967.9 Ų67.974%0.73532%0.323SS*.SBendtrans-70.2-30.3178.8-71-174.4175.9-172.90112.6Y14Y14-K254 HydrophobicContact CE2-CB 4.15Å
255T78.8Confident78.7Confident42 Ų4266.9 Ų66.926%0.25832%0.321SS..SBendtrans-129153.7177.557.20000109.1Y14 P253Y14-T255 WeakPolarHBondContact CE2-OG1 3.49Å; P253-T255 VanDerWaalsContact C-N 3.32Å; P253-T255 WeakPolarHBondContact CB-O 3.43Å; P253-T255 VanDerWaalsContact CG-O 3.29Å; P253-T255 WeakPolarHBondContact CG-O 3.4Å
256E80.9Confident77Confident47 Ų4768 Ų6822%0.2233%0.333CS..  trans-65.6133.1178.7-69.978.7-175.500111.4F9 S258 Q261 N265F9-E256 HydrophobicContact CE2-CB 4.32Å; F9-E256 HydrophobicContact CZ-CB 4.05Å; F9-E256 WeakPolarHBondContact CZ-O 3.04Å; E256-S258 PolarHBondContact O-N 2.75Å; E256-Q261 HydrophobicContact CB-CB 4.17Å; E256-Q261 HydrophobicContact CG-CB 4.16Å; E256-N265 PolarHBondContact OE1-ND2 2.91Å
257P79.7Confident74.8Confident3 Ų367.4 Ų67.42%0.01934%0.335CS..SBendtrans-78.6-3.6179.634.3-40.1000113.8V11 L13 V164 G167 Q261V11-P257 VanDerWaalsContact CG1-O 3.23Å; V11-P257 WeakPolarHBondContact CG1-O 3.27Å; L13-P257 HydrophobicContact CD2-CB 3.65Å; V164-P257 WeakPolarHBondContact O-CG 3.4Å; G167-P257 WeakPolarHBondContact CA-O 3.27Å; P257-Q261 VanDerWaalsContact CG-OE1 3.24Å
258S78.9Confident72.9Confident11 Ų1161.2 Ų61.28%0.07731%0.312CS..SBendtrans-152.9151.7178660000112.4E256 A260 Q261 Y262E256-S258 PolarHBondContact O-N 2.75Å; S258-A260 PolarHBondContact O-N 2.95Å; S258-Q261 PolarHBondContact O-N 3.38Å; S258-Q261 VanDerWaalsContact O-N 3.16Å; S258-Q261 PolarHBondContact OG-N 3.08Å; S258-Y262 PolarHBondContact O-N 2.81Å
259L71.7Confident71Confident56 Ų5665.1 Ų65.129%0.29333%0.33SS..Hα-helixtrans-59.3-35.2174.7-176.164.6000111.8F9 Q261 Y262 K263F9-L259 HydrophobicContact CB-CD1 4.16Å; F9-L259 HydrophobicContact CD1-CB 4.24Å; F9-L259 HydrophobicContact CD1-CD1 3.78Å; F9-L259 HydrophobicContact CE1-CB 4.26Å; F9-L259 HydrophobicContact CE1-CD1 4.46Å; F9-L259 HydrophobicContact CG-CD1 4.13Å; L259-Q261 VanDerWaalsContact C-N 3.35Å; L259-Q261 PolarHBondContact O-N 3.19Å; L259-Y262 HydrophobicContact CD1-CD1 4.14Å; L259-Y262 WeakPolarHBondContact O-CB 3.4Å; L259-Y262 PolarHBondContact O-N 3.31Å; L259-K263 HydrophobicContact CD1-CG 4.35Å; L259-K263 HydrophobicContact CG-CD 4.28Å; L259-K263 HydrophobicContact CG-CG 4.39Å; L259-K263 WeakPolarHBondContact O-CB 3.44Å; L259-K263 WeakPolarHBondContact O-CG 3.4Å; L259-K263 PolarHBondContact O-N 3.31Å
260A68.6Low69Low71 Ų7170 Ų7059%0.58736%0.356SS*.Hα-helixtrans-61.5-42.417700000111.9S258 R264S258-A260 PolarHBondContact O-N 2.95Å; A260-R264 VanDerWaalsContact O-CB 3.28Å; A260-R264 WeakPolarHBondContact O-CB 2.93Å; A260-R264 PolarHBondContact O-N 3.15Å
261Q70Confident66.9Low31 Ų3168.4 Ų68.415%0.14535%0.353CS..Hα-helixtrans-70.1-38.9174.4-80.5-165.5-23.300113A163 V164 E256 P257 S258 L259 R264 N265A163-Q261 PolarHBondContact O-NE2 3.11Å; A163-Q261 PolarHBondContact O-OE1 3.3Å; V164-Q261 VanDerWaalsContact CA-NE2 3.3Å; E256-Q261 HydrophobicContact CB-CB 4.17Å; E256-Q261 HydrophobicContact CG-CB 4.16Å; P257-Q261 VanDerWaalsContact CG-OE1 3.24Å; S258-Q261 PolarHBondContact O-N 3.38Å; S258-Q261 VanDerWaalsContact O-N 3.16Å; S258-Q261 PolarHBondContact OG-N 3.08Å; L259-Q261 VanDerWaalsContact C-N 3.35Å; L259-Q261 PolarHBondContact O-N 3.19Å; Q261-R264 PolarHBondContact O-N 2.9Å; Q261-N265 WeakPolarHBondContact O-CB 3.39Å; Q261-N265 PolarHBondContact O-N 3.48Å
262Y71.7Confident65Low98 Ų9873.2 Ų73.238%0.38437%0.367SS..Hα-helixtrans-58-50.8174.3177.6-101.2000111.2F9 S258 L259 R264 N265 G266F9-Y262 HydrophobicContact CB-CD1 4.48Å; F9-Y262 AromaticContact CD2-CD1 3.9Å; F9-Y262 HydrophobicContact CD2-CD1 3.9Å; F9-Y262 AromaticContact CD2-CD2 3.46Å; F9-Y262 HydrophobicContact CD2-CD2 3.46Å; F9-Y262 VanDerWaalsContact CD2-CD2 3.46Å; F9-Y262 HydrophobicContact CD2-CE1 4.27Å; F9-Y262 AromaticContact CD2-CE2 3.86Å; F9-Y262 HydrophobicContact CD2-CE2 3.86Å; F9-Y262 AromaticContact CD2-CG 3.48Å; F9-Y262 HydrophobicContact CD2-CG 3.48Å; F9-Y262 VanDerWaalsContact CD2-CG 3.48Å; F9-Y262 HydrophobicContact CE2-CD1 4.36Å; F9-Y262 AromaticContact CE2-CD2 3.41Å; F9-Y262 HydrophobicContact CE2-CD2 3.41Å; F9-Y262 VanDerWaalsContact CE2-CD2 3.41Å; F9-Y262 HydrophobicContact CE2-CE2 4.2Å; F9-Y262 AromaticContact CE2-CG 3.5Å; F9-Y262 HydrophobicContact CE2-CG 3.5Å; F9-Y262 HydrophobicContact CG-CD1 4.19Å; F9-Y262 HydrophobicContact CG-CD2 4.49Å; F9-Y262 HydrophobicContact CG-CG 4.12Å; F9-Y262 HydrophobicContact CZ-CD2 4.39Å; F9-Y262 HydrophobicContact CZ-CG 4.14Å; S258-Y262 PolarHBondContact O-N 2.81Å; L259-Y262 HydrophobicContact CD1-CD1 4.14Å; L259-Y262 WeakPolarHBondContact O-CB 3.4Å; L259-Y262 PolarHBondContact O-N 3.31Å; Y262-R264 VanDerWaalsContact C-N 3.34Å; Y262-R264 PolarHBondContact O-N 3.46Å; Y262-N265 PolarHBondContact O-N 3.4Å; Y262-N265 VanDerWaalsContact O-N 3.15Å; Y262-G266 PolarHBondContact O-N 3.37Å
263K68.7Low62.9Low111 Ų11171 Ų7148%0.48336%0.361SS..Hα-helixtrans-60.5-41.1176.3-70.7-171.8178.2-162.50112.2D7 L259 N265 G266 S267D7-K263 WeakPolarHBondContact OD2-CE 3.27Å; D7-K263 IonicContact OD2-NZ 3.22Å; D7-K263 PolarHBondContact OD2-NZ 2.99Å; L259-K263 HydrophobicContact CD1-CG 4.35Å; L259-K263 HydrophobicContact CG-CD 4.28Å; L259-K263 HydrophobicContact CG-CG 4.39Å; L259-K263 WeakPolarHBondContact O-CB 3.44Å; L259-K263 WeakPolarHBondContact O-CG 3.4Å; L259-K263 PolarHBondContact O-N 3.31Å; K263-N265 VanDerWaalsContact C-N 3.29Å; K263-N265 PolarHBondContact O-N 3.49Å; K263-G266 PolarHBondContact O-N 3.4Å; K263-S267 WeakPolarHBondContact O-CB 3.34Å; K263-S267 PolarHBondContact O-N 3.22Å
264R65.5Low60.9Low154 Ų15476 Ų7658%0.58138%0.382SS*.Hα-helixtrans-63.2-32.2176.6-173.4176.8178.2177.20.7113.2A260 Q261 Y262A260-R264 VanDerWaalsContact O-CB 3.28Å; A260-R264 WeakPolarHBondContact O-CB 2.93Å; A260-R264 PolarHBondContact O-N 3.15Å; Q261-R264 PolarHBondContact O-N 2.9Å; Y262-R264 VanDerWaalsContact C-N 3.34Å; Y262-R264 PolarHBondContact O-N 3.46Å
265N65.2Low59.2Low57 Ų5771.3 Ų71.331%0.30537%0.365SS..Hα-helixtrans-84.7-40.9176.8-73.1-12.1000112.2E256 Q261 Y262 K263 S268 I269E256-N265 PolarHBondContact OE1-ND2 2.91Å; Q261-N265 WeakPolarHBondContact O-CB 3.39Å; Q261-N265 PolarHBondContact O-N 3.48Å; Y262-N265 PolarHBondContact O-N 3.4Å; Y262-N265 VanDerWaalsContact O-N 3.15Å; K263-N265 VanDerWaalsContact C-N 3.29Å; K263-N265 PolarHBondContact O-N 3.49Å; N265-S268 VanDerWaalsContact O-CB 3.27Å; N265-S268 WeakPolarHBondContact O-CB 3.43Å; N265-S268 PolarHBondContact O-N 3.34Å; N265-S268 VanDerWaalsContact O-N 3.09Å; N265-I269 PolarHBondContact O-N 3.35Å
266G54.1Low57.5Low24 Ų2474.3 Ų74.325%0.24738%0.379CS..Hα-helixtrans-64-41.5-179.700000113.3Y262 K263 S268 I269 N270Y262-G266 PolarHBondContact O-N 3.37Å; K263-G266 PolarHBondContact O-N 3.4Å; G266-S268 PolarHBondContact O-N 3.08Å; G266-I269 PolarHBondContact O-N 3.43Å; G266-N270 PolarHBondContact O-N 3.43Å
267S46.5Very low55.8Low59 Ų5976.5 Ų76.541%0.41339%0.393SS..Hα-helixtrans-57.1-34.7171.5165.30000112.2K263 I269 H271K263-S267 WeakPolarHBondContact O-CB 3.34Å; K263-S267 PolarHBondContact O-N 3.22Å; S267-I269 VanDerWaalsContact C-N 3.31Å; S267-I269 PolarHBondContact O-N 3.01Å; S267-H271 WeakPolarHBondContact O-CB 3.36Å; S267-H271 PolarHBondContact O-N 2.97Å
268S48.3Very low54Low33 Ų3382.7 Ų82.723%0.23142%0.421CS..Hα-helixtrans-73-20.5178.5-163.20000113.8N265 G266N265-S268 VanDerWaalsContact O-CB 3.27Å; N265-S268 WeakPolarHBondContact O-CB 3.43Å; N265-S268 PolarHBondContact O-N 3.34Å; N265-S268 VanDerWaalsContact O-N 3.09Å; G266-S268 PolarHBondContact O-N 3.08Å
269I46Very low52.1Low90 Ų9087.8 Ų87.846%0.46245%0.447SS..Hα-helixtrans-84.9-46.8177.2-65.4171.8000109.8N265 G266 S267 H271 K272 L273N265-I269 PolarHBondContact O-N 3.35Å; G266-I269 PolarHBondContact O-N 3.43Å; S267-I269 VanDerWaalsContact C-N 3.31Å; S267-I269 PolarHBondContact O-N 3.01Å; I269-H271 VanDerWaalsContact C-N 3.27Å; I269-H271 PolarHBondContact O-N 3.28Å; I269-K272 PolarHBondContact O-N 3.24Å; I269-K272 VanDerWaalsContact O-N 3.07Å; I269-L273 HydrophobicContact CG2-CD1 4.05Å; I269-L273 PolarHBondContact O-N 3.33Å
270N41Very low50.6Low103 Ų10388.9 Ų88.955%0.55146%0.459SS*.Hα-helixtrans-60.5-36.4178.1-71.5-11.5000112.3G266 L273 Q274G266-N270 PolarHBondContact O-N 3.43Å; N270-L273 PolarHBondContact O-N 3.03Å; N270-Q274 WeakPolarHBondContact O-CG 3.44Å; N270-Q274 PolarHBondContact O-N 3.49Å
271H40.1Very low49.4Very low79 Ų7991.7 Ų91.737%0.36646%0.463SS..Hα-helixtrans-71.3-31.8175.7-166.9-89.5000113.4S267 I269 L273 I275S267-H271 WeakPolarHBondContact O-CB 3.36Å; S267-H271 PolarHBondContact O-N 2.97Å; I269-H271 VanDerWaalsContact C-N 3.27Å; I269-H271 PolarHBondContact O-N 3.28Å; H271-L273 VanDerWaalsContact C-N 3.33Å; H271-I275 WeakPolarHBondContact CE1-CD1 3.48Å; H271-I275 VanDerWaalsContact ND1-CD1 3.35Å; H271-I275 WeakPolarHBondContact ND1-CD1 3.49Å; H271-I275 WeakPolarHBondContact O-CB 3.5Å; H271-I275 WeakPolarHBondContact O-CG1 3.26Å; H271-I275 PolarHBondContact O-N 3.47Å
272K40Very low47.8Very low143 Ų14396.6 Ų96.662%0.62249%0.49SS*.Hα-helixtrans-69.5-33.3172.8-83.4-175.1175.9-1730112I269 N276I269-K272 PolarHBondContact O-N 3.24Å; I269-K272 VanDerWaalsContact O-N 3.07Å; K272-N276 WeakPolarHBondContact O-CB 3.29Å; K272-N276 PolarHBondContact O-N 3.18Å
273L40.6Very low45.9Very low93 Ų93100 Ų10049%0.48751%0.507SS..Hα-helixtrans-69.1-47.6173.3-69.6162000110.4I269 N270 H271 I275 N276 D277I269-L273 HydrophobicContact CG2-CD1 4.05Å; I269-L273 PolarHBondContact O-N 3.33Å; N270-L273 PolarHBondContact O-N 3.03Å; H271-L273 VanDerWaalsContact C-N 3.33Å; L273-I275 PolarHBondContact O-N 3.39Å; L273-N276 PolarHBondContact O-N 3.39Å; L273-N276 VanDerWaalsContact O-N 3.14Å; L273-D277 PolarHBondContact O-N 3.05Å
274Q41.1Very low44Very low121 Ų12199.8 Ų99.857%0.56552%0.517SS*.Hα-helixtrans-61.5-40177.2-76.8178.7-22.400114N270 D277 Q278N270-Q274 WeakPolarHBondContact O-CG 3.44Å; N270-Q274 PolarHBondContact O-N 3.49Å; Q274-D277 PolarHBondContact O-N 2.9Å; Q274-Q278 WeakPolarHBondContact O-CB 3.38Å; Q274-Q278 WeakPolarHBondContact O-CG 3.35Å; Q274-Q278 PolarHBondContact O-N 3.5Å
275I46.2Very low42.3Very low71 Ų71101.1 Ų101.136%0.36454%0.535SS..Hα-helixtrans-64.5-41.6174.6-75.9175.8000111H271 L273 Q278 L279H271-I275 WeakPolarHBondContact CE1-CD1 3.48Å; H271-I275 VanDerWaalsContact ND1-CD1 3.35Å; H271-I275 WeakPolarHBondContact ND1-CD1 3.49Å; H271-I275 WeakPolarHBondContact O-CB 3.5Å; H271-I275 WeakPolarHBondContact O-CG1 3.26Å; H271-I275 PolarHBondContact O-N 3.47Å; L273-I275 PolarHBondContact O-N 3.39Å; I275-Q278 PolarHBondContact O-N 3.21Å; I275-L279 HydrophobicContact CG2-CD1 3.55Å; I275-L279 WeakPolarHBondContact O-CB 3.27Å; I275-L279 WeakPolarHBondContact O-CD1 3.49Å; I275-L279 PolarHBondContact O-N 3.05Å
276N42.2Very low40.6Very low105 Ų105105.4 Ų105.456%0.56156%0.558SS**Hα-helixtrans-68.5-35.9178.5-80.2-11.7000111.9K272 L273 S280K272-N276 WeakPolarHBondContact O-CB 3.29Å; K272-N276 PolarHBondContact O-N 3.18Å; L273-N276 PolarHBondContact O-N 3.39Å; L273-N276 VanDerWaalsContact O-N 3.14Å; N276-S280 VanDerWaalsContact O-CB 3.31Å; N276-S280 WeakPolarHBondContact O-CB 3.36Å; N276-S280 PolarHBondContact O-N 3.24Å; N276-S280 PolarHBondContact O-OG 3.18Å
277D46Very low39.3Very low94 Ų94107.4 Ų107.450%0.50358%0.579SS.*Hα-helixtrans-67.8-43174.9-70.4-23.8000110.8L273 Q274 S280 I281L273-D277 PolarHBondContact O-N 3.05Å; Q274-D277 PolarHBondContact O-N 2.9Å; D277-S280 WeakPolarHBondContact CA-OG 3.37Å; D277-S280 PolarHBondContact O-N 2.98Å; D277-S280 PolarHBondContact O-OG 3.41Å; D277-I281 WeakPolarHBondContact O-CD1 3.36Å; D277-I281 VanDerWaalsContact O-CG1 3.23Å; D277-I281 WeakPolarHBondContact O-CG1 3.38Å; D277-I281 PolarHBondContact O-N 3.43Å; D277-I281 VanDerWaalsContact O-N 3.11Å
278Q41.4Very low38.4Very low132 Ų132112.3 Ų112.362%0.61760%0.598SS**Hα-helixtrans-65.3-40.7175.1-75.5-176.1-16.300113.1Q274 I275 S280 I281 D282Q274-Q278 WeakPolarHBondContact O-CB 3.38Å; Q274-Q278 WeakPolarHBondContact O-CG 3.35Å; Q274-Q278 PolarHBondContact O-N 3.5Å; I275-Q278 PolarHBondContact O-N 3.21Å; Q278-S280 PolarHBondContact O-N 3.46Å; Q278-I281 PolarHBondContact O-N 2.97Å; Q278-D282 PolarHBondContact O-N 3.45Å
279L39.3Very low37.4Very low119 Ų119120.4 Ų120.462%0.62363%0.632SS**Hα-helixtrans-69.4-20.2174.4-84.8153.6000113.5I275I275-L279 HydrophobicContact CG2-CD1 3.55Å; I275-L279 WeakPolarHBondContact O-CB 3.27Å; I275-L279 WeakPolarHBondContact O-CD1 3.49Å; I275-L279 PolarHBondContact O-N 3.05Å
280S39.7Very low36.5Very low78 Ų78120.4 Ų120.455%0.54564%0.64SS.*Hα-helixtrans-84.8-22.8174.5730000113.3N276 D277 Q278N276-S280 VanDerWaalsContact O-CB 3.31Å; N276-S280 WeakPolarHBondContact O-CB 3.36Å; N276-S280 PolarHBondContact O-N 3.24Å; N276-S280 PolarHBondContact O-OG 3.18Å; D277-S280 WeakPolarHBondContact CA-OG 3.37Å; D277-S280 PolarHBondContact O-N 2.98Å; D277-S280 PolarHBondContact O-OG 3.41Å; Q278-S280 PolarHBondContact O-N 3.46Å
281I43.3Very low36Very low130 Ų130122.2 Ų122.267%0.66766%0.655SS**Hα-helixtrans-86.5-25.1179.6-66.5165000111.8D277 Q278D277-I281 WeakPolarHBondContact O-CD1 3.36Å; D277-I281 VanDerWaalsContact O-CG1 3.23Å; D277-I281 WeakPolarHBondContact O-CG1 3.38Å; D277-I281 PolarHBondContact O-N 3.43Å; D277-I281 VanDerWaalsContact O-N 3.11Å; Q278-I281 PolarHBondContact O-N 2.97Å
282D36.5Very low35.3Very low135 Ų135125.4 Ų125.472%0.72267%0.673SS**SBendtrans-93.115.9-177.3-78.9-22.3000115.6Q278 P284Q278-D282 PolarHBondContact O-N 3.45Å; D282-P284 WeakPolarHBondContact O-CD 3.41Å
283K32.5Very low34.8Very low168 Ų168125.7 Ų125.773%0.7368%0.681SS**SBendtrans-86.8118166.3-90.4-174177-179.90110L285K283-L285 PolarHBondContact O-N 3.31Å
284P29.3Very low34.1Very low108 Ų108127.5 Ų127.570%0.70169%0.691SS**  trans-65.3123.5175.923.6-25.2000108.8D282 N286D282-P284 WeakPolarHBondContact O-CD 3.41Å; P284-N286 PolarHBondContact O-N 3.04Å
285L28Very low33.5Very low182 Ų182129.4 Ų129.495%0.95371%0.706SS**  trans-6279.2167.2-115.1103000108.8K283K283-L285 PolarHBondContact O-N 3.31Å
286N29.8Very low32.6Very low147 Ų147129.5 Ų129.579%0.78672%0.724SS**  trans-105.2103.8167.8-88.9-10.8000108.7P284P284-N286 PolarHBondContact O-N 3.04Å
287G27.1Very low31.8Very low66 Ų66131.9 Ų131.968%0.6874%0.736SS**  trans51.2113.8146.200000117.9
288I28.2Very low30.9Very low161 Ų161134.7 Ų134.783%0.82675%0.746SS**  -169.4105.2119.4-86.6144.3000106.6
289H26.1Very low30.4Very low203 Ų203136.1 Ų136.194%0.9476%0.757SS**  trans-76.7118.7154.2-103-67000107.1
290S28.8Very low29.8Very low91 Ų91139.7 Ų139.764%0.63677%0.768SS**  trans-168115.6143.648.20000113.4
291V28.9Very low29.2Very low141 Ų141145.2 Ų145.286%0.85578%0.782SS**  trans73.1108.2131.2-172.30000119.3
292I26Very low28.6Very low146 Ų146146.3 Ų146.375%0.74979%0.789SS**  trans-47.5129.6154-63159.4000111.7
293N29.4Very low28Very low148 Ų148147.7 Ų147.779%0.79180%0.797SS**  -170.3149.1122.9-119-22.2000115.6
294N26.8Very low27.8Very low132 Ų132147 Ų14771%0.70680%0.8SS**  trans-63.9151-177.8-68.3-42.4000115.4
295N27.8Very low27.8Very low161 Ų161149 Ų14986%0.86180%0.804SS**  trans135.7136.3132.3-72.4-23.7000115
296G27.2Very low27.8Very low72 Ų72150.2 Ų150.274%0.74280%0.802SS**  trans91.794.7149.600000115.8
297L24.9Very low27.7Very low156 Ų156152.4 Ų152.482%0.81781%0.807SS**  70.212184.3-140.385.3000114.9
298H27.2Very low27.8Very low153 Ų153158.5 Ų158.571%0.70882%0.815SS**  trans68.9110.1163-70.1-67.7000119.6
299D31.3Very low27.8Very low162 Ų162161.1 Ų161.187%0.86682%0.816SS**  -165.5137.695.3-106-27.5000115
300K27.1Very low27.8Very low193 Ų193158.1 Ų158.184%0.83981%0.812SS**  trans-80.2131.4173.1-84.7172.3169.5173.30109.7
301K27.8Very low27.7Very low194 Ų194163.6 Ų163.684%0.84383%0.825SS**  -176.2137.9128.2-108.3168178.5173.50114
302N28.9Very low27.7Very low154 Ų154162.8 Ų162.882%0.82483%0.825SS**  trans88.378.5158.3-59.7-6000118
303N25.7Very low27.8Very low164 Ų164164.1 Ų164.188%0.87783%0.833SS**  trans-103.1106.1164-118.6-2.3000109
304I27.5Very low27.7Very low154 Ų154165.8 Ų165.879%0.7984%0.836SS**  trans-149.6133.7150.5-53.5-177.4000104.6
305D28.2Very low28Very low148 Ų148165 Ų16579%0.79184%0.84SS**SBendtrans92.168.1-177.2-52.2-24.1000116.6
306K29.8Very low27.9Very low209 Ų209164.2 Ų164.291%0.90984%0.837SS**  trans177.565.8143.8-99.2164.9-175-177.50112
307E26.2Very low28.1Very low192 Ų192169.2 Ų169.290%0.89784%0.838SS**  trans-119.887.2161.1-100.4-173.3158.900107.5
308F29.7Very low28.1Very low194 Ų194169.8 Ų169.885%0.85184%0.836SS**SBendtrans-173.333.2154.6-125.9-88.4000114.2
309Y28.6Very low28.1Very low217 Ų217173.5 Ų173.585%0.85185%0.846SS**SBendtrans-153.160.3173.8-85.1-78.4000112
310T25.7Very low28Very low139 Ų139171.5 Ų171.585%0.85384%0.842SS**  trans-16383.2167.519.70000109.4
311K27Very low27.9Very low206 Ų206167 Ų16790%0.89684%0.841SS**SBendtrans178.692.4159.3-105.7172.4-178.9-178.80108.8
312S29.9Very low27.9Very low124 Ų124166.2 Ų166.287%0.86784%0.844SS**  trans1801.9160.935.30000114.2E314S312-E314 PolarHBondContact O-N 2.99Å
313L27.5Very low27.9Very low174 Ų174163.7 Ų163.791%0.91184%0.839SS**  trans-89.283.7166.5-84.1154000109.1
314E27.4Very low28Very low184 Ų184161.6 Ų161.686%0.8683%0.834SS**  trans17897.1158.4-103.8167.3-161.900108.5S312S312-E314 PolarHBondContact O-N 2.99Å
315S31.5Very low28.3Very low114 Ų114161.2 Ų161.280%0.79783%0.834SS**  trans161.1100.314445.30000111.9
316D27.8Very low28.2Very low146 Ų146162.2 Ų162.278%0.78183%0.834SS**  57.4116.9124-802.8000122.8
317K30.7Very low28.2Very low177 Ų177163.8 Ų163.877%0.7784%0.836SS**  123.495.8128.3-76.7166.4-176.2-1750117.6
318Q24.9Very low28.2Very low167 Ų167159.1 Ų159.178%0.7882%0.824SS**  59.4102.7111.3-161.5172.69.500118.5
319Y27.5Very low28.2Very low232 Ų232157.2 Ų157.291%0.9182%0.821SS**  trans-155.4149.8140.8-88.6-72.7000111.4
320P27.8Very low28.1Very low120 Ų120151.7 Ų151.778%0.77981%0.814SS**  trans-95.8170.2-157.937.8-34.5000115.9
321A25.6Very low28.2Very low99 Ų99150.6 Ų150.682%0.81881%0.812SS**  trans-68.7152-173.800000116.2
322L28.8Very low28.1Very low176 Ų176146.8 Ų146.892%0.92181%0.807SS**  trans-130.3135.8160.8-85.3161.9000110.2
323S27.1Very low28.1Very low101 Ų101150.7 Ų150.771%0.70681%0.808SS**  trans-81.9158.3-166.152.10000115.5
324P29.6Very low28Very low120 Ų120150.9 Ų150.978%0.77980%0.804SS**  trans-95.3134.417234.8-27000112.3
325N32.5Very low28.1Very low147 Ų147149.6 Ų149.679%0.78680%0.803SS**  trans-118112.9166.8-89.3-1.6000111.4
326E26.9Very low27.9Very low168 Ų168150.3 Ų150.379%0.78580%0.803SS**  trans23129135.8-60.3-178.4148.400120.7
327Y30.4Very low27.9Very low243 Ų243149.7 Ų149.795%0.95380%0.804SS**  -145.5127118-98.8-79.7000110.1
328S25Very low27.8Very low93 Ų93147.2 Ų147.265%0.6580%0.8SS**  trans-101.5155.8173.452.70000110.2
329I30.3Very low27.9Very low155 Ų155148.4 Ų148.480%0.79580%0.802SS**  172.9133.9119.9-81.7156.3000110.6
330S25.2Very low28.1Very low100 Ų100144.1 Ų144.170%0.69980%0.795SS**  trans-33.8158.4168.759.70000117.9
331S29.9Very low28.2Very low116 Ų116143.8 Ų143.881%0.81179%0.787SS**  -176.2162.358.749.70000113.4
332T24.8Very low28.4Very low127 Ų127142.9 Ų142.978%0.77978%0.775SS**  trans-58.1141.3-171.3-32.60000117.7
333K30Very low28.5Very low205 Ų205140.9 Ų140.989%0.89176%0.763SS**  -170.7131.4122.1-105.5175-175.9-179.40113.3
334Q25.1Very low28.5Very low178 Ų178142.3 Ų142.383%0.83276%0.761SS**  trans-64.6140.9177.2-69.6160.5-49.200111.9
335N28.9Very low28.5Very low158 Ų158142.3 Ų142.385%0.84575%0.754SS**  trans-151.4132.8131.8-106.5-12.3000111.1
336T27Very low28.3Very low129 Ų129142.4 Ų142.479%0.79175%0.754SS**  trans-69.4120.1179.640.20000111.5
337T28.1Very low28.5Very low132 Ų132140.3 Ų140.381%0.8174%0.743SS**  trans-167.1125.7153.92.90000110.1
338D27.9Very low28.4Very low125 Ų125132.4 Ų132.467%0.66872%0.72SS**  trans3597.8167.9-65.5-36.4000120.8N340D338-N340 PolarHBondContact O-N 3.1Å; D338-N340 VanDerWaalsContact O-N 3.08Å
339K28.1Very low28.7Very low192 Ų192132.7 Ų132.784%0.83571%0.713SS**THydrogen-bonded Turntrans-68.43-179.7-97.9-177.7176.2179.70116.8
340N31.2Very low28.6Very low142 Ų142131.7 Ų131.776%0.75971%0.709SS**THydrogen-bonded Turntrans-111.5-11.8-179-77.4-16.6000114.9D338D338-N340 PolarHBondContact O-N 3.1Å; D338-N340 VanDerWaalsContact O-N 3.08Å
341D30.3Very low29.2Very low114 Ų114133.8 Ų133.861%0.6171%0.711SS**THydrogen-bonded Turntrans-103.2-14.3-176.9-73.5-25.9000114.3I343D341-I343 PolarHBondContact O-N 2.99Å
342S28.5Very low29.4Very low80 Ų80134.4 Ų134.456%0.55971%0.705SS**THydrogen-bonded Turntrans-80.6-12.2-179.370.40000115
343I31Very low30Very low134 Ų134136 Ų13669%0.68770%0.704SS**THydrogen-bonded Turntrans-84.1-20.8176.2-60.7174.4000111.3D341D341-I343 PolarHBondContact O-N 2.99Å
344M28Very low30.3Very low131 Ų131133 Ų13365%0.64570%0.698SS**THydrogen-bonded Turntrans-84.2-24.5-179.4-84-87.7-157.200113.9
345N29.2Very low30.8Very low120 Ų120131.6 Ų131.664%0.64270%0.696SS**G310 helixtrans-89.7-15.9-172.4-75.4-15.5000114.9F347N345-F347 VanDerWaalsContact C-N 3.32Å; N345-F347 PolarHBondContact O-N 3.35Å
346N29.1Very low31.4Very low148 Ų148129.7 Ų129.779%0.79169%0.686SS**G310 helixtrans-86.53175.6-78.1-3.1000114.2
347F30.3Very low32.3Very low124 Ų124126.7 Ų126.754%0.54466%0.664SS.*G310 helixtrans-113.510.9178.5-113.3-83000113.6N345 Y363N345-F347 VanDerWaalsContact C-N 3.32Å; N345-F347 PolarHBondContact O-N 3.35Å; F347-Y363 HydrophobicContact CE1-CD2 4.31Å; F347-Y363 HydrophobicContact CE1-CE2 4.1Å
348V28.1Very low32.8Very low78 Ų78126 Ų12647%0.47366%0.655SS.*  trans-103.584.2175-174.30000108.1N350V348-N350 PolarHBondContact O-N 3.3Å
349I31.1Very low33.6Very low99 Ų99121.8 Ų121.851%0.50864%0.636SS.*  trans-74.5104.6162.7-59.9168.7000105.9I351I349-I351 HydrophobicContact CG2-CG1 4.22Å; I349-I351 PolarHBondContact O-N 3.35Å; I349-I351 VanDerWaalsContact O-N 3.17Å
350N29.3Very low34.5Very low134 Ų134116.4 Ų116.472%0.71762%0.616SS**  trans-61.9108.7156.5-99.3-19.9000106.1V348 D352V348-N350 PolarHBondContact O-N 3.3Å; N350-D352 PolarHBondContact O-N 2.8Å
351I37.5Very low35.2Very low143 Ų143112.6 Ų112.673%0.73360%0.595SS**  trans-77.174.6169.5-54174.7000105.8I349I349-I351 HydrophobicContact CG2-CG1 4.22Å; I349-I351 PolarHBondContact O-N 3.35Å; I349-I351 VanDerWaalsContact O-N 3.17Å
352D33.3Very low35.7Very low129 Ų129112.2 Ų112.269%0.6959%0.593SS**  trans-70.4149.1164.1-115.9-24.7000108.4N350 N354N350-D352 PolarHBondContact O-N 2.8Å; D352-N354 PolarHBondContact O-N 2.97Å
353E37Very low36.5Very low162 Ų162110.6 Ų110.676%0.75758%0.575SS**SBendtrans-62.914.4-168.8-74.7-175.2141.300116.3K567E353-K567 IonicContact OE1-NZ 3.2Å; E353-K567 PolarHBondContact OE1-NZ 2.97Å
354N36.4Very low37.2Very low141 Ų141105.1 Ų105.175%0.75455%0.549SS*.SBendtrans-109.486.7177.8-70.6-29.9000111.4D352 D356D352-N354 PolarHBondContact O-N 2.97Å; N354-D356 VanDerWaalsContact C-N 3.27Å; N354-D356 PolarHBondContact O-N 2.88Å
355N36.2Very low37.7Very low148 Ų148104.6 Ų104.679%0.79155%0.545SS*.  trans25.631144.5-88.5-9000122.3I357N355-I357 PolarHBondContact O-N 3.42Å
356D42.1Very low38.2Very low118 Ų118102.7 Ų102.763%0.63153%0.532SS*.  trans-83.371.7-179.7-137.6-11.6000112.2N354 N358 S359N354-D356 VanDerWaalsContact C-N 3.27Å; N354-D356 PolarHBondContact O-N 2.88Å; D356-N358 PolarHBondContact O-N 2.87Å; D356-S359 PolarHBondContact O-N 2.9Å; D356-S359 PolarHBondContact O-OG 3.41Å
357I44.7Very low38.9Very low66 Ų6696.6 Ų96.634%0.33850%0.501SS..THydrogen-bonded Turntrans-54.3-31.3-176.2-81164.4000113N355 S359 I360 R578N355-I357 PolarHBondContact O-N 3.42Å; I357-S359 VanDerWaalsContact C-N 3.26Å; I357-S359 PolarHBondContact O-N 3.12Å; I357-I360 PolarHBondContact O-N 3.25Å; I357-R578 VanDerWaalsContact CG2-CZ 3.46Å
358N39.7Very low39.5Very low117 Ų11796.5 Ų96.563%0.62651%0.505SS*.Hα-helixtrans-67.2-27.8-175.9-65.1-30.7000112.6D356 I360 D361 D362D356-N358 PolarHBondContact O-N 2.87Å; N358-I360 VanDerWaalsContact C-N 3.27Å; N358-I360 PolarHBondContact O-N 3.03Å; N358-D361 PolarHBondContact O-N 3.19Å; N358-D362 PolarHBondContact O-N 3.31Å
359S44.5Very low39.9Very low38 Ų3899.9 Ų99.927%0.26652%0.516SS..Hα-helixtrans-67.7-26.5178.269.50000113.4D356 I357 Y363D356-S359 PolarHBondContact O-N 2.9Å; D356-S359 PolarHBondContact O-OG 3.41Å; I357-S359 VanDerWaalsContact C-N 3.26Å; I357-S359 PolarHBondContact O-N 3.12Å; S359-Y363 WeakPolarHBondContact O-CB 3.23Å; S359-Y363 PolarHBondContact O-N 2.83Å
360I47.7Very low40.2Very low79 Ų7999.6 Ų99.641%0.40552%0.515SS..Hα-helixtrans-77.1-36.2178.3-59.3172.5000110.2I357 N358 Y363 S364I357-I360 PolarHBondContact O-N 3.25Å; N358-I360 VanDerWaalsContact C-N 3.27Å; N358-I360 PolarHBondContact O-N 3.03Å; I360-Y363 PolarHBondContact O-N 2.91Å; I360-S364 WeakPolarHBondContact O-CB 3.16Å; I360-S364 PolarHBondContact O-N 3.34Å; I360-S364 PolarHBondContact O-OG 3.36Å
361D44.1Very low40.9Very low62 Ų6295.6 Ų95.633%0.33249%0.493SS..Hα-helixtrans-69-44.4179.2-71.7-33.3000110.7N358 Y363 S364 Q365 R578N358-D361 PolarHBondContact O-N 3.19Å; D361-Y363 VanDerWaalsContact C-N 3.29Å; D361-Y363 PolarHBondContact O-N 3.09Å; D361-S364 PolarHBondContact O-N 2.97Å; D361-S364 PolarHBondContact O-OG 3.16Å; D361-Q365 VanDerWaalsContact O-CB 3.31Å; D361-Q365 WeakPolarHBondContact O-CB 3.31Å; D361-Q365 VanDerWaalsContact O-CG 3.23Å; D361-Q365 WeakPolarHBondContact O-CG 3.19Å; D361-Q365 PolarHBondContact O-N 3.23Å; D361-R578 IonicContact OD1-NH1 3.04Å; D361-R578 IonicContact OD2-NH1 3.7Å; D361-R578 PolarHBondContact OD2-NH1 3.36Å
362D42.9Very low41.3Very low106 Ų10693.4 Ų93.457%0.56749%0.487SS*.Hα-helixtrans-57.6-42.4171.3-96.8-16000111.6N358 Q366N358-D362 PolarHBondContact O-N 3.31Å; D362-Q366 WeakPolarHBondContact O-CB 3.5Å; D362-Q366 WeakPolarHBondContact O-CG 3.37Å; D362-Q366 PolarHBondContact O-N 3.41Å
363Y44.6Very low42Very low45 Ų4593.7 Ų93.718%0.17648%0.479CS..Hα-helixtrans-70.4-38.2178.2-175.9-102.4000113.2F347 S359 I360 D361 S367 R383 P511F347-Y363 HydrophobicContact CE1-CD2 4.31Å; F347-Y363 HydrophobicContact CE1-CE2 4.1Å; S359-Y363 WeakPolarHBondContact O-CB 3.23Å; S359-Y363 PolarHBondContact O-N 2.83Å; I360-Y363 PolarHBondContact O-N 2.91Å; D361-Y363 VanDerWaalsContact C-N 3.29Å; D361-Y363 PolarHBondContact O-N 3.09Å; Y363-S367 WeakPolarHBondContact O-CB 3.45Å; Y363-S367 PolarHBondContact O-N 3.48Å; Y363-S367 PolarHBondContact O-OG 3.04Å; Y363-R383 WeakPolarHBondContact OH-CD 3.3Å; Y363-R383 PolarHBondContact OH-NE 3.43Å; Y363-R383 PolarHBondContact OH-NH1 3.24Å; Y363-R383 PolarHBondContact OH-NH2 3.01Å; Y363-P511 HydrophobicContact CD1-CG 4.06Å; Y363-P511 HydrophobicContact CE1-CG 3.73Å
364S45.2Very low42.3Very low20 Ų2092.5 Ų92.514%0.1448%0.477CS..Hα-helixtrans-70.1-39.6177.875.50000111.4I360 D361 S367 L368I360-S364 WeakPolarHBondContact O-CB 3.16Å; I360-S364 PolarHBondContact O-N 3.34Å; I360-S364 PolarHBondContact O-OG 3.36Å; D361-S364 PolarHBondContact O-N 2.97Å; D361-S364 PolarHBondContact O-OG 3.16Å; S364-S367 WeakPolarHBondContact CA-OG 3.37Å; S364-S367 PolarHBondContact O-OG 2.96Å; S364-S367 VanDerWaalsContact O-OG 3.07Å; S364-L368 WeakPolarHBondContact O-CB 3.28Å; S364-L368 WeakPolarHBondContact O-CD1 3.39Å; S364-L368 WeakPolarHBondContact O-CG 3.48Å; S364-L368 PolarHBondContact O-N 3.47Å
365Q39.1Very low43.4Very low119 Ų11988.7 Ų88.756%0.55646%0.455SS*.Hα-helixtrans-68.9-44.8174.1-68.6-121.4-5.800110.9D361 S367 L368 Q369D361-Q365 VanDerWaalsContact O-CB 3.31Å; D361-Q365 WeakPolarHBondContact O-CB 3.31Å; D361-Q365 VanDerWaalsContact O-CG 3.23Å; D361-Q365 WeakPolarHBondContact O-CG 3.19Å; D361-Q365 PolarHBondContact O-N 3.23Å; Q365-S367 PolarHBondContact O-N 3.48Å; Q365-L368 PolarHBondContact O-N 3.33Å; Q365-Q369 WeakPolarHBondContact O-CB 3.45Å; Q365-Q369 WeakPolarHBondContact O-CG 3.14Å; Q365-Q369 PolarHBondContact O-N 2.68Å
366Q40.1Very low45Very low81 Ų8189.4 Ų89.438%0.37945%0.451SS..Hα-helixtrans-66.7-33.6176.2-75.4174.910.800112.8D362 N370D362-Q366 WeakPolarHBondContact O-CB 3.5Å; D362-Q366 WeakPolarHBondContact O-CG 3.37Å; D362-Q366 PolarHBondContact O-N 3.41Å; Q366-N370 WeakPolarHBondContact O-CA 3.29Å; Q366-N370 WeakPolarHBondContact O-CB 3.37Å; Q366-N370 VanDerWaalsContact O-CG 3.29Å; Q366-N370 PolarHBondContact O-N 2.87Å; Q366-N370 PolarHBondContact O-ND2 3.42Å
367S43.1Very low46.6Very low20 Ų2088.9 Ų88.914%0.1445%0.447CS..Hα-helixtrans-78.1-23.2175.757.60000113.3Y363 S364 Q365 P511Y363-S367 WeakPolarHBondContact O-CB 3.45Å; Y363-S367 PolarHBondContact O-N 3.48Å; Y363-S367 PolarHBondContact O-OG 3.04Å; S364-S367 WeakPolarHBondContact CA-OG 3.37Å; S364-S367 PolarHBondContact O-OG 2.96Å; S364-S367 VanDerWaalsContact O-OG 3.07Å; Q365-S367 PolarHBondContact O-N 3.48Å; S367-P511 WeakPolarHBondContact OG-CG 3.31Å
368L41.8Very low48.3Very low121 Ų12189.5 Ų89.563%0.63446%0.457SS*.Hα-helixtrans-77.5-34.6168.9-73167.6000111.8S364 Q365S364-L368 WeakPolarHBondContact O-CB 3.28Å; S364-L368 WeakPolarHBondContact O-CD1 3.39Å; S364-L368 WeakPolarHBondContact O-CG 3.48Å; S364-L368 PolarHBondContact O-N 3.47Å; Q365-L368 PolarHBondContact O-N 3.33Å
369Q36.7Very low50.6Low150 Ų15085.8 Ų85.870%0.70144%0.443SS*.Hα-helixtrans-79.9-38175.7-72.6-179.1-0.500112.7Q365 H371Q365-Q369 WeakPolarHBondContact O-CB 3.45Å; Q365-Q369 WeakPolarHBondContact O-CG 3.14Å; Q365-Q369 PolarHBondContact O-N 2.68Å; Q369-H371 PolarHBondContact O-N 3.39Å
370N37.6Very low52.5Low92 Ų9284.2 Ų84.249%0.49243%0.433SS..SBendtrans-81.2100.5171.6-71.4-39.8000108.8Q366Q366-N370 WeakPolarHBondContact O-CA 3.29Å; Q366-N370 WeakPolarHBondContact O-CB 3.37Å; Q366-N370 VanDerWaalsContact O-CG 3.29Å; Q366-N370 PolarHBondContact O-N 2.87Å; Q366-N370 PolarHBondContact O-ND2 3.42Å
371H45.5Very low54.4Low51 Ų5182.3 Ų82.324%0.23642%0.423CS..  trans-39127.3178.9-112.2-39.2000112.4Q369 R373 N374Q369-H371 PolarHBondContact O-N 3.39Å; H371-R373 PolarHBondContact O-N 3.18Å; H371-N374 PolarHBondContact O-N 2.88Å
372P46Very low56.6Low96 Ų9685.2 Ų85.262%0.62343%0.433SS*.THydrogen-bonded Turntrans-62.32.4174.618-28.5000114.3
373R46.1Very low58.9Low136 Ų13682.8 Ų82.851%0.51342%0.416SS..THydrogen-bonded Turntrans-97-14.7174.6-62.1-170.5-138.8-164.86.1114.3H371H371-R373 PolarHBondContact O-N 3.18Å
374N44.4Very low61.1Low136 Ų13680.8 Ų80.873%0.72741%0.408SS*.THydrogen-bonded Turntrans-107.9-12.2-178.5-84.5-0.9000114.1H371 K376H371-N374 PolarHBondContact O-N 2.88Å; N374-K376 PolarHBondContact O-N 2.92Å
375E59.5Low63.3Low61 Ų6184.4 Ų84.429%0.28542%0.421SS..SBendtrans-66.7128.9168.4-72.7-161.4133.700110.2I377 R383E375-I377 PolarHBondContact O-N 2.87Å; E375-R383 IonicContact OE1-CZ 3.38Å; E375-R383 IonicContact OE1-NH1 3.88Å; E375-R383 PolarHBondContact OE1-NH1 3.45Å; E375-R383 IonicContact OE1-NH2 3.76Å; E375-R383 IonicContact OE2-CZ 2.59Å; E375-R383 IonicContact OE2-NH1 2.77Å; E375-R383 PolarHBondContact OE2-NH1 3.47Å; E375-R383 IonicContact OE2-NH2 2.68Å; E375-R383 PolarHBondContact OE2-NH2 3.39Å
376K69.9Low65.9Low164 Ų16484.5 Ų84.571%0.71342%0.42SS*.  trans-60.8126.2170.6-67-178.3-179.5176.80107.4N374 S378 A379N374-K376 PolarHBondContact O-N 2.92Å; K376-S378 WeakPolarHBondContact CB-OG 3.3Å; K376-S378 PolarHBondContact O-N 2.92Å; K376-A379 WeakPolarHBondContact O-CB 3.42Å; K376-A379 PolarHBondContact O-N 3.31Å
377I76.2Confident68.4Low106 Ų10682.2 Ų82.254%0.54441%0.41SS..Hα-helixtrans-48.6-33.6176.1-66.4172.4000111.1E375 A379 A380 L381E375-I377 PolarHBondContact O-N 2.87Å; I377-A379 VanDerWaalsContact C-N 3.31Å; I377-A379 PolarHBondContact O-N 3.39Å; I377-A380 PolarHBondContact O-N 3.49Å; I377-L381 HydrophobicContact CG2-CD1 3.92Å; I377-L381 HydrophobicContact CG2-CG 4.05Å; I377-L381 WeakPolarHBondContact O-CB 3.45Å; I377-L381 VanDerWaalsContact O-CG 3.27Å; I377-L381 WeakPolarHBondContact O-CG 3.41Å; I377-L381 PolarHBondContact O-N 3.25Å
378S80.6Confident70.8Confident79 Ų7987 Ų8755%0.55243%0.433SS*.Hα-helixtrans-59.3-35.2175.4580000114.3K376 K382K376-S378 WeakPolarHBondContact CB-OG 3.3Å; K376-S378 PolarHBondContact O-N 2.92Å; S378-K382 WeakPolarHBondContact O-CB 3.32Å; S378-K382 PolarHBondContact O-N 3.3Å
379A86.1Confident73.3Confident40 Ų4082 Ų8233%0.33141%0.408SS..Hα-helixtrans-69-46.6176.700000111K376 I377 L381 K382 R383K376-A379 WeakPolarHBondContact O-CB 3.42Å; K376-A379 PolarHBondContact O-N 3.31Å; I377-A379 VanDerWaalsContact C-N 3.31Å; I377-A379 PolarHBondContact O-N 3.39Å; A379-L381 PolarHBondContact O-N 3.47Å; A379-K382 PolarHBondContact O-N 2.91Å; A379-R383 WeakPolarHBondContact O-CG 3.32Å; A379-R383 PolarHBondContact O-N 2.93Å
380A84.5Confident76Confident5 Ų574.9 Ų74.94%0.04137%0.374CS..Hα-helixtrans-59.8-45.9174.800000111.9I377 K382 R383 L384 E512 L516I377-A380 PolarHBondContact O-N 3.49Å; A380-K382 VanDerWaalsContact C-N 3.33Å; A380-K382 PolarHBondContact O-N 3.45Å; A380-R383 PolarHBondContact O-N 2.79Å; A380-L384 WeakPolarHBondContact O-CG 3.21Å; A380-L384 PolarHBondContact O-N 2.99Å; A380-E512 WeakPolarHBondContact CB-OE2 3.05Å; A380-L516 HydrophobicContact CB-CD2 3.64Å
381L88.3Confident78.8Confident38 Ų3872.2 Ų72.220%0.19936%0.362CS..Hα-helixtrans-57.5-44.8174.2-70.5175.6000111.9I377 A379 R383 L384 F385 L516 L520I377-L381 HydrophobicContact CG2-CD1 3.92Å; I377-L381 HydrophobicContact CG2-CG 4.05Å; I377-L381 WeakPolarHBondContact O-CB 3.45Å; I377-L381 VanDerWaalsContact O-CG 3.27Å; I377-L381 WeakPolarHBondContact O-CG 3.41Å; I377-L381 PolarHBondContact O-N 3.25Å; A379-L381 PolarHBondContact O-N 3.47Å; L381-R383 VanDerWaalsContact C-N 3.3Å; L381-R383 PolarHBondContact O-N 3.05Å; L381-L384 PolarHBondContact O-N 3.39Å; L381-F385 HydrophobicContact CD2-CE2 4.39Å; L381-F385 VanDerWaalsContact O-CD2 3.3Å; L381-F385 WeakPolarHBondContact O-CD2 3.42Å; L381-F385 PolarHBondContact O-N 2.94Å; L381-L516 HydrophobicContact CD2-CD1 4.2Å; L381-L520 HydrophobicContact CD2-CD1 3.87Å; L381-L520 HydrophobicContact CD2-CD2 3.78Å; L381-L520 HydrophobicContact CD2-CG 4.26Å
382K90.6Very high81.3Confident123 Ų12371.2 Ų71.254%0.53536%0.358SS..Hα-helixtrans-61.9-37.3178.6-170.4178.1-177.6-178.30112S378 A379 A380 K386S378-K382 WeakPolarHBondContact O-CB 3.32Å; S378-K382 PolarHBondContact O-N 3.3Å; A379-K382 PolarHBondContact O-N 2.91Å; A380-K382 VanDerWaalsContact C-N 3.33Å; A380-K382 PolarHBondContact O-N 3.45Å; K382-K386 WeakPolarHBondContact O-CB 3.47Å; K382-K386 VanDerWaalsContact O-CG 3.25Å; K382-K386 WeakPolarHBondContact O-CG 3.29Å; K382-K386 PolarHBondContact O-N 3.49Å
383R90.2Very high83.7Confident56 Ų5666.7 Ų66.721%0.21133%0.328CS..Hα-helixtrans-69.1-45.4175.8-68.5-178.1-57.8-124.18.9111.7Y363 E375 A379 A380 L381 F385 K386 N387 E512Y363-R383 WeakPolarHBondContact OH-CD 3.3Å; Y363-R383 PolarHBondContact OH-NE 3.43Å; Y363-R383 PolarHBondContact OH-NH1 3.24Å; Y363-R383 PolarHBondContact OH-NH2 3.01Å; E375-R383 IonicContact OE1-CZ 3.38Å; E375-R383 IonicContact OE1-NH1 3.88Å; E375-R383 PolarHBondContact OE1-NH1 3.45Å; E375-R383 IonicContact OE1-NH2 3.76Å; E375-R383 IonicContact OE2-CZ 2.59Å; E375-R383 IonicContact OE2-NH1 2.77Å; E375-R383 PolarHBondContact OE2-NH1 3.47Å; E375-R383 IonicContact OE2-NH2 2.68Å; E375-R383 PolarHBondContact OE2-NH2 3.39Å; A379-R383 WeakPolarHBondContact O-CG 3.32Å; A379-R383 PolarHBondContact O-N 2.93Å; A380-R383 PolarHBondContact O-N 2.79Å; L381-R383 VanDerWaalsContact C-N 3.3Å; L381-R383 PolarHBondContact O-N 3.05Å; R383-F385 PolarHBondContact O-N 3.36Å; R383-K386 PolarHBondContact O-N 2.98Å; R383-K386 VanDerWaalsContact O-N 3.15Å; R383-N387 PolarHBondContact O-N 3.44Å; R383-E512 IonicContact CZ-OE1 3.38Å; R383-E512 IonicContact NE-OE1 3.72Å; R383-E512 PolarHBondContact NE-OE1 3.15Å; R383-E512 IonicContact NH2-OE1 3.78Å; R383-E512 PolarHBondContact NH2-OE1 3.39Å; R383-E512 IonicContact NH2-OE2 2.82Å; R383-E512 PolarHBondContact NH2-OE2 2.97Å
384L91Very high86.1Confident2 Ų261.4 Ų61.41%0.0131%0.309CS..Hα-helixtrans-59.5-47.2177.6-71.6172.8000112.1A380 L381 K386 N387 F390 T509 E512 L516 L520A380-L384 WeakPolarHBondContact O-CG 3.21Å; A380-L384 PolarHBondContact O-N 2.99Å; L381-L384 PolarHBondContact O-N 3.39Å; L384-K386 PolarHBondContact O-N 2.92Å; L384-N387 WeakPolarHBondContact O-CB 3.3Å; L384-N387 PolarHBondContact O-N 2.83Å; L384-N387 VanDerWaalsContact O-N 3.08Å; L384-F390 HydrophobicContact CB-CD1 4.03Å; L384-F390 HydrophobicContact CB-CE1 3.93Å; L384-F390 HydrophobicContact CD2-CD1 4.37Å; L384-F390 HydrophobicContact CD2-CE1 4.4Å; L384-F390 WeakPolarHBondContact O-CD1 3.36Å; L384-T509 HydrophobicContact CD2-CG2 3.33Å; L384-E512 HydrophobicContact CD2-CB 4.19Å; L384-E512 HydrophobicContact CD2-CG 3.86Å; L384-E512 HydrophobicContact CG-CG 4.2Å; L384-L516 HydrophobicContact CD1-CD2 3.63Å; L384-L516 HydrophobicContact CD1-CG 3.78Å; L384-L520 HydrophobicContact CB-CD1 4.44Å; L384-L520 HydrophobicContact CD1-CD1 3.6Å
385F93.2Very high88.6Confident96 Ų9657.3 Ų57.342%0.42129%0.286SS..THydrogen-bonded Turntrans-76-6.7178.6-75.8-71.3000114.5L381 R383 V391 F394 L520L381-F385 HydrophobicContact CD2-CE2 4.39Å; L381-F385 VanDerWaalsContact O-CD2 3.3Å; L381-F385 WeakPolarHBondContact O-CD2 3.42Å; L381-F385 PolarHBondContact O-N 2.94Å; R383-F385 PolarHBondContact O-N 3.36Å; F385-V391 HydrophobicContact CD1-CG2 4.23Å; F385-V391 WeakPolarHBondContact O-CG2 3.37Å; F385-F394 HydrophobicContact CE1-CD1 4.33Å; F385-F394 HydrophobicContact CE1-CD2 4.45Å; F385-F394 HydrophobicContact CE1-CE1 4.24Å; F385-F394 HydrophobicContact CE1-CE2 4.33Å; F385-F394 HydrophobicContact CE1-CG 4.45Å; F385-F394 HydrophobicContact CE1-CZ 4.25Å; F385-F394 HydrophobicContact CZ-CD2 4.5Å; F385-F394 HydrophobicContact CZ-CE2 4.08Å; F385-F394 HydrophobicContact CZ-CZ 4.15Å; F385-L520 HydrophobicContact CE2-CD1 4.37Å; F385-L520 HydrophobicContact CE2-CD2 4.26Å; F385-L520 HydrophobicContact CZ-CD2 4.35Å
386K93.2Very high90.4Very high122 Ų12254.4 Ų54.453%0.5327%0.273SS..THydrogen-bonded Turntrans-88.1-18.5166.1-79.1179.8170.9-1610112.8K382 R383 L384 I388K382-K386 WeakPolarHBondContact O-CB 3.47Å; K382-K386 VanDerWaalsContact O-CG 3.25Å; K382-K386 WeakPolarHBondContact O-CG 3.29Å; K382-K386 PolarHBondContact O-N 3.49Å; R383-K386 PolarHBondContact O-N 2.98Å; R383-K386 VanDerWaalsContact O-N 3.15Å; L384-K386 PolarHBondContact O-N 2.92Å; K386-I388 PolarHBondContact O-N 3.17Å
387N91.3Very high91.7Very high32 Ų3246.7 Ų46.717%0.17124%0.239CC..  trans-80.297.9178.2-179.1-18.3000109.9R383 L384 P389 F390 V391 L508R383-N387 PolarHBondContact O-N 3.44Å; L384-N387 WeakPolarHBondContact O-CB 3.3Å; L384-N387 PolarHBondContact O-N 2.83Å; L384-N387 VanDerWaalsContact O-N 3.08Å; N387-P389 WeakPolarHBondContact OD1-CD 3.26Å; N387-F390 HydrophobicContact CB-CB 4.05Å; N387-F390 WeakPolarHBondContact O-CA 3.49Å; N387-F390 WeakPolarHBondContact O-CB 3.29Å; N387-F390 PolarHBondContact O-N 2.86Å; N387-F390 PolarHBondContact OD1-N 3.22Å; N387-V391 WeakPolarHBondContact O-CG2 3.31Å; N387-V391 PolarHBondContact O-N 3.42Å; N387-L508 PolarHBondContact ND2-O 2.8Å
388I94Very high92.7Very high121 Ų12141.6 Ų41.662%0.62121%0.213SC*.Hα-helixtrans-53.6-48.6-176.5-63.5171.4000112.7K386 F390 V391 L392K386-I388 PolarHBondContact O-N 3.17Å; I388-F390 VanDerWaalsContact C-N 3.29Å; I388-F390 PolarHBondContact O-N 2.97Å; I388-V391 PolarHBondContact O-N 3.27Å; I388-V391 VanDerWaalsContact O-N 3.1Å; I388-L392 HydrophobicContact CG2-CD1 4.15Å; I388-L392 HydrophobicContact CG2-CG 4.31Å; I388-L392 WeakPolarHBondContact O-CG 3.45Å; I388-L392 PolarHBondContact O-N 3.36Å
389P94.6Very high93.6Very high16 Ų1638.2 Ų38.210%0.10419%0.189CC..Hα-helixtrans-50.5-44.9172.4-29.832.1000114.1N387 L393 L508 I566 K567N387-P389 WeakPolarHBondContact OD1-CD 3.26Å; P389-L393 PolarHBondContact O-N 3.19Å; P389-L508 HydrophobicContact CB-CD1 4.12Å; P389-L508 HydrophobicContact CB-CD2 3.99Å; P389-I566 HydrophobicContact CB-CG2 4.23Å; P389-K567 HydrophobicContact CG-CB 4.28Å
390F94.4Very high94.1Very high0 Ų036.3 Ų36.30%017%0.173CC..Hα-helixtrans-67.8-39.3177177.5-100.9000112.2L384 N387 I388 L393 F394 A505 T509 L520 L521L384-F390 HydrophobicContact CB-CD1 4.03Å; L384-F390 HydrophobicContact CB-CE1 3.93Å; L384-F390 HydrophobicContact CD2-CD1 4.37Å; L384-F390 HydrophobicContact CD2-CE1 4.4Å; L384-F390 WeakPolarHBondContact O-CD1 3.36Å; N387-F390 HydrophobicContact CB-CB 4.05Å; N387-F390 WeakPolarHBondContact O-CA 3.49Å; N387-F390 WeakPolarHBondContact O-CB 3.29Å; N387-F390 PolarHBondContact O-N 2.86Å; N387-F390 PolarHBondContact OD1-N 3.22Å; I388-F390 VanDerWaalsContact C-N 3.29Å; I388-F390 PolarHBondContact O-N 2.97Å; F390-L393 PolarHBondContact O-N 2.9Å; F390-F394 HydrophobicContact CE1-CB 4.47Å; F390-F394 HydrophobicContact CE1-CD2 4.48Å; F390-F394 HydrophobicContact CZ-CD2 4.49Å; F390-F394 VanDerWaalsContact O-CB 3.27Å; F390-F394 WeakPolarHBondContact O-CB 3.32Å; F390-F394 PolarHBondContact O-N 3.46Å; F390-A505 HydrophobicContact CE2-CB 4.25Å; F390-T509 HydrophobicContact CB-CG2 4.05Å; F390-T509 HydrophobicContact CD2-CG2 3.22Å; F390-T509 HydrophobicContact CE2-CG2 3.75Å; F390-T509 HydrophobicContact CG-CG2 3.69Å; F390-L520 HydrophobicContact CE1-CD1 3.96Å; F390-L520 HydrophobicContact CZ-CB 4.06Å; F390-L520 HydrophobicContact CZ-CD1 3.87Å; F390-L521 HydrophobicContact CE2-CD2 4.41Å
391V96.4Very high94.7Very high37 Ų3736 Ų3622%0.22417%0.171CC..Hα-helixtrans-63.6-42.1176.6174.60000111.5F385 N387 I388 L393 F394 I395F385-V391 HydrophobicContact CD1-CG2 4.23Å; F385-V391 WeakPolarHBondContact O-CG2 3.37Å; N387-V391 WeakPolarHBondContact O-CG2 3.31Å; N387-V391 PolarHBondContact O-N 3.42Å; I388-V391 PolarHBondContact O-N 3.27Å; I388-V391 VanDerWaalsContact O-N 3.1Å; V391-L393 VanDerWaalsContact C-N 3.35Å; V391-F394 WeakPolarHBondContact O-CB 3.47Å; V391-F394 PolarHBondContact O-N 2.94Å; V391-I395 HydrophobicContact CG1-CD1 4Å; V391-I395 WeakPolarHBondContact O-CG1 3.35Å; V391-I395 PolarHBondContact O-N 2.74Å
392L97Very high95.1Very high30 Ų3034.2 Ų34.216%0.15716%0.162CC..Hα-helixtrans-62.2-42.4174.1-70.8175.7000111.5I388 S396 M562 L565 I566I388-L392 HydrophobicContact CG2-CD1 4.15Å; I388-L392 HydrophobicContact CG2-CG 4.31Å; I388-L392 WeakPolarHBondContact O-CG 3.45Å; I388-L392 PolarHBondContact O-N 3.36Å; L392-S396 VanDerWaalsContact O-CB 3.28Å; L392-S396 WeakPolarHBondContact O-CB 3.4Å; L392-S396 PolarHBondContact O-N 3.47Å; L392-S396 PolarHBondContact O-OG 3.49Å; L392-M562 HydrophobicContact CD2-CB 4.38Å; L392-M562 HydrophobicContact CD2-CE 3.69Å; L392-L565 HydrophobicContact CD1-CB 4.01Å; L392-I566 HydrophobicContact CB-CG1 3.73Å; L392-I566 HydrophobicContact CD1-CG1 4.44Å
393L96Very high95.5Very high0 Ų028.4 Ų28.40%014%0.136CC..Hα-helixtrans-63.6-45.6173.7-178.559.8000111.7P389 F390 V391 I395 S396 Y397 L504 A505 L508 L521 I566P389-L393 PolarHBondContact O-N 3.19Å; F390-L393 PolarHBondContact O-N 2.9Å; V391-L393 VanDerWaalsContact C-N 3.35Å; L393-I395 VanDerWaalsContact C-N 3.33Å; L393-I395 PolarHBondContact O-N 3.38Å; L393-S396 WeakPolarHBondContact CA-OG 3.39Å; L393-S396 PolarHBondContact O-N 3.46Å; L393-S396 PolarHBondContact O-OG 3.19Å; L393-Y397 WeakPolarHBondContact O-CB 3.31Å; L393-Y397 PolarHBondContact O-N 3.02Å; L393-L504 HydrophobicContact CD1-CD2 3.93Å; L393-L504 HydrophobicContact CD2-CB 4.24Å; L393-L504 HydrophobicContact CD2-CD2 4.11Å; L393-L504 HydrophobicContact CD2-CG 3.92Å; L393-A505 HydrophobicContact CD2-CB 3.78Å; L393-L508 HydrophobicContact CB-CD1 4.39Å; L393-L508 HydrophobicContact CD2-CD1 3.98Å; L393-L521 HydrophobicContact CD2-CD1 4.4Å; L393-L521 HydrophobicContact CG-CD2 4.3Å; L393-I566 HydrophobicContact CB-CD1 3.94Å; L393-I566 HydrophobicContact CD1-CD1 4.12Å
394F96.4Very high95.8Very high25 Ų2526.2 Ų26.211%0.1113%0.128CC..Hα-helixtrans-55.4-48.5179.1176.4-87.4000111.1F385 F390 V391 G398 L520 L521 S524F385-F394 HydrophobicContact CE1-CD1 4.33Å; F385-F394 HydrophobicContact CE1-CD2 4.45Å; F385-F394 HydrophobicContact CE1-CE1 4.24Å; F385-F394 HydrophobicContact CE1-CE2 4.33Å; F385-F394 HydrophobicContact CE1-CG 4.45Å; F385-F394 HydrophobicContact CE1-CZ 4.25Å; F385-F394 HydrophobicContact CZ-CD2 4.5Å; F385-F394 HydrophobicContact CZ-CE2 4.08Å; F385-F394 HydrophobicContact CZ-CZ 4.15Å; F390-F394 HydrophobicContact CE1-CB 4.47Å; F390-F394 HydrophobicContact CE1-CD2 4.48Å; F390-F394 HydrophobicContact CZ-CD2 4.49Å; F390-F394 VanDerWaalsContact O-CB 3.27Å; F390-F394 WeakPolarHBondContact O-CB 3.32Å; F390-F394 PolarHBondContact O-N 3.46Å; V391-F394 WeakPolarHBondContact O-CB 3.47Å; V391-F394 PolarHBondContact O-N 2.94Å; F394-G398 PolarHBondContact O-N 2.86Å; F394-G398 VanDerWaalsContact O-N 3.07Å; F394-L520 HydrophobicContact CD2-CB 4.19Å; F394-L520 HydrophobicContact CE2-CB 4.05Å; F394-L520 WeakPolarHBondContact CE2-O 3.04Å; F394-L521 HydrophobicContact CB-CD2 4.28Å; F394-L521 HydrophobicContact CD2-CD2 4.47Å; F394-S524 WeakPolarHBondContact O-CB 3.11Å; F394-S524 PolarHBondContact O-OG 3.19Å
395I97.7Very high96.1Very high50 Ų5027.4 Ų27.426%0.25613%0.133SC..Hα-helixtrans-71.2-49.7179.9-63168.5000111.1V391 L393 Y397 G398 I399 F528 M562V391-I395 HydrophobicContact CG1-CD1 4Å; V391-I395 WeakPolarHBondContact O-CG1 3.35Å; V391-I395 PolarHBondContact O-N 2.74Å; L393-I395 VanDerWaalsContact C-N 3.33Å; L393-I395 PolarHBondContact O-N 3.38Å; I395-Y397 VanDerWaalsContact C-N 3.34Å; I395-Y397 PolarHBondContact O-N 3.07Å; I395-G398 PolarHBondContact O-N 3.06Å; I395-G398 VanDerWaalsContact O-N 3.16Å; I395-I399 HydrophobicContact CG2-CD1 3.9Å; I395-I399 HydrophobicContact CG2-CG1 4.42Å; I395-I399 WeakPolarHBondContact O-CG1 3.5Å; I395-I399 PolarHBondContact O-N 3.25Å; I395-F528 HydrophobicContact CG2-CE2 4.38Å; I395-F528 HydrophobicContact CG2-CZ 3.83Å; I395-M562 HydrophobicContact CB-CE 3.56Å; I395-M562 HydrophobicContact CB-SD 4.1Å; I395-M562 HydrophobicContact CD1-CE 3.69Å; I395-M562 HydrophobicContact CG1-CE 4.21Å; I395-M562 HydrophobicContact CG2-CE 3.48Å; I395-M562 VanDerWaalsContact CG2-CE 3.48Å; I395-M562 HydrophobicContact CG2-SD 3.45Å; I395-M562 WeakPolarHBondContact CG2-SD 3.22Å
396S97.5Very high96.3Very high0 Ų022.8 Ų22.80%011%0.112CC..Hα-helixtrans-63-38.3-178.259.10000112.8L392 L393 I399 L400 Y461 Y497 T563L392-S396 VanDerWaalsContact O-CB 3.28Å; L392-S396 WeakPolarHBondContact O-CB 3.4Å; L392-S396 PolarHBondContact O-N 3.47Å; L392-S396 PolarHBondContact O-OG 3.49Å; L393-S396 WeakPolarHBondContact CA-OG 3.39Å; L393-S396 PolarHBondContact O-N 3.46Å; L393-S396 PolarHBondContact O-OG 3.19Å; S396-I399 PolarHBondContact O-N 3.26Å; S396-L400 PolarHBondContact O-N 3.01Å; S396-Y461 WeakPolarHBondContact O-CE2 3.18Å; S396-Y461 PolarHBondContact O-OH 3.46Å; S396-Y497 PolarHBondContact OG-OH 2.84Å; S396-T563 VanDerWaalsContact CB-OG1 3.26Å; S396-T563 WeakPolarHBondContact CB-OG1 3.2Å; S396-T563 PolarHBondContact OG-OG1 2.91Å
397Y96.8Very high96.5Very high2 Ų217 Ų171%0.0089%0.087CC..Hα-helixtrans-64.5-44172.8-176.4-81.9000112.1L393 I395 L400 T401 Y497 L498 F502 L521 A525L393-Y397 WeakPolarHBondContact O-CB 3.31Å; L393-Y397 PolarHBondContact O-N 3.02Å; I395-Y397 VanDerWaalsContact C-N 3.34Å; I395-Y397 PolarHBondContact O-N 3.07Å; Y397-L400 PolarHBondContact O-N 2.78Å; Y397-T401 WeakPolarHBondContact CE1-OG1 3.42Å; Y397-T401 VanDerWaalsContact O-CB 3.29Å; Y397-T401 WeakPolarHBondContact O-CB 3.46Å; Y397-T401 PolarHBondContact O-N 3.29Å; Y397-T401 PolarHBondContact O-OG1 3.47Å; Y397-Y497 HydrophobicContact CD2-CD1 4.09Å; Y397-Y497 AromaticContact CD2-CE1 3.73Å; Y397-Y497 HydrophobicContact CD2-CE1 3.73Å; Y397-Y497 HydrophobicContact CG-CE1 4.29Å; Y397-L498 WeakPolarHBondContact CE2-O 3.46Å; Y397-F502 HydrophobicContact CE1-CE1 4.47Å; Y397-F502 HydrophobicContact CE2-CE1 4.38Å; Y397-F502 AromaticContact CZ-CE1 3.84Å; Y397-F502 WeakPolarHBondContact OH-CE1 3.17Å; Y397-F502 VanDerWaalsContact OH-CZ 3.3Å; Y397-F502 WeakPolarHBondContact OH-CZ 3.49Å; Y397-L521 HydrophobicContact CD1-CB 3.86Å; Y397-L521 HydrophobicContact CD1-CD2 4.37Å; Y397-L521 WeakPolarHBondContact CD1-O 3.28Å; Y397-L521 HydrophobicContact CD2-CD1 4.1Å; Y397-L521 HydrophobicContact CE1-CB 3.89Å; Y397-L521 WeakPolarHBondContact CE1-O 3.26Å; Y397-L521 HydrophobicContact CE2-CD1 4.32Å; Y397-L521 HydrophobicContact CG-CB 4.31Å; Y397-L521 HydrophobicContact CG-CD1 4.27Å; Y397-L521 HydrophobicContact CG-CD2 4.2Å; Y397-L521 HydrophobicContact CG-CG 4.5Å; Y397-A525 HydrophobicContact CD1-CB 4.46Å; Y397-A525 HydrophobicContact CE1-CB 4.06Å
398G97.8Very high96.7Very high0 Ų015.6 Ų15.60%08%0.081CC..Hα-helixtrans-55.8-50.8174.100000111.7F394 I395 G402 S524 F528F394-G398 PolarHBondContact O-N 2.86Å; F394-G398 VanDerWaalsContact O-N 3.07Å; I395-G398 PolarHBondContact O-N 3.06Å; I395-G398 VanDerWaalsContact O-N 3.16Å; G398-G402 WeakPolarHBondContact O-CA 3.5Å; G398-G402 PolarHBondContact O-N 3.07Å; G398-S524 VanDerWaalsContact CA-OG 3.26Å; G398-S524 WeakPolarHBondContact CA-OG 3.23Å; G398-F528 VanDerWaalsContact C-CB 3.4Å; G398-F528 VanDerWaalsContact C-CG 3.47Å; G398-F528 WeakPolarHBondContact O-CB 3.4Å
399I98.2Very high96.8Very high7 Ų79.9 Ų9.94%0.0365%0.051CC..Hα-helixtrans-57.9-54.5178.7-69.2169.8000111.3I395 S396 T401 G402 V403 F528 L555 I558 M562I395-I399 HydrophobicContact CG2-CD1 3.9Å; I395-I399 HydrophobicContact CG2-CG1 4.42Å; I395-I399 WeakPolarHBondContact O-CG1 3.5Å; I395-I399 PolarHBondContact O-N 3.25Å; S396-I399 PolarHBondContact O-N 3.26Å; I399-T401 PolarHBondContact O-N 2.7Å; I399-G402 PolarHBondContact O-N 3.42Å; I399-V403 WeakPolarHBondContact O-CG2 3.42Å; I399-V403 PolarHBondContact O-N 3.31Å; I399-F528 HydrophobicContact CB-CD1 4.48Å; I399-F528 HydrophobicContact CD1-CE1 4.23Å; I399-F528 HydrophobicContact CG1-CD1 3.64Å; I399-F528 HydrophobicContact CG1-CE1 3.45Å; I399-F528 VanDerWaalsContact CG1-CE1 3.45Å; I399-F528 HydrophobicContact CG1-CG 4.37Å; I399-F528 HydrophobicContact CG1-CZ 4.04Å; I399-L555 HydrophobicContact CG2-CB 4.07Å; I399-L555 VanDerWaalsContact CG2-O 3.3Å; I399-L555 WeakPolarHBondContact CG2-O 3.2Å; I399-I558 HydrophobicContact CD1-CG2 4.3Å; I399-M562 HydrophobicContact CD1-SD 4.4Å
400L97.9Very high96.9Very high0 Ų09.2 Ų9.20%05%0.047CC..Hα-helixtrans-63.3-46.2-174.9-167.765.3000111.5S396 Y397 G402 V403 Y404 Y461 M494 Y497 T556S396-L400 PolarHBondContact O-N 3.01Å; Y397-L400 PolarHBondContact O-N 2.78Å; L400-G402 VanDerWaalsContact C-N 3.31Å; L400-G402 PolarHBondContact O-N 2.95Å; L400-V403 PolarHBondContact O-N 2.93Å; L400-Y404 WeakPolarHBondContact O-CB 3.29Å; L400-Y404 PolarHBondContact O-N 3.28Å; L400-Y461 HydrophobicContact CB-CE1 4.26Å; L400-Y461 HydrophobicContact CB-CE2 3.91Å; L400-Y461 WeakPolarHBondContact CB-OH 3.39Å; L400-Y461 HydrophobicContact CD1-CD1 4.17Å; L400-Y461 HydrophobicContact CD1-CE1 3.75Å; L400-Y461 HydrophobicContact CD2-CD2 4.28Å; L400-Y461 HydrophobicContact CD2-CE2 4.17Å; L400-Y461 HydrophobicContact CD2-CG 4.47Å; L400-Y461 HydrophobicContact CG-CE1 4.4Å; L400-Y461 HydrophobicContact CG-CE2 4.48Å; L400-Y461 PolarHBondContact N-OH 2.97Å; L400-M494 HydrophobicContact CD1-CE 4.13Å; L400-M494 HydrophobicContact CD1-CG 4.18Å; L400-M494 HydrophobicContact CG-CG 4.46Å; L400-Y497 HydrophobicContact CB-CD1 4.44Å; L400-Y497 HydrophobicContact CD2-CD1 3.43Å; L400-Y497 VanDerWaalsContact CD2-CD1 3.43Å; L400-Y497 HydrophobicContact CD2-CD2 3.94Å; L400-Y497 HydrophobicContact CD2-CE1 4.16Å; L400-Y497 HydrophobicContact CD2-CG 3.29Å; L400-T556 HydrophobicContact CD1-CG2 3.96Å
401T96.4Very high96.9Very high0 Ų09.2 Ų9.20%05%0.047CC..Hα-helixtrans-68.1-35.7-179.6-47.30000110.9Y397 I399 Y404 Y405 L498 A525Y397-T401 WeakPolarHBondContact CE1-OG1 3.42Å; Y397-T401 VanDerWaalsContact O-CB 3.29Å; Y397-T401 WeakPolarHBondContact O-CB 3.46Å; Y397-T401 PolarHBondContact O-N 3.29Å; Y397-T401 PolarHBondContact O-OG1 3.47Å; I399-T401 PolarHBondContact O-N 2.7Å; T401-Y404 WeakPolarHBondContact O-CB 3.09Å; T401-Y404 PolarHBondContact O-N 2.85Å; T401-Y405 HydrophobicContact CG2-CD1 4.44Å; T401-Y405 HydrophobicContact CG2-CD2 4.48Å; T401-Y405 HydrophobicContact CG2-CE1 3.87Å; T401-Y405 HydrophobicContact CG2-CE2 3.94Å; T401-Y405 VanDerWaalsContact O-CG 3.26Å; T401-Y405 PolarHBondContact O-N 3.48Å; T401-L498 HydrophobicContact CG2-CD1 4.24Å; T401-L498 HydrophobicContact CG2-CD2 4.05Å; T401-L498 HydrophobicContact CG2-CG 4.21Å; T401-A525 HydrophobicContact CG2-CB 3.45Å; T401-A525 VanDerWaalsContact CG2-CB 3.45Å
402G97.6Very high96.8Very high0 Ų07.5 Ų7.50%04%0.036CC..Hα-helixtrans-64.5-39.9173.400000112.6G398 I399 L400 Y405 A406G398-G402 WeakPolarHBondContact O-CA 3.5Å; G398-G402 PolarHBondContact O-N 3.07Å; I399-G402 PolarHBondContact O-N 3.42Å; L400-G402 VanDerWaalsContact C-N 3.31Å; L400-G402 PolarHBondContact O-N 2.95Å; G402-Y405 PolarHBondContact O-N 3.01Å; G402-A406 WeakPolarHBondContact O-CB 3.26Å; G402-A406 PolarHBondContact O-N 3.31Å
403V97.8Very high96.5Very high0 Ų06.9 Ų6.90%03%0.034CC..Hα-helixtrans-64.5-44.1173.3170.30000110I399 L400 Y405 A406 V407 M468 M494 L532 L552I399-V403 WeakPolarHBondContact O-CG2 3.42Å; I399-V403 PolarHBondContact O-N 3.31Å; L400-V403 PolarHBondContact O-N 2.93Å; V403-Y405 VanDerWaalsContact C-N 3.33Å; V403-Y405 PolarHBondContact O-N 3.15Å; V403-A406 PolarHBondContact O-N 3.42Å; V403-A406 VanDerWaalsContact O-N 3.15Å; V403-V407 HydrophobicContact CG1-CG2 4.29Å; V403-V407 WeakPolarHBondContact O-CG2 3.38Å; V403-V407 PolarHBondContact O-N 2.83Å; V403-M468 HydrophobicContact CG1-SD 4.24Å; V403-M494 HydrophobicContact CG1-CE 3.75Å; V403-L532 HydrophobicContact CB-CD1 4.36Å; V403-L532 HydrophobicContact CG2-CD1 3.47Å; V403-L532 VanDerWaalsContact CG2-CD1 3.47Å; V403-L552 HydrophobicContact CG1-CB 4.24Å; V403-L552 HydrophobicContact CG2-CB 4.47Å; V403-L552 HydrophobicContact CG2-CD2 4.28Å
404Y96.5Very high96.4Very high10 Ų106.9 Ų6.94%0.0394%0.035CC..Hα-helixtrans-58.2-44.1175.6178.1-111.7000112.1L400 T401 G408 M432 I433 M494 T495L400-Y404 WeakPolarHBondContact O-CB 3.29Å; L400-Y404 PolarHBondContact O-N 3.28Å; T401-Y404 WeakPolarHBondContact O-CB 3.09Å; T401-Y404 PolarHBondContact O-N 2.85Å; Y404-G408 PolarHBondContact O-N 2.77Å; Y404-M432 HydrophobicContact CD2-CE 4.35Å; Y404-M432 HydrophobicContact CD2-SD 4.28Å; Y404-M432 HydrophobicContact CE2-CE 3.72Å; Y404-M432 HydrophobicContact CE2-CG 4.12Å; Y404-M432 HydrophobicContact CE2-SD 3.89Å; Y404-I433 WeakPolarHBondContact OH-CD1 3.43Å; Y404-M494 HydrophobicContact CD2-CB 3.92Å; Y404-M494 HydrophobicContact CD2-SD 3.95Å; Y404-M494 HydrophobicContact CG-CB 4.43Å; Y404-M494 HydrophobicContact CG-SD 4.46Å; Y404-T495 PolarHBondContact OH-OG1 3.25Å
405Y97Very high96.2Very high27 Ų275.7 Ų5.711%0.1063%0.029CC..Hα-helixtrans-64.5-41.8173.6-64.4-17.9000112.5W35 M73 T401 G402 V403 G408 T409 A525W35-Y405 AromaticContact CH2-CD1 3.65Å; W35-Y405 HydrophobicContact CH2-CD1 3.65Å; W35-Y405 HydrophobicContact CH2-CE1 4.07Å; W35-Y405 HydrophobicContact CH2-CG 4.28Å; W35-Y405 AromaticContact CZ2-CD1 4Å; W35-Y405 HydrophobicContact CZ2-CD1 4Å; W35-Y405 HydrophobicContact CZ2-CG 4.17Å; M73-Y405 HydrophobicContact CE-CD2 3.69Å; M73-Y405 HydrophobicContact CE-CG 3.94Å; T401-Y405 HydrophobicContact CG2-CD1 4.44Å; T401-Y405 HydrophobicContact CG2-CD2 4.48Å; T401-Y405 HydrophobicContact CG2-CE1 3.87Å; T401-Y405 HydrophobicContact CG2-CE2 3.94Å; T401-Y405 VanDerWaalsContact O-CG 3.26Å; T401-Y405 PolarHBondContact O-N 3.48Å; G402-Y405 PolarHBondContact O-N 3.01Å; V403-Y405 VanDerWaalsContact C-N 3.33Å; V403-Y405 PolarHBondContact O-N 3.15Å; Y405-G408 PolarHBondContact O-N 3.45Å; Y405-T409 WeakPolarHBondContact O-CB 3.44Å; Y405-T409 PolarHBondContact O-N 3.48Å; Y405-T409 PolarHBondContact O-OG1 3.27Å; Y405-A525 HydrophobicContact CE2-CB 4.04Å
406A97.8Very high95.8Very high0 Ų05.5 Ų5.50%03%0.028CC..Hα-helixtrans-63.6-45.1178.100000112.2G402 V403 G408 T409 L410 L532 I533 L552G402-A406 WeakPolarHBondContact O-CB 3.26Å; G402-A406 PolarHBondContact O-N 3.31Å; V403-A406 PolarHBondContact O-N 3.42Å; V403-A406 VanDerWaalsContact O-N 3.15Å; A406-G408 VanDerWaalsContact C-N 3.31Å; A406-G408 PolarHBondContact O-N 3Å; A406-T409 PolarHBondContact O-N 2.6Å; A406-L410 WeakPolarHBondContact O-CB 3.32Å; A406-L410 WeakPolarHBondContact O-CG 3.34Å; A406-L410 PolarHBondContact O-N 3.16Å; A406-L532 HydrophobicContact CB-CB 4.26Å; A406-I533 HydrophobicContact CB-CG1 3.84Å; A406-L552 HydrophobicContact CB-CD1 4.2Å; A406-L552 HydrophobicContact CB-CD2 3.9Å
407V96.7Very high95.2Very high0 Ų07.6 Ų7.60%05%0.05CC..Hα-helixtrans-59.6-44.3173.91720000110.3V403 L411 M432 M468 M487 L490 L552V403-V407 HydrophobicContact CG1-CG2 4.29Å; V403-V407 WeakPolarHBondContact O-CG2 3.38Å; V403-V407 PolarHBondContact O-N 2.83Å; V407-L411 WeakPolarHBondContact O-CA 3.36Å; V407-L411 VanDerWaalsContact O-CB 3.26Å; V407-L411 WeakPolarHBondContact O-CB 3.45Å; V407-L411 PolarHBondContact O-N 3.39Å; V407-M432 HydrophobicContact CG1-SD 4.2Å; V407-M468 HydrophobicContact CG2-CE 3.95Å; V407-M468 HydrophobicContact CG2-SD 3.92Å; V407-M487 HydrophobicContact CG1-CE 4.35Å; V407-L490 HydrophobicContact CG1-CD2 4.35Å; V407-L552 HydrophobicContact CG2-CD1 4.32Å
408G95.8Very high94.8Very high3 Ų39.2 Ų9.23%0.0316%0.057CC..Hα-helixtrans-61.3-52.1177.900000113.5F190 Y404 Y405 A406F190-G408 WeakPolarHBondContact CE1-O 3.49Å; Y404-G408 PolarHBondContact O-N 2.77Å; Y405-G408 PolarHBondContact O-N 3.45Å; A406-G408 VanDerWaalsContact C-N 3.31Å; A406-G408 PolarHBondContact O-N 3Å
409T97.1Very high94.3Very high0 Ų010.4 Ų10.40%06%0.062CC..Hα-helixtrans-62.9-44.1179.8-69.60000111.8N39 D66 S69 Y405 A406 L411 I533N39-T409 HydrophobicContact CB-CG2 4.23Å; D66-T409 HydrophobicContact CB-CG2 4.46Å; S69-T409 WeakPolarHBondContact CB-OG1 3.46Å; S69-T409 WeakPolarHBondContact OG-CG2 3.25Å; S69-T409 PolarHBondContact OG-OG1 2.9Å; Y405-T409 WeakPolarHBondContact O-CB 3.44Å; Y405-T409 PolarHBondContact O-N 3.48Å; Y405-T409 PolarHBondContact O-OG1 3.27Å; A406-T409 PolarHBondContact O-N 2.6Å; T409-L411 VanDerWaalsContact C-N 3.33Å; T409-L411 PolarHBondContact O-N 3.23Å; T409-I533 HydrophobicContact CG2-CD1 4.15Å; T409-I533 HydrophobicContact CG2-CG2 4.23Å
410L96.1Very high93.3Very high3 Ų315.6 Ų15.62%0.0169%0.094CC..Hα-helixtrans-89.91.7-172-55.6176.6000112.9D66 A406 N412 S413 I414 I533 A536 T537D66-L410 VanDerWaalsContact OD2-CD2 3.28Å; D66-L410 WeakPolarHBondContact OD2-CD2 3.5Å; A406-L410 WeakPolarHBondContact O-CB 3.32Å; A406-L410 WeakPolarHBondContact O-CG 3.34Å; A406-L410 PolarHBondContact O-N 3.16Å; L410-N412 PolarHBondContact O-N 3.48Å; L410-S413 PolarHBondContact O-N 3.07Å; L410-S413 VanDerWaalsContact O-N 3.17Å; L410-I414 HydrophobicContact CB-CD1 3.88Å; L410-I414 HydrophobicContact CB-CG1 4.21Å; L410-I414 WeakPolarHBondContact O-CB 3.3Å; L410-I414 VanDerWaalsContact O-CG1 3.31Å; L410-I414 WeakPolarHBondContact O-CG1 3.39Å; L410-I414 PolarHBondContact O-N 3.16Å; L410-I533 HydrophobicContact CD2-CG2 4.35Å; L410-A536 HydrophobicContact CD1-CB 3.77Å; L410-T537 VanDerWaalsContact CD2-OG1 3.25Å; L410-T537 WeakPolarHBondContact CD2-OG1 3.46Å
411L95.6Very high92.3Very high0 Ų018.9 Ų18.90%011%0.112CC..Hα-helixtrans-56.2-47.4-170.1-172.858.6000113I40 F190 V407 T409 S413 I414 L415 S425 A428 G429 F471 M487I40-L411 HydrophobicContact CD1-CB 4.23Å; I40-L411 HydrophobicContact CD1-CD2 4.15Å; I40-L411 HydrophobicContact CD1-CG 4.39Å; F190-L411 HydrophobicContact CD1-CD2 4.36Å; F190-L411 HydrophobicContact CE1-CD2 4.1Å; V407-L411 WeakPolarHBondContact O-CA 3.36Å; V407-L411 VanDerWaalsContact O-CB 3.26Å; V407-L411 WeakPolarHBondContact O-CB 3.45Å; V407-L411 PolarHBondContact O-N 3.39Å; T409-L411 VanDerWaalsContact C-N 3.33Å; T409-L411 PolarHBondContact O-N 3.23Å; L411-S413 PolarHBondContact O-N 2.94Å; L411-I414 PolarHBondContact O-N 3.45Å; L411-L415 HydrophobicContact CD1-CD1 3.81Å; L411-L415 HydrophobicContact CD1-CG 4.07Å; L411-L415 HydrophobicContact CG-CD1 3.96Å; L411-L415 HydrophobicContact CG-CG 4.5Å; L411-L415 WeakPolarHBondContact O-CB 3.06Å; L411-L415 WeakPolarHBondContact O-CG 3.46Å; L411-L415 PolarHBondContact O-N 2.99Å; L411-S425 WeakPolarHBondContact CD2-O 3.46Å; L411-A428 HydrophobicContact CD2-CB 4.35Å; L411-G429 VanDerWaalsContact CD2-N 3.28Å; L411-F471 HydrophobicContact CD1-CZ 4.39Å; L411-M487 HydrophobicContact CD1-CE 3.61Å; L411-M487 HydrophobicContact CD1-SD 4.39Å; L411-M487 HydrophobicContact CD2-CE 3.95Å; L411-M487 HydrophobicContact CG-CE 4.46Å
412N93.3Very high91.2Very high0 Ų019 Ų190%011%0.112CC..Hα-helixtrans-56.5-53.7178.4175.1-93.8000110.6I40 S42 D43 L410 I414 L415 L416I40-N412 HydrophobicContact CD1-CB 4.33Å; I40-N412 VanDerWaalsContact O-CB 3.24Å; I40-N412 WeakPolarHBondContact O-CB 3.32Å; I40-N412 VanDerWaalsContact O-CG 3.31Å; I40-N412 PolarHBondContact O-ND2 3.36Å; S42-N412 PolarHBondContact OG-OD1 3.28Å; D43-N412 PolarHBondContact N-OD1 3.4Å; D43-N412 PolarHBondContact OD1-ND2 3.33Å; D43-N412 PolarHBondContact OD1-OD1 2.98Å; L410-N412 PolarHBondContact O-N 3.48Å; N412-I414 PolarHBondContact O-N 3.27Å; N412-L415 PolarHBondContact O-N 2.89Å; N412-L416 WeakPolarHBondContact O-CB 3.16Å; N412-L416 VanDerWaalsContact O-CG 3.31Å; N412-L416 WeakPolarHBondContact O-CG 3.47Å; N412-L416 PolarHBondContact O-N 3.03Å; N412-L416 WeakPolarHBondContact OD1-CD1 3.37Å
413S90.8Very high90.4Very high17 Ų1720.6 Ų20.612%0.11912%0.122CC..Hα-helixtrans-64.7-34.1-179.7-80.70000114.1S42 L410 L411 R540S42-S413 PolarHBondContact OG-OG 3.05Å; L410-S413 PolarHBondContact O-N 3.07Å; L410-S413 VanDerWaalsContact O-N 3.17Å; L411-S413 PolarHBondContact O-N 2.94Å; S413-R540 PolarHBondContact OG-NH2 3.3Å
414I93.7Very high89.9Confident1 Ų123.1 Ų23.11%0.00514%0.135CC..Hα-helixtrans-65.5-49.1174.5-74.1168.5000109.9L410 L411 N412 G417 F471 L475 V545L410-I414 HydrophobicContact CB-CD1 3.88Å; L410-I414 HydrophobicContact CB-CG1 4.21Å; L410-I414 WeakPolarHBondContact O-CB 3.3Å; L410-I414 VanDerWaalsContact O-CG1 3.31Å; L410-I414 WeakPolarHBondContact O-CG1 3.39Å; L410-I414 PolarHBondContact O-N 3.16Å; L411-I414 PolarHBondContact O-N 3.45Å; N412-I414 PolarHBondContact O-N 3.27Å; I414-G417 PolarHBondContact O-N 3.18Å; I414-F471 HydrophobicContact CG2-CE1 4.15Å; I414-F471 HydrophobicContact CG2-CZ 3.85Å; I414-L475 HydrophobicContact CG2-CD1 3.77Å; I414-V545 HydrophobicContact CB-CG1 4.42Å; I414-V545 HydrophobicContact CG1-CG1 4.33Å; I414-V545 HydrophobicContact CG2-CG1 3.92Å
415L92.5Very high89.7Confident0 Ų022.7 Ų22.70%013%0.134CC..Hα-helixtrans-72.1-35.3-176.7-67.2177.9000112.3L411 N412 G417 Y418 F419 S425 A428 L475 M480 V483L411-L415 HydrophobicContact CD1-CD1 3.81Å; L411-L415 HydrophobicContact CD1-CG 4.07Å; L411-L415 HydrophobicContact CG-CD1 3.96Å; L411-L415 HydrophobicContact CG-CG 4.5Å; L411-L415 WeakPolarHBondContact O-CB 3.06Å; L411-L415 WeakPolarHBondContact O-CG 3.46Å; L411-L415 PolarHBondContact O-N 2.99Å; N412-L415 PolarHBondContact O-N 2.89Å; L415-G417 PolarHBondContact O-N 2.86Å; L415-Y418 PolarHBondContact O-N 3.28Å; L415-F419 HydrophobicContact CB-CD2 4.45Å; L415-F419 HydrophobicContact CD2-CD2 4.22Å; L415-F419 HydrophobicContact CD2-CE2 4.18Å; L415-F419 WeakPolarHBondContact O-CD2 3.5Å; L415-F419 PolarHBondContact O-N 3.31Å; L415-S425 WeakPolarHBondContact CB-OG 3.21Å; L415-A428 HydrophobicContact CD1-CB 3.95Å; L415-L475 HydrophobicContact CD2-CD2 3.67Å; L415-M480 HydrophobicContact CB-CE 4.4Å; L415-M480 HydrophobicContact CD1-CE 4.42Å; L415-M480 HydrophobicContact CD2-CE 4.44Å; L415-V483 HydrophobicContact CD2-CG1 4.04Å
416L88.1Confident89.5Confident45 Ų4521.4 Ų21.424%0.23613%0.129CC..Hα-helixtrans-62.3-20.8173.9-74.7177.8000113.4D43 N412 Y418 F419D43-L416 HydrophobicContact CB-CD1 3.52Å; N412-L416 WeakPolarHBondContact O-CB 3.16Å; N412-L416 VanDerWaalsContact O-CG 3.31Å; N412-L416 WeakPolarHBondContact O-CG 3.47Å; N412-L416 PolarHBondContact O-N 3.03Å; N412-L416 WeakPolarHBondContact OD1-CD1 3.37Å; L416-Y418 PolarHBondContact O-N 2.95Å; L416-F419 VanDerWaalsContact CA-O 3.31Å; L416-F419 WeakPolarHBondContact CA-O 3.26Å
417G86.3Confident89.4Confident45 Ų4526.4 Ų26.446%0.46415%0.148SC..THydrogen-bonded Turntrans-67.5-15.4170.700000114.5I414 L415I414-G417 PolarHBondContact O-N 3.18Å; L415-G417 PolarHBondContact O-N 2.86Å
418Y88.3Confident89.3Confident36 Ų3626.4 Ų26.414%0.14115%0.148CC..THydrogen-bonded Turntrans-129.2-22.2-176-65.9-92.3000113.9L415 L416 L475 Y476 V545L415-Y418 PolarHBondContact O-N 3.28Å; L416-Y418 PolarHBondContact O-N 2.95Å; Y418-L475 HydrophobicContact CD1-CB 4.05Å; Y418-L475 WeakPolarHBondContact CD1-O 3.05Å; Y418-L475 HydrophobicContact CD2-CB 3.88Å; Y418-L475 HydrophobicContact CD2-CD1 4.28Å; Y418-L475 HydrophobicContact CD2-CD2 4.4Å; Y418-L475 HydrophobicContact CD2-CG 4.4Å; Y418-L475 HydrophobicContact CE1-CB 3.95Å; Y418-L475 HydrophobicContact CE2-CB 3.76Å; Y418-L475 HydrophobicContact CE2-CD1 3.94Å; Y418-L475 HydrophobicContact CE2-CG 4.37Å; Y418-L475 HydrophobicContact CG-CB 4.02Å; Y418-Y476 HydrophobicContact CE1-CD1 4.22Å; Y418-Y476 HydrophobicContact CE1-CE1 4.33Å; Y418-Y476 HydrophobicContact CE1-CG 4.36Å; Y418-V545 HydrophobicContact CE2-CB 3.75Å; Y418-V545 HydrophobicContact CE2-CG1 3.81Å; Y418-V545 HydrophobicContact CE2-CG2 3.95Å
419F86.5Confident89.3Confident25 Ų2526.2 Ų26.211%0.1115%0.146CC..  trans-137.1147.2-172-55-83.2000110.6L415 L416 L475 R478 M480 V483L415-F419 HydrophobicContact CB-CD2 4.45Å; L415-F419 HydrophobicContact CD2-CD2 4.22Å; L415-F419 HydrophobicContact CD2-CE2 4.18Å; L415-F419 WeakPolarHBondContact O-CD2 3.5Å; L415-F419 PolarHBondContact O-N 3.31Å; L416-F419 VanDerWaalsContact CA-O 3.31Å; L416-F419 WeakPolarHBondContact CA-O 3.26Å; F419-L475 HydrophobicContact CE2-CD2 4.2Å; F419-R478 HydrophobicContact CE1-CB 4.32Å; F419-R478 WeakPolarHBondContact CE1-O 3.35Å; F419-M480 HydrophobicContact CB-CE 3.42Å; F419-M480 VanDerWaalsContact CB-CE 3.42Å; F419-M480 HydrophobicContact CD1-CE 3.75Å; F419-M480 HydrophobicContact CD1-CG 3.61Å; F419-M480 HydrophobicContact CD1-SD 4.02Å; F419-M480 HydrophobicContact CD2-CE 3.21Å; F419-M480 HydrophobicContact CD2-CG 4.46Å; F419-M480 HydrophobicContact CD2-SD 3.78Å; F419-M480 HydrophobicContact CE1-CB 4.39Å; F419-M480 HydrophobicContact CE1-CE 4.24Å; F419-M480 HydrophobicContact CE1-CG 3.5Å; F419-M480 HydrophobicContact CE1-SD 3.92Å; F419-M480 HydrophobicContact CE2-CE 3.8Å; F419-M480 HydrophobicContact CE2-CG 4.4Å; F419-M480 HydrophobicContact CE2-SD 3.69Å; F419-M480 HydrophobicContact CG-CE 3.17Å; F419-M480 HydrophobicContact CG-CG 4.09Å; F419-M480 HydrophobicContact CG-SD 3.94Å; F419-M480 HydrophobicContact CZ-CE 4.27Å; F419-M480 HydrophobicContact CZ-CG 3.93Å; F419-M480 HydrophobicContact CZ-SD 3.75Å; F419-V483 HydrophobicContact CE2-CG2 4.16Å; F419-V483 HydrophobicContact CZ-CG2 4.04Å
420T76.8Confident89.3Confident116 Ų11628.3 Ų28.371%0.71216%0.155SC*.SBendtrans-94.6-11.5-177.2520000114.2
421N77.6Confident89.4Confident69 Ų6929.7 Ų29.737%0.36916%0.164SC..  trans-96.5106.4-174-173.7-30.2000111.6T423 L424N421-T423 VanDerWaalsContact C-N 3.34Å; N421-T423 PolarHBondContact O-N 3.17Å; N421-T423 VanDerWaalsContact OD1-CB 3.32Å; N421-T423 WeakPolarHBondContact OD1-CB 3.13Å; N421-T423 PolarHBondContact OD1-N 3.35Å; N421-L424 HydrophobicContact CB-CD1 3.88Å; N421-L424 HydrophobicContact CB-CG 4.08Å; N421-L424 PolarHBondContact O-N 3.48Å; N421-L424 PolarHBondContact OD1-N 3.08Å
422S72.5Confident89.4Confident1 Ų129.8 Ų29.81%0.00717%0.165CC..Hα-helixtrans-67.8-27.4-179.358.30000114.1S199 L424 S425S199-S422 WeakPolarHBondContact CB-OG 3.46Å; S199-S422 PolarHBondContact OG-OG 2.85Å; S422-L424 VanDerWaalsContact C-N 3.25Å; S422-L424 PolarHBondContact O-N 3.17Å; S422-S425 WeakPolarHBondContact O-CB 3.49Å; S422-S425 PolarHBondContact O-N 3.31Å; S422-S425 VanDerWaalsContact O-N 3.16Å
423T82.4Confident89.5Confident35 Ų3529.8 Ų29.822%0.21517%0.165CC..Hα-helixtrans-62.9-33.9176.9-53.10000111.6P194 L195 N421 S425 G426 W427P194-T423 PolarHBondContact O-OG1 3Å; L195-T423 HydrophobicContact CD2-CG2 4.12Å; N421-T423 VanDerWaalsContact C-N 3.34Å; N421-T423 PolarHBondContact O-N 3.17Å; N421-T423 VanDerWaalsContact OD1-CB 3.32Å; N421-T423 WeakPolarHBondContact OD1-CB 3.13Å; N421-T423 PolarHBondContact OD1-N 3.35Å; T423-S425 VanDerWaalsContact C-N 3.28Å; T423-S425 PolarHBondContact O-N 3Å; T423-G426 PolarHBondContact O-N 3.15Å; T423-W427 PolarHBondContact O-N 3.03Å
424L87.8Confident89.8Confident52 Ų5231.1 Ų31.127%0.27217%0.17SC..Hα-helixtrans-67.4-30.1178.5-62.2178.2000112.3N421 S422 W427 A428 M480 F484N421-L424 HydrophobicContact CB-CD1 3.88Å; N421-L424 HydrophobicContact CB-CG 4.08Å; N421-L424 PolarHBondContact O-N 3.48Å; N421-L424 PolarHBondContact OD1-N 3.08Å; S422-L424 VanDerWaalsContact C-N 3.25Å; S422-L424 PolarHBondContact O-N 3.17Å; L424-W427 PolarHBondContact O-N 3.16Å; L424-A428 WeakPolarHBondContact O-CB 3.24Å; L424-A428 PolarHBondContact O-N 3.27Å; L424-M480 HydrophobicContact CB-CE 3.75Å; L424-M480 HydrophobicContact CB-CG 4.46Å; L424-M480 HydrophobicContact CB-SD 4.35Å; L424-M480 HydrophobicContact CD1-CB 4.28Å; L424-M480 HydrophobicContact CD1-CE 4.29Å; L424-M480 HydrophobicContact CD1-CG 3.72Å; L424-F484 HydrophobicContact CD2-CZ 4.3Å
425S90.3Very high90Very high1 Ų131 Ų311%0.00717%0.17CC..Hα-helixtrans-62.9-42.3174.4-55.10000112L411 L415 S422 T423 A428 G429L411-S425 WeakPolarHBondContact CD2-O 3.46Å; L415-S425 WeakPolarHBondContact CB-OG 3.21Å; S422-S425 WeakPolarHBondContact O-CB 3.49Å; S422-S425 PolarHBondContact O-N 3.31Å; S422-S425 VanDerWaalsContact O-N 3.16Å; T423-S425 VanDerWaalsContact C-N 3.28Å; T423-S425 PolarHBondContact O-N 3Å; S425-A428 PolarHBondContact O-N 3.27Å; S425-G429 PolarHBondContact O-N 3.04Å
426G93.5Very high90.1Very high1 Ų131 Ų311%0.0117%0.17CC..Hα-helixtrans-59.8-47.1175.700000113F190 T423 A428 G429 F430F190-G426 WeakPolarHBondContact O-CA 3.32Å; T423-G426 PolarHBondContact O-N 3.15Å; G426-A428 VanDerWaalsContact C-N 3.3Å; G426-A428 PolarHBondContact O-N 3.08Å; G426-G429 PolarHBondContact O-N 3.03Å; G426-F430 WeakPolarHBondContact O-CB 3.45Å; G426-F430 PolarHBondContact O-N 3.48Å
427W94.9Very high90.3Very high104 Ų10430.1 Ų30.139%0.39416%0.164SC..Hα-helixtrans-63.3-35.1175.8-76.6107.7000112.8L191 L195 T423 L424 F430 T431 F484L191-W427 HydrophobicContact CD1-CD2 3.65Å; L191-W427 HydrophobicContact CD1-CE3 3.66Å; L191-W427 HydrophobicContact CD1-CG 4.39Å; L191-W427 HydrophobicContact CD1-CH2 3.69Å; L191-W427 HydrophobicContact CD1-CZ2 3.67Å; L191-W427 HydrophobicContact CD1-CZ3 3.68Å; L191-W427 HydrophobicContact CD2-CH2 4.4Å; L191-W427 HydrophobicContact CD2-CZ3 4.41Å; L195-W427 HydrophobicContact CD2-CZ2 4.35Å; T423-W427 PolarHBondContact O-N 3.03Å; L424-W427 PolarHBondContact O-N 3.16Å; W427-F430 HydrophobicContact CE3-CD1 4.08Å; W427-F430 HydrophobicContact CZ3-CD1 4.1Å; W427-F430 HydrophobicContact CZ3-CE1 4.28Å; W427-F430 PolarHBondContact O-N 3.22Å; W427-T431 WeakPolarHBondContact O-CB 3.21Å; W427-T431 PolarHBondContact O-N 3.17Å; W427-T431 PolarHBondContact O-OG1 3.46Å; W427-F484 HydrophobicContact CB-CE1 3.57Å; W427-F484 HydrophobicContact CB-CZ 3.87Å
428A95.4Very high90.7Very high0 Ų033.6 Ų33.60%017%0.167CC..Hα-helixtrans-66.7-43.5179.500000110.4L411 L415 L424 S425 G426 T431 M432 F484 M487L411-A428 HydrophobicContact CD2-CB 4.35Å; L415-A428 HydrophobicContact CD1-CB 3.95Å; L424-A428 WeakPolarHBondContact O-CB 3.24Å; L424-A428 PolarHBondContact O-N 3.27Å; S425-A428 PolarHBondContact O-N 3.27Å; G426-A428 VanDerWaalsContact C-N 3.3Å; G426-A428 PolarHBondContact O-N 3.08Å; A428-T431 PolarHBondContact O-N 3.35Å; A428-M432 PolarHBondContact O-N 3.13Å; A428-M432 VanDerWaalsContact O-N 3.1Å; A428-F484 HydrophobicContact CB-CD1 4.34Å; A428-F484 HydrophobicContact CB-CE1 4.07Å; A428-M487 HydrophobicContact CB-CG 4.33Å
429G96.2Very high90.9Very high0 Ų031.9 Ų31.90%016%0.161CC..Hα-helixtrans-63.8-46.517400000111.8L411 S425 G426 T431 M432 I433L411-G429 VanDerWaalsContact CD2-N 3.28Å; S425-G429 PolarHBondContact O-N 3.04Å; G426-G429 PolarHBondContact O-N 3.03Å; G429-T431 VanDerWaalsContact C-N 3.33Å; G429-T431 PolarHBondContact O-N 3.5Å; G429-M432 WeakPolarHBondContact O-CB 3.45Å; G429-M432 PolarHBondContact O-N 3.46Å; G429-I433 WeakPolarHBondContact O-CG1 3.46Å; G429-I433 PolarHBondContact O-N 3.22Å; G429-I433 VanDerWaalsContact O-N 3.08Å
430F97.1Very high91.2Very high43 Ų4331.1 Ų31.119%0.18916%0.158CC..Hα-helixtrans-55.5-47.2175.2178.4-96.3000112.1A187 L191 G426 W427 M432 I433 I434A187-F430 HydrophobicContact CB-CD2 3.82Å; A187-F430 HydrophobicContact CB-CE2 4.01Å; A187-F430 WeakPolarHBondContact O-CD2 3.18Å; L191-F430 HydrophobicContact CB-CB 4.26Å; L191-F430 HydrophobicContact CB-CD2 3.8Å; L191-F430 HydrophobicContact CB-CG 4.25Å; L191-F430 HydrophobicContact CD1-CG 4.47Å; L191-F430 HydrophobicContact CD2-CD2 3.79Å; L191-F430 HydrophobicContact CD2-CE2 3.78Å; L191-F430 HydrophobicContact CD2-CG 4.29Å; L191-F430 HydrophobicContact CD2-CZ 4.26Å; L191-F430 HydrophobicContact CG-CD2 4.29Å; G426-F430 WeakPolarHBondContact O-CB 3.45Å; G426-F430 PolarHBondContact O-N 3.48Å; W427-F430 HydrophobicContact CE3-CD1 4.08Å; W427-F430 HydrophobicContact CZ3-CD1 4.1Å; W427-F430 HydrophobicContact CZ3-CE1 4.28Å; W427-F430 PolarHBondContact O-N 3.22Å; F430-M432 VanDerWaalsContact C-N 3.33Å; F430-M432 PolarHBondContact O-N 2.95Å; F430-I433 PolarHBondContact O-N 3.42Å; F430-I434 HydrophobicContact CD1-CG1 4.09Å; F430-I434 HydrophobicContact CD2-CG1 4.27Å; F430-I434 HydrophobicContact CE1-CG1 3.68Å; F430-I434 HydrophobicContact CE2-CD1 4.06Å; F430-I434 HydrophobicContact CE2-CG1 3.88Å; F430-I434 HydrophobicContact CG-CG1 4.38Å; F430-I434 HydrophobicContact CZ-CD1 3.94Å; F430-I434 HydrophobicContact CZ-CG1 3.57Å; F430-I434 WeakPolarHBondContact O-CG1 3.33Å; F430-I434 PolarHBondContact O-N 3.23Å
431T97Very high91.8Very high32 Ų3229 Ų2920%0.19615%0.145CC..Hα-helixtrans-58-45.2178.4-59.80000111.4W427 A428 G429 I433 A435 F488W427-T431 WeakPolarHBondContact O-CB 3.21Å; W427-T431 PolarHBondContact O-N 3.17Å; W427-T431 PolarHBondContact O-OG1 3.46Å; A428-T431 PolarHBondContact O-N 3.35Å; G429-T431 VanDerWaalsContact C-N 3.33Å; G429-T431 PolarHBondContact O-N 3.5Å; T431-I433 PolarHBondContact O-N 2.99Å; T431-A435 VanDerWaalsContact O-CB 3.23Å; T431-A435 WeakPolarHBondContact O-CB 3.33Å; T431-A435 PolarHBondContact O-N 3.27Å; T431-F488 HydrophobicContact CG2-CB 3.93Å; T431-F488 HydrophobicContact CG2-CD2 4.35Å
432M96.4Very high92.5Very high2 Ų229.3 Ų29.31%0.0115%0.146CC..Hα-helixtrans-59.3-46.6177.3-175.4-17469.700112.1F190 Y404 V407 A428 G429 F430 G436 M487 G491F190-M432 HydrophobicContact CE2-CE 4.45Å; F190-M432 HydrophobicContact CZ-CE 4.44Å; Y404-M432 HydrophobicContact CD2-CE 4.35Å; Y404-M432 HydrophobicContact CD2-SD 4.28Å; Y404-M432 HydrophobicContact CE2-CE 3.72Å; Y404-M432 HydrophobicContact CE2-CG 4.12Å; Y404-M432 HydrophobicContact CE2-SD 3.89Å; V407-M432 HydrophobicContact CG1-SD 4.2Å; A428-M432 PolarHBondContact O-N 3.13Å; A428-M432 VanDerWaalsContact O-N 3.1Å; G429-M432 WeakPolarHBondContact O-CB 3.45Å; G429-M432 PolarHBondContact O-N 3.46Å; F430-M432 VanDerWaalsContact C-N 3.33Å; F430-M432 PolarHBondContact O-N 2.95Å; M432-G436 PolarHBondContact O-N 3.35Å; M432-M487 WeakPolarHBondContact CA-O 3.25Å; M432-M487 HydrophobicContact CB-CB 4.41Å; M432-M487 HydrophobicContact CB-CE 3.94Å; M432-M487 HydrophobicContact CG-CE 4.19Å; M432-M487 HydrophobicContact SD-CE 3.58Å; M432-M487 VanDerWaalsContact SD-CE 3.58Å; M432-G491 VanDerWaalsContact CG-CA 3.47Å; M432-G491 WeakPolarHBondContact O-CA 3.48Å
433I96.6Very high93.4Very high1 Ų129.5 Ų29.51%0.00515%0.147CC..Hα-helixtrans-67.6-45.7-178.8-55.3-51.7000111.7Q183 V186 A187 F190 Y404 G429 F430 T431 A435 G436 I437Q183-I433 HydrophobicContact CB-CG2 4.23Å; Q183-I433 WeakPolarHBondContact O-CG2 3.33Å; V186-I433 HydrophobicContact CB-CD1 4.45Å; V186-I433 HydrophobicContact CB-CG1 4.39Å; V186-I433 HydrophobicContact CB-CG2 4.42Å; V186-I433 HydrophobicContact CG1-CD1 3.69Å; V186-I433 HydrophobicContact CG1-CG1 3.87Å; A187-I433 HydrophobicContact CB-CB 3.93Å; A187-I433 HydrophobicContact CB-CG2 3.77Å; F190-I433 HydrophobicContact CD2-CD1 4.23Å; F190-I433 HydrophobicContact CD2-CG1 3.66Å; F190-I433 HydrophobicContact CE2-CD1 3.83Å; F190-I433 HydrophobicContact CE2-CG1 3.79Å; Y404-I433 WeakPolarHBondContact OH-CD1 3.43Å; G429-I433 WeakPolarHBondContact O-CG1 3.46Å; G429-I433 PolarHBondContact O-N 3.22Å; G429-I433 VanDerWaalsContact O-N 3.08Å; F430-I433 PolarHBondContact O-N 3.42Å; T431-I433 PolarHBondContact O-N 2.99Å; I433-A435 PolarHBondContact O-N 2.97Å; I433-G436 WeakPolarHBondContact O-CA 3.36Å; I433-G436 PolarHBondContact O-N 3.45Å; I433-G436 VanDerWaalsContact O-N 3.12Å; I433-I437 PolarHBondContact O-N 2.88Å
434I96.7Very high93.6Very high44 Ų4428.4 Ų28.423%0.22614%0.142CC..Hα-helixtrans-62.5-45.2179.7-65.8-58000110.7L184 A187 F430 G436 I437 F438L184-I434 HydrophobicContact CD2-CD1 4.38Å; A187-I434 HydrophobicContact CB-CD1 4.13Å; F430-I434 HydrophobicContact CD1-CG1 4.09Å; F430-I434 HydrophobicContact CD2-CG1 4.27Å; F430-I434 HydrophobicContact CE1-CG1 3.68Å; F430-I434 HydrophobicContact CE2-CD1 4.06Å; F430-I434 HydrophobicContact CE2-CG1 3.88Å; F430-I434 HydrophobicContact CG-CG1 4.38Å; F430-I434 HydrophobicContact CZ-CD1 3.94Å; F430-I434 HydrophobicContact CZ-CG1 3.57Å; F430-I434 WeakPolarHBondContact O-CG1 3.33Å; F430-I434 PolarHBondContact O-N 3.23Å; I434-G436 PolarHBondContact O-N 2.97Å; I434-I437 HydrophobicContact CD1-CD1 4.32Å; I434-I437 PolarHBondContact O-N 3.29Å; I434-F438 HydrophobicContact CG2-CD2 4.12Å; I434-F438 HydrophobicContact CG2-CE2 3.7Å; I434-F438 WeakPolarHBondContact O-CD2 2.96Å; I434-F438 PolarHBondContact O-N 3.21Å
435A96.7Very high93.6Very high0 Ų029.3 Ų29.30%015%0.15CC..Hα-helixtrans-60.1-37.4174.600000111.8T431 I433 F438 G439 F488 F492T431-A435 VanDerWaalsContact O-CB 3.23Å; T431-A435 WeakPolarHBondContact O-CB 3.33Å; T431-A435 PolarHBondContact O-N 3.27Å; I433-A435 PolarHBondContact O-N 2.97Å; A435-F438 PolarHBondContact O-N 3.24Å; A435-G439 PolarHBondContact O-N 2.86Å; A435-F488 HydrophobicContact CB-CB 4.22Å; A435-F488 HydrophobicContact CB-CD1 4.26Å; A435-F488 HydrophobicContact CB-CD2 3.41Å; A435-F488 VanDerWaalsContact CB-CD2 3.41Å; A435-F488 HydrophobicContact CB-CE1 4.48Å; A435-F488 HydrophobicContact CB-CE2 3.69Å; A435-F488 HydrophobicContact CB-CG 3.71Å; A435-F488 HydrophobicContact CB-CZ 4.22Å; A435-F488 WeakPolarHBondContact CB-O 3.2Å; A435-F492 HydrophobicContact CB-CB 4.4Å
436G94.9Very high93.6Very high0 Ų033.1 Ų33.10%017%0.169CC..Hα-helixtrans-62.1-38.817500000114.6M432 I433 I434 G439 S440 G491 T495M432-G436 PolarHBondContact O-N 3.35Å; I433-G436 WeakPolarHBondContact O-CA 3.36Å; I433-G436 PolarHBondContact O-N 3.45Å; I433-G436 VanDerWaalsContact O-N 3.12Å; I434-G436 PolarHBondContact O-N 2.97Å; G436-G439 PolarHBondContact O-N 3.47Å; G436-S440 PolarHBondContact O-N 3.2Å; G436-S440 PolarHBondContact O-OG 2.81Å; G436-G491 WeakPolarHBondContact CA-O 3.26Å; G436-T495 VanDerWaalsContact CA-OG1 3.3Å; G436-T495 WeakPolarHBondContact CA-OG1 3.4Å; G436-T495 WeakPolarHBondContact O-CB 3.26Å; G436-T495 VanDerWaalsContact O-CG2 3.3Å; G436-T495 WeakPolarHBondContact O-CG2 3.09Å
437I93.6Very high93.4Very high25 Ų2533 Ų3313%0.12817%0.169CC..Hα-helixtrans-59.8-48.6172.8-64.4170.6000109.7F180 Q183 L184 I433 I434 G439 S440 V441F180-I437 HydrophobicContact CD1-CG1 4.44Å; F180-I437 HydrophobicContact CD1-CG2 3.92Å; F180-I437 HydrophobicContact CD2-CG2 4.46Å; F180-I437 HydrophobicContact CE1-CG2 4.02Å; F180-I437 HydrophobicContact CG-CG2 4.18Å; F180-I437 HydrophobicContact CZ-CG2 4.34Å; Q183-I437 HydrophobicContact CB-CD1 3.87Å; Q183-I437 HydrophobicContact CB-CG1 3.76Å; Q183-I437 HydrophobicContact CG-CG1 4.34Å; L184-I437 HydrophobicContact CD2-CD1 3.97Å; L184-I437 HydrophobicContact CG-CD1 4.25Å; I433-I437 PolarHBondContact O-N 2.88Å; I434-I437 HydrophobicContact CD1-CD1 4.32Å; I434-I437 PolarHBondContact O-N 3.29Å; I437-G439 VanDerWaalsContact C-N 3.34Å; I437-G439 PolarHBondContact O-N 3.19Å; I437-S440 PolarHBondContact O-N 3.39Å; I437-S440 PolarHBondContact O-OG 3.45Å; I437-V441 WeakPolarHBondContact O-CG2 3.46Å; I437-V441 PolarHBondContact O-N 3.29Å
438F93.5Very high92.9Very high119 Ų11932.3 Ų32.352%0.52217%0.172SC..Hα-helixtrans-61.8-42.1175.9-70.9-72000112.4I434 A435 V441 I442I434-F438 HydrophobicContact CG2-CD2 4.12Å; I434-F438 HydrophobicContact CG2-CE2 3.7Å; I434-F438 WeakPolarHBondContact O-CD2 2.96Å; I434-F438 PolarHBondContact O-N 3.21Å; A435-F438 PolarHBondContact O-N 3.24Å; F438-V441 PolarHBondContact O-N 3Å; F438-I442 WeakPolarHBondContact O-CB 3.46Å; F438-I442 WeakPolarHBondContact O-CG1 3.35Å; F438-I442 PolarHBondContact O-N 3.15Å
439G93.5Very high92.6Very high0 Ų040.5 Ų40.50%021%0.208CC..Hα-helixtrans-54-54.317600000111.7A435 G436 I437 V441 I442 T443 F492A435-G439 PolarHBondContact O-N 2.86Å; G436-G439 PolarHBondContact O-N 3.47Å; I437-G439 VanDerWaalsContact C-N 3.34Å; I437-G439 PolarHBondContact O-N 3.19Å; G439-V441 VanDerWaalsContact C-N 3.33Å; G439-V441 PolarHBondContact O-N 3.37Å; G439-I442 PolarHBondContact O-N 2.9Å; G439-T443 WeakPolarHBondContact O-CB 3.47Å; G439-T443 VanDerWaalsContact O-CG2 3.22Å; G439-T443 WeakPolarHBondContact O-CG2 3.47Å; G439-T443 PolarHBondContact O-N 2.88Å; G439-T443 PolarHBondContact O-OG1 3.04Å; G439-F492 VanDerWaalsContact CA-CD2 3.45Å; G439-F492 VanDerWaalsContact CA-CE2 3.49Å; G439-F492 WeakPolarHBondContact CA-O 3.44Å
440S91.2Very high92.3Very high9 Ų943.6 Ų43.66%0.06323%0.227CC..Hα-helixtrans-57.6-39.8179.865.10000114.4F180 G436 I437 T443 G444 S499F180-S440 WeakPolarHBondContact CE1-OG 3.28Å; G436-S440 PolarHBondContact O-N 3.2Å; G436-S440 PolarHBondContact O-OG 2.81Å; I437-S440 PolarHBondContact O-N 3.39Å; I437-S440 PolarHBondContact O-OG 3.45Å; S440-T443 PolarHBondContact O-OG1 3.48Å; S440-G444 PolarHBondContact O-N 2.99Å; S440-G444 VanDerWaalsContact O-N 3.1Å; S440-S499 VanDerWaalsContact CB-OG 3.27Å; S440-S499 WeakPolarHBondContact CB-OG 3.35Å
441V90.4Very high91.8Very high70 Ų7046 Ų4642%0.42424%0.237SC..Hα-helixtrans-69-49.5177.8176.20000110.5F180 I437 F438 G439 G444 V445F180-V441 HydrophobicContact CE1-CG2 4.38Å; F180-V441 HydrophobicContact CE2-CG2 3.84Å; F180-V441 HydrophobicContact CZ-CG2 3.39Å; I437-V441 WeakPolarHBondContact O-CG2 3.46Å; I437-V441 PolarHBondContact O-N 3.29Å; F438-V441 PolarHBondContact O-N 3Å; G439-V441 VanDerWaalsContact C-N 3.33Å; G439-V441 PolarHBondContact O-N 3.37Å; V441-G444 PolarHBondContact O-N 3.28Å; V441-V445 VanDerWaalsContact O-CG2 3.3Å; V441-V445 WeakPolarHBondContact O-CG2 3.48Å; V441-V445 PolarHBondContact O-N 3.26Å
442I92.3Very high91.4Very high76 Ų7650 Ų5039%0.3925%0.252SS..Hα-helixtrans-66.6-44.6-175.5-70165.8000110.4F438 G439 V445 I446 F492F438-I442 WeakPolarHBondContact O-CB 3.46Å; F438-I442 WeakPolarHBondContact O-CG1 3.35Å; F438-I442 PolarHBondContact O-N 3.15Å; G439-I442 PolarHBondContact O-N 2.9Å; I442-V445 PolarHBondContact O-N 3.4Å; I442-I446 HydrophobicContact CG2-CD1 3.73Å; I442-I446 HydrophobicContact CG2-CG1 4.43Å; I442-I446 VanDerWaalsContact O-CG1 3.25Å; I442-I446 WeakPolarHBondContact O-CG1 3.43Å; I442-I446 PolarHBondContact O-N 3.07Å; I442-F492 HydrophobicContact CB-CZ 4.15Å; I442-F492 HydrophobicContact CD1-CE2 3.84Å; I442-F492 HydrophobicContact CD1-CZ 4.07Å; I442-F492 HydrophobicContact CG2-CZ 4.16Å
443T90.6Very high91.1Very high6 Ų650.2 Ų50.24%0.03725%0.253CS..Hα-helixtrans-66.2-39179.561.60000111.5G439 S440 I446 L447 I460 F492 G496G439-T443 WeakPolarHBondContact O-CB 3.47Å; G439-T443 VanDerWaalsContact O-CG2 3.22Å; G439-T443 WeakPolarHBondContact O-CG2 3.47Å; G439-T443 PolarHBondContact O-N 2.88Å; G439-T443 PolarHBondContact O-OG1 3.04Å; S440-T443 PolarHBondContact O-OG1 3.48Å; T443-I446 PolarHBondContact O-N 2.88Å; T443-L447 VanDerWaalsContact O-CB 3.3Å; T443-L447 WeakPolarHBondContact O-CB 3.18Å; T443-L447 PolarHBondContact O-N 3.26Å; T443-I460 HydrophobicContact CG2-CD1 3.43Å; T443-I460 VanDerWaalsContact CG2-CD1 3.43Å; T443-I460 HydrophobicContact CG2-CG1 4.21Å; T443-F492 HydrophobicContact CG2-CE1 4.43Å; T443-G496 WeakPolarHBondContact OG1-CA 3.04Å; T443-G496 PolarHBondContact OG1-O 3.27Å
444G86.5Confident90.7Very high11 Ų1153.2 Ų53.211%0.11327%0.266CS..Hα-helixtrans-60.1-46.8171.700000112.7S440 V441 I446 L447 D448S440-G444 PolarHBondContact O-N 2.99Å; S440-G444 VanDerWaalsContact O-N 3.1Å; V441-G444 PolarHBondContact O-N 3.28Å; G444-I446 PolarHBondContact O-N 3.44Å; G444-L447 PolarHBondContact O-N 3.41Å; G444-D448 WeakPolarHBondContact O-CB 3.41Å; G444-D448 PolarHBondContact O-N 3.49Å
445V88.3Confident90.5Very high71 Ų7155.2 Ų55.243%0.4328%0.276SS..Hα-helixtrans-62.4-40.9176.8170.70000112.1V441 I442 K449V441-V445 VanDerWaalsContact O-CG2 3.3Å; V441-V445 WeakPolarHBondContact O-CG2 3.48Å; V441-V445 PolarHBondContact O-N 3.26Å; I442-V445 PolarHBondContact O-N 3.4Å; V445-K449 HydrophobicContact CG1-CD 4.29Å; V445-K449 WeakPolarHBondContact O-CG 3.49Å; V445-K449 PolarHBondContact O-N 3.12Å; V445-K449 VanDerWaalsContact O-N 3.11Å
446I91.4Very high90.4Very high81 Ų8156 Ų5642%0.41528%0.28SS..Hα-helixtrans-65.7-43.7176.9-67.5167.3000110.2I442 T443 G444 K449 T450 I456I442-I446 HydrophobicContact CG2-CD1 3.73Å; I442-I446 HydrophobicContact CG2-CG1 4.43Å; I442-I446 VanDerWaalsContact O-CG1 3.25Å; I442-I446 WeakPolarHBondContact O-CG1 3.43Å; I442-I446 PolarHBondContact O-N 3.07Å; T443-I446 PolarHBondContact O-N 2.88Å; G444-I446 PolarHBondContact O-N 3.44Å; I446-K449 PolarHBondContact O-N 2.87Å; I446-T450 HydrophobicContact CG2-CG2 4.29Å; I446-T450 WeakPolarHBondContact O-CB 3.41Å; I446-T450 VanDerWaalsContact O-CG2 3.29Å; I446-T450 WeakPolarHBondContact O-CG2 3.4Å; I446-T450 PolarHBondContact O-N 3.39Å; I446-T450 PolarHBondContact O-OG1 3.36Å; I446-I456 HydrophobicContact CG2-CD1 3.83Å
447L87.8Confident90.3Very high0 Ų056.1 Ų56.10%028%0.281CS..Hα-helixtrans-61.5-45.5176.9178.661.9000111.3T443 G444 K449 T450 K451 F453 I456 I500 E503T443-L447 VanDerWaalsContact O-CB 3.3Å; T443-L447 WeakPolarHBondContact O-CB 3.18Å; T443-L447 PolarHBondContact O-N 3.26Å; G444-L447 PolarHBondContact O-N 3.41Å; L447-K449 VanDerWaalsContact C-N 3.32Å; L447-K449 PolarHBondContact O-N 2.88Å; L447-T450 PolarHBondContact O-N 3.37Å; L447-K451 VanDerWaalsContact O-CA 3.31Å; L447-K451 WeakPolarHBondContact O-CA 3.38Å; L447-K451 PolarHBondContact O-N 3.39Å; L447-F453 HydrophobicContact CD1-CB 4.24Å; L447-F453 HydrophobicContact CD1-CD1 3.85Å; L447-F453 HydrophobicContact CD1-CD2 3.91Å; L447-F453 HydrophobicContact CD1-CE1 4.09Å; L447-F453 HydrophobicContact CD1-CE2 4.07Å; L447-F453 HydrophobicContact CD1-CG 3.76Å; L447-F453 HydrophobicContact CD1-CZ 4.18Å; L447-F453 HydrophobicContact CD2-CD1 3.9Å; L447-F453 HydrophobicContact CD2-CE1 3.68Å; L447-F453 HydrophobicContact CD2-CZ 4.18Å; L447-F453 HydrophobicContact CG-CD1 4.32Å; L447-F453 HydrophobicContact CG-CE1 4.11Å; L447-F453 HydrophobicContact CG-CE2 4.45Å; L447-F453 HydrophobicContact CG-CZ 4.16Å; L447-I456 HydrophobicContact CB-CD1 4.24Å; L447-I456 HydrophobicContact CD1-CD1 4.03Å; L447-I500 HydrophobicContact CD2-CB 4.27Å; L447-I500 HydrophobicContact CD2-CG1 3.79Å; L447-I500 HydrophobicContact CD2-CG2 3.96Å; L447-E503 HydrophobicContact CD2-CB 4.33Å; L447-E503 WeakPolarHBondContact CD2-OE2 3.35Å
448D85.2Confident90.4Very high88 Ų8855.8 Ų55.847%0.47128%0.28SS..Hα-helixtrans-62.6-38179.2-99.8-26.7000113.3G444 K451G444-D448 WeakPolarHBondContact O-CB 3.41Å; G444-D448 PolarHBondContact O-N 3.49Å; D448-K451 VanDerWaalsContact O-CD 3.31Å; D448-K451 WeakPolarHBondContact O-CD 3.48Å; D448-K451 WeakPolarHBondContact O-CE 3.39Å; D448-K451 PolarHBondContact O-NZ 3.45Å; D448-K451 IonicContact OD1-NZ 2.89Å; D448-K451 PolarHBondContact OD1-NZ 2.95Å
449K89.1Confident90.5Very high173 Ų17354.2 Ų54.275%0.75228%0.277SS*.Hα-helixtrans-74.3-39.7178.9-75.4-179.1177.5-177.10113V445 I446 L447V445-K449 HydrophobicContact CG1-CD 4.29Å; V445-K449 WeakPolarHBondContact O-CG 3.49Å; V445-K449 PolarHBondContact O-N 3.12Å; V445-K449 VanDerWaalsContact O-N 3.11Å; I446-K449 PolarHBondContact O-N 2.87Å; L447-K449 VanDerWaalsContact C-N 3.32Å; L447-K449 PolarHBondContact O-N 2.88Å
450T90.7Very high90.6Very high64 Ų6454.6 Ų54.639%0.39328%0.278SS..Hα-helixtrans-91.4-27-172.760.20000113I446 L447 K452 I456I446-T450 HydrophobicContact CG2-CG2 4.29Å; I446-T450 WeakPolarHBondContact O-CB 3.41Å; I446-T450 VanDerWaalsContact O-CG2 3.29Å; I446-T450 WeakPolarHBondContact O-CG2 3.4Å; I446-T450 PolarHBondContact O-N 3.39Å; I446-T450 PolarHBondContact O-OG1 3.36Å; L447-T450 PolarHBondContact O-N 3.37Å; T450-K452 PolarHBondContact O-N 3.22Å; T450-K452 VanDerWaalsContact O-N 3.08Å; T450-K452 PolarHBondContact OG1-N 3.48Å; T450-I456 WeakPolarHBondContact OG1-CD1 3.41Å
451K85.9Confident90.9Very high94 Ų9454.1 Ų54.141%0.40928%0.275SS..  trans53.319.8-171.1-56.9-56.7-172.2-172.10114.2L447 D448 F453L447-K451 VanDerWaalsContact O-CA 3.31Å; L447-K451 WeakPolarHBondContact O-CA 3.38Å; L447-K451 PolarHBondContact O-N 3.39Å; D448-K451 VanDerWaalsContact O-CD 3.31Å; D448-K451 WeakPolarHBondContact O-CD 3.48Å; D448-K451 WeakPolarHBondContact O-CE 3.39Å; D448-K451 PolarHBondContact O-NZ 3.45Å; D448-K451 IonicContact OD1-NZ 2.89Å; D448-K451 PolarHBondContact OD1-NZ 2.95Å; K451-F453 HydrophobicContact CD-CE2 4.35Å; K451-F453 WeakPolarHBondContact O-CD2 3.46Å; K451-F453 PolarHBondContact O-N 3.36Å
452K89.1Confident91.2Very high117 Ų11754.2 Ų54.251%0.50927%0.273SS..  trans-9371.6179.3-68.6-177178.1-173.10111.1T450 K454 I455 I456T450-K452 PolarHBondContact O-N 3.22Å; T450-K452 VanDerWaalsContact O-N 3.08Å; T450-K452 PolarHBondContact OG1-N 3.48Å; K452-K454 PolarHBondContact O-N 3.29Å; K452-I455 HydrophobicContact CB-CB 4.42Å; K452-I455 HydrophobicContact CD-CD1 4.21Å; K452-I456 HydrophobicContact CB-CD1 4.48Å; K452-I456 WeakPolarHBondContact O-CB 3.3Å; K452-I456 WeakPolarHBondContact O-CG1 3.45Å; K452-I456 PolarHBondContact O-N 3.1Å
453F88.6Confident91.5Very high5 Ų552.9 Ų52.92%0.02227%0.266CS..Hα-helixtrans-56.7-51.2-174.1-76.6-101.5000112.3L447 K451 T457 E503 L504 E507 L570L447-F453 HydrophobicContact CD1-CB 4.24Å; L447-F453 HydrophobicContact CD1-CD1 3.85Å; L447-F453 HydrophobicContact CD1-CD2 3.91Å; L447-F453 HydrophobicContact CD1-CE1 4.09Å; L447-F453 HydrophobicContact CD1-CE2 4.07Å; L447-F453 HydrophobicContact CD1-CG 3.76Å; L447-F453 HydrophobicContact CD1-CZ 4.18Å; L447-F453 HydrophobicContact CD2-CD1 3.9Å; L447-F453 HydrophobicContact CD2-CE1 3.68Å; L447-F453 HydrophobicContact CD2-CZ 4.18Å; L447-F453 HydrophobicContact CG-CD1 4.32Å; L447-F453 HydrophobicContact CG-CE1 4.11Å; L447-F453 HydrophobicContact CG-CE2 4.45Å; L447-F453 HydrophobicContact CG-CZ 4.16Å; K451-F453 HydrophobicContact CD-CE2 4.35Å; K451-F453 WeakPolarHBondContact O-CD2 3.46Å; K451-F453 PolarHBondContact O-N 3.36Å; F453-T457 VanDerWaalsContact O-CB 3.24Å; F453-T457 WeakPolarHBondContact O-CB 3.34Å; F453-T457 PolarHBondContact O-N 2.84Å; F453-T457 VanDerWaalsContact O-N 3.08Å; F453-T457 PolarHBondContact O-OG1 3.31Å; F453-E503 HydrophobicContact CE1-CB 3.81Å; F453-L504 HydrophobicContact CB-CD1 3.99Å; F453-L504 HydrophobicContact CD1-CB 4.22Å; F453-L504 HydrophobicContact CD1-CD1 4.41Å; F453-E507 HydrophobicContact CD1-CG 4.28Å; F453-E507 HydrophobicContact CE1-CG 3.87Å; F453-E507 HydrophobicContact CE2-CG 4.46Å; F453-E507 HydrophobicContact CZ-CG 4Å; F453-L570 HydrophobicContact CB-CD1 4.49Å; F453-L570 HydrophobicContact CB-CD2 4.04Å; F453-L570 HydrophobicContact CD2-CD1 4.04Å; F453-L570 HydrophobicContact CD2-CD2 4.41Å; F453-L570 HydrophobicContact CG-CD2 4.21Å
454K89.6Confident91.8Very high65 Ų6552.6 Ų52.628%0.28326%0.264SS..Hα-helixtrans-62.4-51.3-176.2176.8170.3176.2156.90112.4K452 I456 T457 C458 V564 I566 E568K452-K454 PolarHBondContact O-N 3.29Å; K454-I456 PolarHBondContact O-N 3.07Å; K454-T457 PolarHBondContact O-N 2.99Å; K454-C458 PolarHBondContact O-N 3.32Å; K454-C458 PolarHBondContact O-SG 3.32Å; K454-V564 PolarHBondContact NZ-O 3.23Å; K454-I566 WeakPolarHBondContact CD-O 3.12Å; K454-I566 WeakPolarHBondContact CE-O 3.34Å; K454-I566 PolarHBondContact NZ-O 2.94Å; K454-E568 HydrophobicContact CB-CB 4.06Å; K454-E568 VanDerWaalsContact CB-CD 3.47Å; K454-E568 HydrophobicContact CB-CG 4.02Å; K454-E568 WeakPolarHBondContact CB-OE1 3.46Å; K454-E568 HydrophobicContact CD-CB 3.97Å; K454-E568 PolarHBondContact N-OE1 3Å
455I92.4Very high92.4Very high86 Ų8653.5 Ų53.544%0.44127%0.267SS..Hα-helixtrans-62.8-46.1-174-67.4169.4000110.8K452 C458 I459K452-I455 HydrophobicContact CB-CB 4.42Å; K452-I455 HydrophobicContact CD-CD1 4.21Å; I455-C458 PolarHBondContact O-N 3.34Å; I455-I459 HydrophobicContact CG2-CD1 3.75Å; I455-I459 HydrophobicContact CG2-CG1 4.42Å; I455-I459 WeakPolarHBondContact O-CG1 3.43Å; I455-I459 PolarHBondContact O-N 3.47Å
456I93.5Very high92.8Very high17 Ų1754 Ų549%0.08727%0.266CS..Hα-helixtrans-65.4-43.8-179.3-68.2172.7000110.6I446 L447 T450 K452 K454 C458 I459 I460 I500I446-I456 HydrophobicContact CG2-CD1 3.83Å; L447-I456 HydrophobicContact CB-CD1 4.24Å; L447-I456 HydrophobicContact CD1-CD1 4.03Å; T450-I456 WeakPolarHBondContact OG1-CD1 3.41Å; K452-I456 HydrophobicContact CB-CD1 4.48Å; K452-I456 WeakPolarHBondContact O-CB 3.3Å; K452-I456 WeakPolarHBondContact O-CG1 3.45Å; K452-I456 PolarHBondContact O-N 3.1Å; K454-I456 PolarHBondContact O-N 3.07Å; I456-C458 VanDerWaalsContact C-N 3.3Å; I456-C458 PolarHBondContact O-N 3.33Å; I456-I459 PolarHBondContact O-N 3.04Å; I456-I460 HydrophobicContact CG2-CD1 3.63Å; I456-I460 HydrophobicContact CG2-CG1 4.44Å; I456-I460 WeakPolarHBondContact O-CG1 3.4Å; I456-I460 PolarHBondContact O-N 2.8Å; I456-I500 HydrophobicContact CG2-CD1 3.63Å
457T92.8Very high93.1Very high2 Ų251.8 Ų51.81%0.01225%0.253CS..Hα-helixtrans-57.3-44.2176.3-56.10000111F453 K454 Y461 Y497 I500 L504 T563F453-T457 VanDerWaalsContact O-CB 3.24Å; F453-T457 WeakPolarHBondContact O-CB 3.34Å; F453-T457 PolarHBondContact O-N 2.84Å; F453-T457 VanDerWaalsContact O-N 3.08Å; F453-T457 PolarHBondContact O-OG1 3.31Å; K454-T457 PolarHBondContact O-N 2.99Å; T457-Y461 PolarHBondContact O-N 3.18Å; T457-Y461 VanDerWaalsContact O-N 3.12Å; T457-Y497 HydrophobicContact CG2-CD2 4.1Å; T457-Y497 HydrophobicContact CG2-CE2 3.34Å; T457-I500 HydrophobicContact CG2-CG2 4.48Å; T457-I500 WeakPolarHBondContact OG1-CG2 3.29Å; T457-L504 HydrophobicContact CG2-CD2 4.01Å; T457-T563 HydrophobicContact CG2-CG2 3.71Å
458C95.5Very high93.6Very high17 Ų1751.8 Ų51.812%0.11525%0.253CS..Hα-helixtrans-64.9-47.1177.1-66.30000112.5K454 I455 I456 I460 Y461 I462K454-C458 PolarHBondContact O-N 3.32Å; K454-C458 PolarHBondContact O-SG 3.32Å; I455-C458 PolarHBondContact O-N 3.34Å; I456-C458 VanDerWaalsContact C-N 3.3Å; I456-C458 PolarHBondContact O-N 3.33Å; C458-I460 VanDerWaalsContact C-N 3.32Å; C458-I460 PolarHBondContact O-N 2.93Å; C458-Y461 PolarHBondContact O-N 3.3Å; C458-I462 WeakPolarHBondContact O-CB 3.31Å; C458-I462 VanDerWaalsContact O-CG1 3.28Å; C458-I462 WeakPolarHBondContact O-CG1 3.24Å; C458-I462 PolarHBondContact O-N 3.15Å
459I96.2Very high94.2Very high87 Ų8749.1 Ų49.145%0.44625%0.246SC..Hα-helixtrans-57.8-47.1-179.8-71.7168.4000110.4I455 I456 Y461 I462 L463I455-I459 HydrophobicContact CG2-CD1 3.75Å; I455-I459 HydrophobicContact CG2-CG1 4.42Å; I455-I459 WeakPolarHBondContact O-CG1 3.43Å; I455-I459 PolarHBondContact O-N 3.47Å; I456-I459 PolarHBondContact O-N 3.04Å; I459-Y461 PolarHBondContact O-N 3.2Å; I459-I462 PolarHBondContact O-N 3.04Å; I459-L463 HydrophobicContact CG2-CD1 3.71Å; I459-L463 HydrophobicContact CG2-CG 4.42Å; I459-L463 WeakPolarHBondContact O-CB 3.26Å; I459-L463 VanDerWaalsContact O-CG 3.27Å; I459-L463 WeakPolarHBondContact O-CG 3.35Å; I459-L463 PolarHBondContact O-N 3.44Å
460I95.9Very high94.6Very high7 Ų744.1 Ų44.14%0.03623%0.227CC..Hα-helixtrans-66.9-38.9-177.8-68.1168.2000111.3T443 I456 C458 L463 S464 F493 Y497 I500T443-I460 HydrophobicContact CG2-CD1 3.43Å; T443-I460 VanDerWaalsContact CG2-CD1 3.43Å; T443-I460 HydrophobicContact CG2-CG1 4.21Å; I456-I460 HydrophobicContact CG2-CD1 3.63Å; I456-I460 HydrophobicContact CG2-CG1 4.44Å; I456-I460 WeakPolarHBondContact O-CG1 3.4Å; I456-I460 PolarHBondContact O-N 2.8Å; C458-I460 VanDerWaalsContact C-N 3.32Å; C458-I460 PolarHBondContact O-N 2.93Å; I460-L463 PolarHBondContact O-N 3.28Å; I460-S464 WeakPolarHBondContact O-CB 3.36Å; I460-S464 PolarHBondContact O-N 3.02Å; I460-S464 PolarHBondContact O-OG 2.81Å; I460-F493 HydrophobicContact CG2-CB 4.32Å; I460-F493 WeakPolarHBondContact CG2-O 3.44Å; I460-Y497 HydrophobicContact CG2-CD2 4.48Å; I460-I500 HydrophobicContact CD1-CD1 3.18Å
461Y96.8Very high94.8Very high0 Ų041.1 Ų41.10%021%0.209CC..Hα-helixtrans-65.3-46.4176-145.6-53.2000111.4S396 L400 T457 C458 I459 L463 S464 L465 Y497 T556 G559 T560 T563S396-Y461 WeakPolarHBondContact O-CE2 3.18Å; S396-Y461 PolarHBondContact O-OH 3.46Å; L400-Y461 HydrophobicContact CB-CE1 4.26Å; L400-Y461 HydrophobicContact CB-CE2 3.91Å; L400-Y461 WeakPolarHBondContact CB-OH 3.39Å; L400-Y461 HydrophobicContact CD1-CD1 4.17Å; L400-Y461 HydrophobicContact CD1-CE1 3.75Å; L400-Y461 HydrophobicContact CD2-CD2 4.28Å; L400-Y461 HydrophobicContact CD2-CE2 4.17Å; L400-Y461 HydrophobicContact CD2-CG 4.47Å; L400-Y461 HydrophobicContact CG-CE1 4.4Å; L400-Y461 HydrophobicContact CG-CE2 4.48Å; L400-Y461 PolarHBondContact N-OH 2.97Å; T457-Y461 PolarHBondContact O-N 3.18Å; T457-Y461 VanDerWaalsContact O-N 3.12Å; C458-Y461 PolarHBondContact O-N 3.3Å; I459-Y461 PolarHBondContact O-N 3.2Å; Y461-L463 VanDerWaalsContact C-N 3.32Å; Y461-L463 PolarHBondContact O-N 3.38Å; Y461-S464 WeakPolarHBondContact O-CA 3.48Å; Y461-S464 WeakPolarHBondContact O-CB 3.47Å; Y461-S464 PolarHBondContact O-N 3.49Å; Y461-S464 VanDerWaalsContact O-N 3.1Å; Y461-L465 PolarHBondContact O-N 3.15Å; Y461-Y497 AromaticContact CD2-CD2 3.86Å; Y461-Y497 HydrophobicContact CD2-CD2 3.86Å; Y461-Y497 HydrophobicContact CD2-CE1 4.3Å; Y461-Y497 AromaticContact CD2-CE2 3.24Å; Y461-Y497 HydrophobicContact CD2-CE2 3.24Å; Y461-Y497 AromaticContact CD2-CZ 3.49Å; Y461-Y497 VanDerWaalsContact CD2-CZ 3.49Å; Y461-Y497 HydrophobicContact CE2-CE1 4.16Å; Y461-Y497 AromaticContact CE2-CE2 3.9Å; Y461-Y497 HydrophobicContact CE2-CE2 3.9Å; Y461-Y497 AromaticContact CE2-CZ 3.64Å; Y461-Y497 HydrophobicContact CG-CD2 4.44Å; Y461-Y497 HydrophobicContact CG-CE2 4.15Å; Y461-T556 HydrophobicContact CD1-CG2 4.31Å; Y461-T556 HydrophobicContact CE1-CG2 3.82Å; Y461-T556 WeakPolarHBondContact CE1-O 3.24Å; Y461-G559 VanDerWaalsContact OH-CA 3.31Å; Y461-G559 WeakPolarHBondContact OH-CA 3.36Å; Y461-T560 WeakPolarHBondContact CD1-OG1 3.47Å; Y461-T563 HydrophobicContact CD2-CG2 4.06Å; Y461-T563 WeakPolarHBondContact CD2-OG1 3.4Å; Y461-T563 VanDerWaalsContact CE2-OG1 3.25Å; Y461-T563 WeakPolarHBondContact CE2-OG1 3.39Å
462I97.8Very high95.3Very high71 Ų7137 Ų3736%0.36419%0.191SC..Hα-helixtrans-59.6-43.8177.3-69.4166000110.7C458 I459 S464 L465 I466 T560C458-I462 WeakPolarHBondContact O-CB 3.31Å; C458-I462 VanDerWaalsContact O-CG1 3.28Å; C458-I462 WeakPolarHBondContact O-CG1 3.24Å; C458-I462 PolarHBondContact O-N 3.15Å; I459-I462 PolarHBondContact O-N 3.04Å; I462-S464 VanDerWaalsContact C-N 3.33Å; I462-S464 PolarHBondContact O-N 3.01Å; I462-L465 WeakPolarHBondContact O-CB 3.39Å; I462-L465 PolarHBondContact O-N 3.08Å; I462-I466 HydrophobicContact CG2-CD1 3.87Å; I462-I466 HydrophobicContact CG2-CG1 4.49Å; I462-I466 VanDerWaalsContact O-CG1 3.31Å; I462-I466 WeakPolarHBondContact O-CG1 3.21Å; I462-I466 PolarHBondContact O-N 3.29Å; I462-T560 HydrophobicContact CG1-CG2 3.61Å
463L97.8Very high95.5Very high49 Ų4933.4 Ų33.426%0.25719%0.188SC..Hα-helixtrans-64.8-38.4175.9-70169.8000111.5I459 I460 Y461 L465 I466 F467 F493I459-L463 HydrophobicContact CG2-CD1 3.71Å; I459-L463 HydrophobicContact CG2-CG 4.42Å; I459-L463 WeakPolarHBondContact O-CB 3.26Å; I459-L463 VanDerWaalsContact O-CG 3.27Å; I459-L463 WeakPolarHBondContact O-CG 3.35Å; I459-L463 PolarHBondContact O-N 3.44Å; I460-L463 PolarHBondContact O-N 3.28Å; Y461-L463 VanDerWaalsContact C-N 3.32Å; Y461-L463 PolarHBondContact O-N 3.38Å; L463-L465 VanDerWaalsContact C-N 3.34Å; L463-L465 PolarHBondContact O-N 2.89Å; L463-I466 HydrophobicContact CD2-CD1 4.43Å; L463-I466 PolarHBondContact O-N 3.43Å; L463-F467 VanDerWaalsContact O-CD2 3.31Å; L463-F467 WeakPolarHBondContact O-CD2 3.49Å; L463-F467 PolarHBondContact O-N 2.94Å; L463-F493 HydrophobicContact CB-CB 4.37Å; L463-F493 HydrophobicContact CB-CD1 3.85Å; L463-F493 HydrophobicContact CB-CD2 3.84Å; L463-F493 HydrophobicContact CB-CE1 4.09Å; L463-F493 HydrophobicContact CB-CE2 4.09Å; L463-F493 HydrophobicContact CB-CG 3.74Å; L463-F493 HydrophobicContact CB-CZ 4.21Å; L463-F493 HydrophobicContact CD1-CD1 3.88Å; L463-F493 HydrophobicContact CD1-CE1 3.38Å; L463-F493 HydrophobicContact CD1-CE2 4.36Å; L463-F493 HydrophobicContact CD1-CZ 3.67Å; L463-F493 HydrophobicContact CG-CE1 4.32Å; L463-F493 HydrophobicContact CG-CZ 4.4Å
464S97.6Very high95.8Very high0 Ų034.4 Ų34.40%019%0.193CC..Hα-helixtrans-61.3-41.8173.8-56.30000112I460 Y461 I462 M468 F493 M494I460-S464 WeakPolarHBondContact O-CB 3.36Å; I460-S464 PolarHBondContact O-N 3.02Å; I460-S464 PolarHBondContact O-OG 2.81Å; Y461-S464 WeakPolarHBondContact O-CA 3.48Å; Y461-S464 WeakPolarHBondContact O-CB 3.47Å; Y461-S464 PolarHBondContact O-N 3.49Å; Y461-S464 VanDerWaalsContact O-N 3.1Å; I462-S464 VanDerWaalsContact C-N 3.33Å; I462-S464 PolarHBondContact O-N 3.01Å; S464-M468 VanDerWaalsContact O-CB 3.32Å; S464-M468 WeakPolarHBondContact O-CB 3.21Å; S464-M468 PolarHBondContact O-N 2.83Å; S464-F493 WeakPolarHBondContact OG-CB 3.37Å; S464-M494 PolarHBondContact OG-N 3.17Å
465L97.9Very high95.9Very high30 Ų3031.3 Ų31.316%0.15718%0.18CC..Hα-helixtrans-61-48.2173.5172.863.1000111.8Y461 I462 L463 F467 M468 G469 T553 T556 L557Y461-L465 PolarHBondContact O-N 3.15Å; I462-L465 WeakPolarHBondContact O-CB 3.39Å; I462-L465 PolarHBondContact O-N 3.08Å; L463-L465 VanDerWaalsContact C-N 3.34Å; L463-L465 PolarHBondContact O-N 2.89Å; L465-F467 PolarHBondContact O-N 3.18Å; L465-M468 PolarHBondContact O-N 3.29Å; L465-G469 PolarHBondContact O-N 2.87Å; L465-T553 HydrophobicContact CD1-CG2 4.03Å; L465-T553 WeakPolarHBondContact CD1-O 3.49Å; L465-T556 HydrophobicContact CB-CG2 3.89Å; L465-T556 HydrophobicContact CD1-CG2 4.03Å; L465-L557 HydrophobicContact CD1-CB 4.1Å; L465-L557 HydrophobicContact CD2-CB 4.27Å; L465-L557 HydrophobicContact CD2-CD1 3.82Å
466I98.1Very high95.9Very high81 Ų8133 Ų3342%0.41518%0.182SC..Hα-helixtrans-59.2-49.7179.5-70.4165.8000110.1I462 L463 M468 G469 I470I462-I466 HydrophobicContact CG2-CD1 3.87Å; I462-I466 HydrophobicContact CG2-CG1 4.49Å; I462-I466 VanDerWaalsContact O-CG1 3.31Å; I462-I466 WeakPolarHBondContact O-CG1 3.21Å; I462-I466 PolarHBondContact O-N 3.29Å; L463-I466 HydrophobicContact CD2-CD1 4.43Å; L463-I466 PolarHBondContact O-N 3.43Å; I466-M468 VanDerWaalsContact C-N 3.32Å; I466-M468 PolarHBondContact O-N 2.97Å; I466-G469 PolarHBondContact O-N 3.39Å; I466-I470 HydrophobicContact CG2-CD1 3.69Å; I466-I470 HydrophobicContact CG2-CG1 4.35Å; I466-I470 VanDerWaalsContact O-CG1 3.31Å; I466-I470 WeakPolarHBondContact O-CG1 3.32Å; I466-I470 PolarHBondContact O-N 3.44Å
467F97.8Very high95.9Very high35 Ų3537.5 Ų37.515%0.15421%0.205CC..Hα-helixtrans-69.2-28-179.6-82.2-76.9000113.1L463 L465 I470 F471 V486 F489 L490 F493L463-F467 VanDerWaalsContact O-CD2 3.31Å; L463-F467 WeakPolarHBondContact O-CD2 3.49Å; L463-F467 PolarHBondContact O-N 2.94Å; L465-F467 PolarHBondContact O-N 3.18Å; F467-I470 HydrophobicContact CD1-CD1 4.32Å; F467-I470 HydrophobicContact CE1-CD1 4.4Å; F467-F471 VanDerWaalsContact O-CB 3.26Å; F467-F471 WeakPolarHBondContact O-CB 3.3Å; F467-F471 PolarHBondContact O-N 3.01Å; F467-V486 HydrophobicContact CD1-CG1 4.4Å; F467-F489 HydrophobicContact CD1-CB 3.47Å; F467-F489 VanDerWaalsContact CD1-CB 3.47Å; F467-F489 HydrophobicContact CD1-CG 4.36Å; F467-F489 HydrophobicContact CD2-CB 3.95Å; F467-F489 HydrophobicContact CE1-CB 3.25Å; F467-F489 AromaticContact CE1-CD2 3.72Å; F467-F489 HydrophobicContact CE1-CD2 3.72Å; F467-F489 AromaticContact CE1-CG 3.65Å; F467-F489 HydrophobicContact CE1-CG 3.65Å; F467-F489 HydrophobicContact CE2-CB 3.77Å; F467-F489 HydrophobicContact CE2-CG 4.21Å; F467-F489 HydrophobicContact CG-CB 3.82Å; F467-F489 HydrophobicContact CZ-CB 3.41Å; F467-F489 VanDerWaalsContact CZ-CB 3.41Å; F467-F489 HydrophobicContact CZ-CD1 4.14Å; F467-F489 AromaticContact CZ-CD2 3.89Å; F467-F489 HydrophobicContact CZ-CD2 3.89Å; F467-F489 AromaticContact CZ-CG 3.56Å; F467-F489 HydrophobicContact CZ-CG 3.56Å; F467-L490 HydrophobicContact CB-CB 4.28Å; F467-L490 HydrophobicContact CB-CD1 4.03Å; F467-F493 AromaticContact CD2-CD2 3.66Å; F467-F493 HydrophobicContact CD2-CD2 3.66Å; F467-F493 AromaticContact CD2-CE2 3.73Å; F467-F493 HydrophobicContact CD2-CE2 3.73Å; F467-F493 AromaticContact CE2-CD2 3.92Å; F467-F493 HydrophobicContact CE2-CD2 3.92Å; F467-F493 AromaticContact CE2-CE2 3.46Å; F467-F493 HydrophobicContact CE2-CE2 3.46Å; F467-F493 VanDerWaalsContact CE2-CE2 3.46Å; F467-F493 HydrophobicContact CZ-CE2 4.38Å
468M97.3Very high95.7Very high0 Ų045.9 Ų45.90%024%0.236CC..Hα-helixtrans-67.9-41171.2-173.660.7-161.600111.9V403 V407 S464 L465 I466 F471 T472 L490 M494 L552V403-M468 HydrophobicContact CG1-SD 4.24Å; V407-M468 HydrophobicContact CG2-CE 3.95Å; V407-M468 HydrophobicContact CG2-SD 3.92Å; S464-M468 VanDerWaalsContact O-CB 3.32Å; S464-M468 WeakPolarHBondContact O-CB 3.21Å; S464-M468 PolarHBondContact O-N 2.83Å; L465-M468 PolarHBondContact O-N 3.29Å; I466-M468 VanDerWaalsContact C-N 3.32Å; I466-M468 PolarHBondContact O-N 2.97Å; M468-F471 HydrophobicContact CE-CD1 4.35Å; M468-F471 PolarHBondContact O-N 3.17Å; M468-F471 HydrophobicContact SD-CD1 4.3Å; M468-T472 PolarHBondContact O-N 3.49Å; M468-T472 PolarHBondContact O-OG1 3.31Å; M468-L490 HydrophobicContact CB-CD1 4.12Å; M468-L490 HydrophobicContact SD-CD1 4.49Å; M468-L490 HydrophobicContact SD-CD2 4.49Å; M468-M494 HydrophobicContact CB-CE 4.35Å; M468-M494 HydrophobicContact SD-CE 4.41Å; M468-L552 HydrophobicContact CE-CB 3.67Å; M468-L552 HydrophobicContact CE-CD1 4.04Å
469G97.2Very high95.5Very high31 Ų3146.8 Ų46.832%0.3224%0.243SC..Hα-helixtrans-64.2-45172.600000112.4L465 I466 F471 T472 G473L465-G469 PolarHBondContact O-N 2.87Å; I466-G469 PolarHBondContact O-N 3.39Å; G469-F471 PolarHBondContact O-N 2.93Å; G469-T472 WeakPolarHBondContact O-CB 3.32Å; G469-T472 PolarHBondContact O-N 2.86Å; G469-G473 PolarHBondContact O-N 3.24Å
470I97.2Very high95.2Very high69 Ų6943.4 Ų43.435%0.35423%0.226SC..Hα-helixtrans-61.6-43.6175.1-66.9169.2000110.5I466 F467 T472 G473 I474 V486I466-I470 HydrophobicContact CG2-CD1 3.69Å; I466-I470 HydrophobicContact CG2-CG1 4.35Å; I466-I470 VanDerWaalsContact O-CG1 3.31Å; I466-I470 WeakPolarHBondContact O-CG1 3.32Å; I466-I470 PolarHBondContact O-N 3.44Å; F467-I470 HydrophobicContact CD1-CD1 4.32Å; F467-I470 HydrophobicContact CE1-CD1 4.4Å; I470-T472 VanDerWaalsContact C-N 3.27Å; I470-T472 PolarHBondContact O-N 3.3Å; I470-G473 PolarHBondContact O-N 3.5Å; I470-I474 VanDerWaalsContact O-CB 3.29Å; I470-I474 WeakPolarHBondContact O-CB 3.4Å; I470-I474 PolarHBondContact O-N 3.5Å; I470-V486 HydrophobicContact CG2-CG1 4.1Å; I470-V486 HydrophobicContact CG2-CG2 3.67Å
471F96.8Very high95Very high0 Ų047.2 Ų47.20%025%0.251CS..Hα-helixtrans-56.6-43.7175.2175.7-113.5000111.3L411 I414 F467 M468 G469 G473 L475 V483 V486 M487 L490L411-F471 HydrophobicContact CD1-CZ 4.39Å; I414-F471 HydrophobicContact CG2-CE1 4.15Å; I414-F471 HydrophobicContact CG2-CZ 3.85Å; F467-F471 VanDerWaalsContact O-CB 3.26Å; F467-F471 WeakPolarHBondContact O-CB 3.3Å; F467-F471 PolarHBondContact O-N 3.01Å; M468-F471 HydrophobicContact CE-CD1 4.35Å; M468-F471 PolarHBondContact O-N 3.17Å; M468-F471 HydrophobicContact SD-CD1 4.3Å; G469-F471 PolarHBondContact O-N 2.93Å; F471-G473 PolarHBondContact O-N 3Å; F471-L475 HydrophobicContact CE1-CD1 4.42Å; F471-L475 HydrophobicContact CE2-CD2 4.18Å; F471-L475 HydrophobicContact CZ-CD1 4.26Å; F471-L475 HydrophobicContact CZ-CD2 4.5Å; F471-L475 WeakPolarHBondContact O-CG 3.44Å; F471-V483 HydrophobicContact CE2-CG1 4.39Å; F471-V486 HydrophobicContact CB-CG1 3.72Å; F471-V486 HydrophobicContact CD2-CG1 4.36Å; F471-M487 HydrophobicContact CD2-SD 3.79Å; F471-M487 HydrophobicContact CE2-CG 4.41Å; F471-M487 HydrophobicContact CE2-SD 3.52Å; F471-M487 VanDerWaalsContact CE2-SD 3.52Å; F471-M487 HydrophobicContact CZ-SD 4.13Å; F471-L490 HydrophobicContact CB-CD2 4.44Å; F471-L490 HydrophobicContact CG-CD2 4.42Å
472T95.5Very high94.9Very high7 Ų750.1 Ų50.14%0.04327%0.266CS..Hα-helixtrans-61.4-44.5176.7-55.20000112.3M468 G469 I470 L546 N549 L550 T553M468-T472 PolarHBondContact O-N 3.49Å; M468-T472 PolarHBondContact O-OG1 3.31Å; G469-T472 WeakPolarHBondContact O-CB 3.32Å; G469-T472 PolarHBondContact O-N 2.86Å; I470-T472 VanDerWaalsContact C-N 3.27Å; I470-T472 PolarHBondContact O-N 3.3Å; T472-L546 HydrophobicContact CG2-CD1 3.86Å; T472-N549 HydrophobicContact CG2-CB 3.64Å; T472-N549 WeakPolarHBondContact OG1-CB 3.46Å; T472-L550 HydrophobicContact CG2-CD2 4.3Å; T472-T553 PolarHBondContact OG1-OG1 3.43Å
473G94.3Very high94.7Very high43 Ų4346.8 Ų46.844%0.44325%0.249SC..Hα-helixtrans-74.8-36.8-179.100000114.3G469 I470 F471 L475 Y476G469-G473 PolarHBondContact O-N 3.24Å; I470-G473 PolarHBondContact O-N 3.5Å; F471-G473 PolarHBondContact O-N 3Å; G473-L475 VanDerWaalsContact C-N 3.28Å; G473-L475 PolarHBondContact O-N 3.22Å; G473-Y476 WeakPolarHBondContact O-CD2 3.31Å; G473-Y476 PolarHBondContact O-N 3.39Å
474I93.7Very high94.6Very high26 Ų2646.9 Ų46.913%0.13325%0.247CC..Hα-helixtrans-70.6-24.3-171.8-152.874.2000113.3I470 Y476 L477 I482 V483 V486I470-I474 VanDerWaalsContact O-CB 3.29Å; I470-I474 WeakPolarHBondContact O-CB 3.4Å; I470-I474 PolarHBondContact O-N 3.5Å; I474-Y476 PolarHBondContact O-N 3.46Å; I474-L477 HydrophobicContact CD1-CD1 3.42Å; I474-L477 VanDerWaalsContact CD1-CD1 3.42Å; I474-L477 HydrophobicContact CD1-CG 4.18Å; I474-L477 HydrophobicContact CG1-CD1 4.22Å; I474-L477 WeakPolarHBondContact O-CB 3.46Å; I474-L477 PolarHBondContact O-N 3.03Å; I474-I482 HydrophobicContact CD1-CB 4.48Å; I474-I482 HydrophobicContact CD1-CG2 3.64Å; I474-I482 HydrophobicContact CG1-CB 4.08Å; I474-I482 HydrophobicContact CG1-CG2 3.56Å; I474-V483 HydrophobicContact CG2-CG2 4.22Å; I474-V486 HydrophobicContact CG1-CG2 4.5Å; I474-V486 HydrophobicContact CG2-CG2 4.18Å
475L92.9Very high94.6Very high0 Ų051.7 Ų51.70%027%0.272CS..G310 helixtrans-57.2-31.6177.2-68.5170.8000111.9I414 L415 Y418 F419 F471 G473 L477 R478 V483 V545I414-L475 HydrophobicContact CG2-CD1 3.77Å; L415-L475 HydrophobicContact CD2-CD2 3.67Å; Y418-L475 HydrophobicContact CD1-CB 4.05Å; Y418-L475 WeakPolarHBondContact CD1-O 3.05Å; Y418-L475 HydrophobicContact CD2-CB 3.88Å; Y418-L475 HydrophobicContact CD2-CD1 4.28Å; Y418-L475 HydrophobicContact CD2-CD2 4.4Å; Y418-L475 HydrophobicContact CD2-CG 4.4Å; Y418-L475 HydrophobicContact CE1-CB 3.95Å; Y418-L475 HydrophobicContact CE2-CB 3.76Å; Y418-L475 HydrophobicContact CE2-CD1 3.94Å; Y418-L475 HydrophobicContact CE2-CG 4.37Å; Y418-L475 HydrophobicContact CG-CB 4.02Å; F419-L475 HydrophobicContact CE2-CD2 4.2Å; F471-L475 HydrophobicContact CE1-CD1 4.42Å; F471-L475 HydrophobicContact CE2-CD2 4.18Å; F471-L475 HydrophobicContact CZ-CD1 4.26Å; F471-L475 HydrophobicContact CZ-CD2 4.5Å; F471-L475 WeakPolarHBondContact O-CG 3.44Å; G473-L475 VanDerWaalsContact C-N 3.28Å; G473-L475 PolarHBondContact O-N 3.22Å; L475-L477 VanDerWaalsContact C-N 3.26Å; L475-L477 PolarHBondContact O-N 2.79Å; L475-R478 PolarHBondContact O-N 3.1Å; L475-R478 VanDerWaalsContact O-N 3.1Å; L475-V483 HydrophobicContact CD2-CG2 4.24Å; L475-V545 HydrophobicContact CD1-CG1 4.31Å
476Y92.2Very high94.5Very high122 Ų12250.6 Ų50.648%0.47827%0.266SS..G310 helixtrans-66.7-24176.8-72-85.2000114.2Y418 G473 I474 R478 L546Y418-Y476 HydrophobicContact CE1-CD1 4.22Å; Y418-Y476 HydrophobicContact CE1-CE1 4.33Å; Y418-Y476 HydrophobicContact CE1-CG 4.36Å; G473-Y476 WeakPolarHBondContact O-CD2 3.31Å; G473-Y476 PolarHBondContact O-N 3.39Å; I474-Y476 PolarHBondContact O-N 3.46Å; Y476-R478 PolarHBondContact O-N 2.93Å; Y476-L546 HydrophobicContact CE2-CD1 4.22Å; Y476-L546 VanDerWaalsContact OH-CB 3.29Å; Y476-L546 WeakPolarHBondContact OH-CB 3.38Å; Y476-L546 WeakPolarHBondContact OH-CD2 3.35Å
477L91.9Very high94.4Very high111 Ų11146.7 Ų46.758%0.58125%0.246SC*.G310 helixtrans-73.6-10.9175.2-59.5-171.2000112.6I474 L475 S479 I482I474-L477 HydrophobicContact CD1-CD1 3.42Å; I474-L477 VanDerWaalsContact CD1-CD1 3.42Å; I474-L477 HydrophobicContact CD1-CG 4.18Å; I474-L477 HydrophobicContact CG1-CD1 4.22Å; I474-L477 WeakPolarHBondContact O-CB 3.46Å; I474-L477 PolarHBondContact O-N 3.03Å; L475-L477 VanDerWaalsContact C-N 3.26Å; L475-L477 PolarHBondContact O-N 2.79Å; L477-S479 PolarHBondContact O-N 3.13Å; L477-S479 VanDerWaalsContact O-N 3.07Å; L477-I482 HydrophobicContact CD1-CD1 4.24Å
478R88.6Confident94.4Very high177 Ų17748.8 Ų48.867%0.66826%0.255SS*.THydrogen-bonded Turntrans47.838.7-179.3-63.4-174.9172.7-175.1-4113F419 L475 Y476F419-R478 HydrophobicContact CE1-CB 4.32Å; F419-R478 WeakPolarHBondContact CE1-O 3.35Å; L475-R478 PolarHBondContact O-N 3.1Å; L475-R478 VanDerWaalsContact O-N 3.1Å; Y476-R478 PolarHBondContact O-N 2.93Å
479S91.9Very high94.4Very high37 Ų3752.4 Ų52.426%0.25927%0.272SS..  trans-118.3102.6178.8-173.80000111L477 I482 V483L477-S479 PolarHBondContact O-N 3.13Å; L477-S479 VanDerWaalsContact O-N 3.07Å; S479-I482 PolarHBondContact O-N 3.44Å; S479-V483 PolarHBondContact O-N 2.88Å
480M89.6Confident94.4Very high15 Ų1551 Ų517%0.07426%0.256CS..Hα-helixtrans-58.6-40179.4-80.7-61.1-160.200114.7L415 F419 L424 I482 V483 F484L415-M480 HydrophobicContact CB-CE 4.4Å; L415-M480 HydrophobicContact CD1-CE 4.42Å; L415-M480 HydrophobicContact CD2-CE 4.44Å; F419-M480 HydrophobicContact CB-CE 3.42Å; F419-M480 VanDerWaalsContact CB-CE 3.42Å; F419-M480 HydrophobicContact CD1-CE 3.75Å; F419-M480 HydrophobicContact CD1-CG 3.61Å; F419-M480 HydrophobicContact CD1-SD 4.02Å; F419-M480 HydrophobicContact CD2-CE 3.21Å; F419-M480 HydrophobicContact CD2-CG 4.46Å; F419-M480 HydrophobicContact CD2-SD 3.78Å; F419-M480 HydrophobicContact CE1-CB 4.39Å; F419-M480 HydrophobicContact CE1-CE 4.24Å; F419-M480 HydrophobicContact CE1-CG 3.5Å; F419-M480 HydrophobicContact CE1-SD 3.92Å; F419-M480 HydrophobicContact CE2-CE 3.8Å; F419-M480 HydrophobicContact CE2-CG 4.4Å; F419-M480 HydrophobicContact CE2-SD 3.69Å; F419-M480 HydrophobicContact CG-CE 3.17Å; F419-M480 HydrophobicContact CG-CG 4.09Å; F419-M480 HydrophobicContact CG-SD 3.94Å; F419-M480 HydrophobicContact CZ-CE 4.27Å; F419-M480 HydrophobicContact CZ-CG 3.93Å; F419-M480 HydrophobicContact CZ-SD 3.75Å; L424-M480 HydrophobicContact CB-CE 3.75Å; L424-M480 HydrophobicContact CB-CG 4.46Å; L424-M480 HydrophobicContact CB-SD 4.35Å; L424-M480 HydrophobicContact CD1-CB 4.28Å; L424-M480 HydrophobicContact CD1-CE 4.29Å; L424-M480 HydrophobicContact CD1-CG 3.72Å; M480-I482 PolarHBondContact O-N 2.98Å; M480-V483 WeakPolarHBondContact O-CB 3.32Å; M480-V483 PolarHBondContact O-N 2.88Å; M480-V483 HydrophobicContact SD-CB 4.31Å; M480-V483 HydrophobicContact SD-CG1 4.49Å; M480-V483 HydrophobicContact SD-CG2 4.45Å; M480-F484 HydrophobicContact CB-CE2 4.27Å; M480-F484 WeakPolarHBondContact O-CD2 3.34Å; M480-F484 PolarHBondContact O-N 2.89Å
481P92.6Very high94.4Very high88 Ų8847.7 Ų47.757%0.57124%0.239SC*.Hα-helixtrans-53-40175.3-29.937.4000113.5F484 I485P481-F484 PolarHBondContact O-N 3.14Å; P481-I485 PolarHBondContact O-N 3.22Å
482I93.8Very high94.4Very high61 Ų6149.2 Ų49.231%0.31325%0.246SC..Hα-helixtrans-74.8-36.2179.8-48.1173.3000110.6I474 L477 S479 M480 F484 I485 V486I474-I482 HydrophobicContact CD1-CB 4.48Å; I474-I482 HydrophobicContact CD1-CG2 3.64Å; I474-I482 HydrophobicContact CG1-CB 4.08Å; I474-I482 HydrophobicContact CG1-CG2 3.56Å; L477-I482 HydrophobicContact CD1-CD1 4.24Å; S479-I482 PolarHBondContact O-N 3.44Å; M480-I482 PolarHBondContact O-N 2.98Å; I482-F484 VanDerWaalsContact C-N 3.28Å; I482-F484 PolarHBondContact O-N 3.37Å; I482-I485 PolarHBondContact O-N 2.73Å; I482-V486 WeakPolarHBondContact O-CG2 3.45Å; I482-V486 PolarHBondContact O-N 3.04Å
483V94.6Very high94.5Very high1 Ų150.2 Ų50.21%0.00625%0.25CS..Hα-helixtrans-56.5-43.1172.4175.40000110.7L415 F419 F471 I474 L475 S479 M480 I485 V486 M487L415-V483 HydrophobicContact CD2-CG1 4.04Å; F419-V483 HydrophobicContact CE2-CG2 4.16Å; F419-V483 HydrophobicContact CZ-CG2 4.04Å; F471-V483 HydrophobicContact CE2-CG1 4.39Å; I474-V483 HydrophobicContact CG2-CG2 4.22Å; L475-V483 HydrophobicContact CD2-CG2 4.24Å; S479-V483 PolarHBondContact O-N 2.88Å; M480-V483 WeakPolarHBondContact O-CB 3.32Å; M480-V483 PolarHBondContact O-N 2.88Å; M480-V483 HydrophobicContact SD-CB 4.31Å; M480-V483 HydrophobicContact SD-CG1 4.49Å; M480-V483 HydrophobicContact SD-CG2 4.45Å; V483-I485 PolarHBondContact O-N 3.19Å; V483-V486 PolarHBondContact O-N 3.13Å; V483-M487 HydrophobicContact CG1-CG 3.99Å; V483-M487 WeakPolarHBondContact O-CB 3.39Å; V483-M487 WeakPolarHBondContact O-CG 3.43Å; V483-M487 PolarHBondContact O-N 3.34Å
484F95.4Very high94.6Very high51 Ų5148.2 Ų48.222%0.22423%0.229CC..Hα-helixtrans-59.3-43.1176.5-72.1-65.4000113.1L424 W427 A428 M480 P481 I482 V486 M487 F488L424-F484 HydrophobicContact CD2-CZ 4.3Å; W427-F484 HydrophobicContact CB-CE1 3.57Å; W427-F484 HydrophobicContact CB-CZ 3.87Å; A428-F484 HydrophobicContact CB-CD1 4.34Å; A428-F484 HydrophobicContact CB-CE1 4.07Å; M480-F484 HydrophobicContact CB-CE2 4.27Å; M480-F484 WeakPolarHBondContact O-CD2 3.34Å; M480-F484 PolarHBondContact O-N 2.89Å; P481-F484 PolarHBondContact O-N 3.14Å; I482-F484 VanDerWaalsContact C-N 3.28Å; I482-F484 PolarHBondContact O-N 3.37Å; F484-V486 VanDerWaalsContact C-N 3.34Å; F484-V486 PolarHBondContact O-N 3.4Å; F484-M487 PolarHBondContact O-N 3.48Å; F484-F488 WeakPolarHBondContact O-CB 3.34Å; F484-F488 PolarHBondContact O-N 3.26Å
485I96.8Very high94.5Very high100 Ų10047.1 Ų47.151%0.51322%0.224SC..Hα-helixtrans-62.3-44.4177.7-63.3170000110.2P481 I482 V483 F488 F489P481-I485 PolarHBondContact O-N 3.22Å; I482-I485 PolarHBondContact O-N 2.73Å; V483-I485 PolarHBondContact O-N 3.19Å; I485-F488 WeakPolarHBondContact O-CB 3.43Å; I485-F488 PolarHBondContact O-N 3.1Å; I485-F489 HydrophobicContact CG2-CD2 4.06Å; I485-F489 HydrophobicContact CG2-CE2 3.88Å; I485-F489 VanDerWaalsContact O-CD2 3.25Å; I485-F489 WeakPolarHBondContact O-CD2 3.38Å; I485-F489 PolarHBondContact O-N 3.04Å
486V96.9Very high94.4Very high7 Ų747.1 Ų47.14%0.04222%0.224CC..Hα-helixtrans-67.1-42.3179.51760000111.3F467 I470 F471 I474 I482 V483 F484 F488 F489 L490F467-V486 HydrophobicContact CD1-CG1 4.4Å; I470-V486 HydrophobicContact CG2-CG1 4.1Å; I470-V486 HydrophobicContact CG2-CG2 3.67Å; F471-V486 HydrophobicContact CB-CG1 3.72Å; F471-V486 HydrophobicContact CD2-CG1 4.36Å; I474-V486 HydrophobicContact CG1-CG2 4.5Å; I474-V486 HydrophobicContact CG2-CG2 4.18Å; I482-V486 WeakPolarHBondContact O-CG2 3.45Å; I482-V486 PolarHBondContact O-N 3.04Å; V483-V486 PolarHBondContact O-N 3.13Å; F484-V486 VanDerWaalsContact C-N 3.34Å; F484-V486 PolarHBondContact O-N 3.4Å; V486-F488 VanDerWaalsContact C-N 3.3Å; V486-F488 PolarHBondContact O-N 2.71Å; V486-F489 PolarHBondContact O-N 2.98Å; V486-L490 VanDerWaalsContact O-CB 3.25Å; V486-L490 WeakPolarHBondContact O-CB 3.05Å; V486-L490 PolarHBondContact O-N 3.26Å
487M96.2Very high94.4Very high0 Ų041.3 Ų41.30%020%0.201CC..Hα-helixtrans-63.3-35.4176.5-69.6-62.5-73.400112.2V407 L411 A428 M432 F471 V483 F484 L490 G491V407-M487 HydrophobicContact CG1-CE 4.35Å; L411-M487 HydrophobicContact CD1-CE 3.61Å; L411-M487 HydrophobicContact CD1-SD 4.39Å; L411-M487 HydrophobicContact CD2-CE 3.95Å; L411-M487 HydrophobicContact CG-CE 4.46Å; A428-M487 HydrophobicContact CB-CG 4.33Å; M432-M487 WeakPolarHBondContact CA-O 3.25Å; M432-M487 HydrophobicContact CB-CB 4.41Å; M432-M487 HydrophobicContact CB-CE 3.94Å; M432-M487 HydrophobicContact CG-CE 4.19Å; M432-M487 HydrophobicContact SD-CE 3.58Å; M432-M487 VanDerWaalsContact SD-CE 3.58Å; F471-M487 HydrophobicContact CD2-SD 3.79Å; F471-M487 HydrophobicContact CE2-CG 4.41Å; F471-M487 HydrophobicContact CE2-SD 3.52Å; F471-M487 VanDerWaalsContact CE2-SD 3.52Å; F471-M487 HydrophobicContact CZ-SD 4.13Å; V483-M487 HydrophobicContact CG1-CG 3.99Å; V483-M487 WeakPolarHBondContact O-CB 3.39Å; V483-M487 WeakPolarHBondContact O-CG 3.43Å; V483-M487 PolarHBondContact O-N 3.34Å; F484-M487 PolarHBondContact O-N 3.48Å; M487-L490 HydrophobicContact SD-CD2 4.22Å; M487-G491 PolarHBondContact O-N 3.32Å
488F97.7Very high94.2Very high78 Ų7837 Ų3734%0.34218%0.179SC..Hα-helixtrans-58-55.7172.6179-84.4000110.8T431 A435 F484 I485 V486 G491 F492T431-F488 HydrophobicContact CG2-CB 3.93Å; T431-F488 HydrophobicContact CG2-CD2 4.35Å; A435-F488 HydrophobicContact CB-CB 4.22Å; A435-F488 HydrophobicContact CB-CD1 4.26Å; A435-F488 HydrophobicContact CB-CD2 3.41Å; A435-F488 VanDerWaalsContact CB-CD2 3.41Å; A435-F488 HydrophobicContact CB-CE1 4.48Å; A435-F488 HydrophobicContact CB-CE2 3.69Å; A435-F488 HydrophobicContact CB-CG 3.71Å; A435-F488 HydrophobicContact CB-CZ 4.22Å; A435-F488 WeakPolarHBondContact CB-O 3.2Å; F484-F488 WeakPolarHBondContact O-CB 3.34Å; F484-F488 PolarHBondContact O-N 3.26Å; I485-F488 WeakPolarHBondContact O-CB 3.43Å; I485-F488 PolarHBondContact O-N 3.1Å; V486-F488 VanDerWaalsContact C-N 3.3Å; V486-F488 PolarHBondContact O-N 2.71Å; F488-G491 PolarHBondContact O-N 3.3Å; F488-F492 WeakPolarHBondContact O-CB 3.18Å; F488-F492 PolarHBondContact O-N 2.92Å
489F98Very high94Very high77 Ų7730.2 Ų30.234%0.33816%0.158SC..Hα-helixtrans-69.3-37.8-178-73.5-68000112.9F467 I485 V486 G491 F492 F493F467-F489 HydrophobicContact CD1-CB 3.47Å; F467-F489 VanDerWaalsContact CD1-CB 3.47Å; F467-F489 HydrophobicContact CD1-CG 4.36Å; F467-F489 HydrophobicContact CD2-CB 3.95Å; F467-F489 HydrophobicContact CE1-CB 3.25Å; F467-F489 AromaticContact CE1-CD2 3.72Å; F467-F489 HydrophobicContact CE1-CD2 3.72Å; F467-F489 AromaticContact CE1-CG 3.65Å; F467-F489 HydrophobicContact CE1-CG 3.65Å; F467-F489 HydrophobicContact CE2-CB 3.77Å; F467-F489 HydrophobicContact CE2-CG 4.21Å; F467-F489 HydrophobicContact CG-CB 3.82Å; F467-F489 HydrophobicContact CZ-CB 3.41Å; F467-F489 VanDerWaalsContact CZ-CB 3.41Å; F467-F489 HydrophobicContact CZ-CD1 4.14Å; F467-F489 AromaticContact CZ-CD2 3.89Å; F467-F489 HydrophobicContact CZ-CD2 3.89Å; F467-F489 AromaticContact CZ-CG 3.56Å; F467-F489 HydrophobicContact CZ-CG 3.56Å; I485-F489 HydrophobicContact CG2-CD2 4.06Å; I485-F489 HydrophobicContact CG2-CE2 3.88Å; I485-F489 VanDerWaalsContact O-CD2 3.25Å; I485-F489 WeakPolarHBondContact O-CD2 3.38Å; I485-F489 PolarHBondContact O-N 3.04Å; V486-F489 PolarHBondContact O-N 2.98Å; F489-G491 PolarHBondContact O-N 3.49Å; F489-F492 WeakPolarHBondContact O-CB 3.49Å; F489-F492 PolarHBondContact O-N 3.29Å; F489-F493 HydrophobicContact CB-CD2 4.39Å; F489-F493 HydrophobicContact CB-CE2 4.17Å; F489-F493 AromaticContact CD1-CE2 3.99Å; F489-F493 HydrophobicContact CD1-CE2 3.99Å; F489-F493 WeakPolarHBondContact O-CD2 3.46Å; F489-F493 PolarHBondContact O-N 3.46Å
490L97Very high93.9Very high0 Ų028.4 Ų28.40%015%0.146CC..Hα-helixtrans-57.2-49.9174.1-174.266.1000110.8V407 F467 M468 F471 V486 M487 M494V407-L490 HydrophobicContact CG1-CD2 4.35Å; F467-L490 HydrophobicContact CB-CB 4.28Å; F467-L490 HydrophobicContact CB-CD1 4.03Å; M468-L490 HydrophobicContact CB-CD1 4.12Å; M468-L490 HydrophobicContact SD-CD1 4.49Å; M468-L490 HydrophobicContact SD-CD2 4.49Å; F471-L490 HydrophobicContact CB-CD2 4.44Å; F471-L490 HydrophobicContact CG-CD2 4.42Å; V486-L490 VanDerWaalsContact O-CB 3.25Å; V486-L490 WeakPolarHBondContact O-CB 3.05Å; V486-L490 PolarHBondContact O-N 3.26Å; M487-L490 HydrophobicContact SD-CD2 4.22Å; L490-M494 HydrophobicContact CD1-CE 3.54Å; L490-M494 HydrophobicContact CD1-CG 4.28Å; L490-M494 HydrophobicContact CD1-SD 3.81Å; L490-M494 HydrophobicContact CG-CE 4.31Å; L490-M494 HydrophobicContact CG-SD 3.97Å; L490-M494 WeakPolarHBondContact O-CB 2.97Å; L490-M494 WeakPolarHBondContact O-CG 3.19Å; L490-M494 PolarHBondContact O-N 2.91Å
491G96.8Very high93.9Very high0 Ų027.7 Ų27.70%014%0.142CC..Hα-helixtrans-62.3-43.617700000113.2M432 G436 M487 F488 F489 T495M432-G491 VanDerWaalsContact CG-CA 3.47Å; M432-G491 WeakPolarHBondContact O-CA 3.48Å; G436-G491 WeakPolarHBondContact CA-O 3.26Å; M487-G491 PolarHBondContact O-N 3.32Å; F488-G491 PolarHBondContact O-N 3.3Å; F489-G491 PolarHBondContact O-N 3.49Å; G491-T495 VanDerWaalsContact O-CB 3.27Å; G491-T495 WeakPolarHBondContact O-CB 3.1Å; G491-T495 PolarHBondContact O-N 2.95Å; G491-T495 PolarHBondContact O-OG1 3.5Å
492F96.9Very high93.6Very high33 Ų3325.9 Ų25.915%0.14513%0.125CC..Hα-helixtrans-55.4-52.6177.1-175.1-79.6000111.9A435 G439 I442 T443 F488 F489 G496A435-F492 HydrophobicContact CB-CB 4.4Å; G439-F492 VanDerWaalsContact CA-CD2 3.45Å; G439-F492 VanDerWaalsContact CA-CE2 3.49Å; G439-F492 WeakPolarHBondContact CA-O 3.44Å; I442-F492 HydrophobicContact CB-CZ 4.15Å; I442-F492 HydrophobicContact CD1-CE2 3.84Å; I442-F492 HydrophobicContact CD1-CZ 4.07Å; I442-F492 HydrophobicContact CG2-CZ 4.16Å; T443-F492 HydrophobicContact CG2-CE1 4.43Å; F488-F492 WeakPolarHBondContact O-CB 3.18Å; F488-F492 PolarHBondContact O-N 2.92Å; F489-F492 WeakPolarHBondContact O-CB 3.49Å; F489-F492 PolarHBondContact O-N 3.29Å; F492-G496 PolarHBondContact O-N 2.79Å
493F97Very high93.3Very high28 Ų2826 Ų2612%0.12313%0.125CC..Hα-helixtrans-76.5-43.4-176.3-65.2-61.9000112.6I460 L463 S464 F467 F489 T495 G496 Y497I460-F493 HydrophobicContact CG2-CB 4.32Å; I460-F493 WeakPolarHBondContact CG2-O 3.44Å; L463-F493 HydrophobicContact CB-CB 4.37Å; L463-F493 HydrophobicContact CB-CD1 3.85Å; L463-F493 HydrophobicContact CB-CD2 3.84Å; L463-F493 HydrophobicContact CB-CE1 4.09Å; L463-F493 HydrophobicContact CB-CE2 4.09Å; L463-F493 HydrophobicContact CB-CG 3.74Å; L463-F493 HydrophobicContact CB-CZ 4.21Å; L463-F493 HydrophobicContact CD1-CD1 3.88Å; L463-F493 HydrophobicContact CD1-CE1 3.38Å; L463-F493 HydrophobicContact CD1-CE2 4.36Å; L463-F493 HydrophobicContact CD1-CZ 3.67Å; L463-F493 HydrophobicContact CG-CE1 4.32Å; L463-F493 HydrophobicContact CG-CZ 4.4Å; S464-F493 WeakPolarHBondContact OG-CB 3.37Å; F467-F493 AromaticContact CD2-CD2 3.66Å; F467-F493 HydrophobicContact CD2-CD2 3.66Å; F467-F493 AromaticContact CD2-CE2 3.73Å; F467-F493 HydrophobicContact CD2-CE2 3.73Å; F467-F493 AromaticContact CE2-CD2 3.92Å; F467-F493 HydrophobicContact CE2-CD2 3.92Å; F467-F493 AromaticContact CE2-CE2 3.46Å; F467-F493 HydrophobicContact CE2-CE2 3.46Å; F467-F493 VanDerWaalsContact CE2-CE2 3.46Å; F467-F493 HydrophobicContact CZ-CE2 4.38Å; F489-F493 HydrophobicContact CB-CD2 4.39Å; F489-F493 HydrophobicContact CB-CE2 4.17Å; F489-F493 AromaticContact CD1-CE2 3.99Å; F489-F493 HydrophobicContact CD1-CE2 3.99Å; F489-F493 WeakPolarHBondContact O-CD2 3.46Å; F489-F493 PolarHBondContact O-N 3.46Å; F493-T495 PolarHBondContact O-N 3.39Å; F493-G496 PolarHBondContact O-N 3.43Å; F493-Y497 PolarHBondContact O-N 3.42Å
494M95.5Very high93.1Very high0 Ų026.2 Ų26.20%013%0.125CC..Hα-helixtrans-61.5-48179.2-74.5-173.8166.300111.4L400 V403 Y404 S464 M468 L490 G496 Y497 L498L400-M494 HydrophobicContact CD1-CE 4.13Å; L400-M494 HydrophobicContact CD1-CG 4.18Å; L400-M494 HydrophobicContact CG-CG 4.46Å; V403-M494 HydrophobicContact CG1-CE 3.75Å; Y404-M494 HydrophobicContact CD2-CB 3.92Å; Y404-M494 HydrophobicContact CD2-SD 3.95Å; Y404-M494 HydrophobicContact CG-CB 4.43Å; Y404-M494 HydrophobicContact CG-SD 4.46Å; S464-M494 PolarHBondContact OG-N 3.17Å; M468-M494 HydrophobicContact CB-CE 4.35Å; M468-M494 HydrophobicContact SD-CE 4.41Å; L490-M494 HydrophobicContact CD1-CE 3.54Å; L490-M494 HydrophobicContact CD1-CG 4.28Å; L490-M494 HydrophobicContact CD1-SD 3.81Å; L490-M494 HydrophobicContact CG-CE 4.31Å; L490-M494 HydrophobicContact CG-SD 3.97Å; L490-M494 WeakPolarHBondContact O-CB 2.97Å; L490-M494 WeakPolarHBondContact O-CG 3.19Å; L490-M494 PolarHBondContact O-N 2.91Å; M494-G496 VanDerWaalsContact C-N 3.35Å; M494-G496 PolarHBondContact O-N 3.46Å; M494-Y497 WeakPolarHBondContact O-CB 3.25Å; M494-Y497 PolarHBondContact O-N 3.37Å; M494-L498 WeakPolarHBondContact O-CD1 3.48Å; M494-L498 PolarHBondContact O-N 3.37Å
495T91.8Very high92.8Very high4 Ų423.8 Ų23.83%0.02512%0.115CC..Hα-helixtrans-70-33.4178.1-47.90000112.1Y404 G436 G491 F493 Y497 L498Y404-T495 PolarHBondContact OH-OG1 3.25Å; G436-T495 VanDerWaalsContact CA-OG1 3.3Å; G436-T495 WeakPolarHBondContact CA-OG1 3.4Å; G436-T495 WeakPolarHBondContact O-CB 3.26Å; G436-T495 VanDerWaalsContact O-CG2 3.3Å; G436-T495 WeakPolarHBondContact O-CG2 3.09Å; G491-T495 VanDerWaalsContact O-CB 3.27Å; G491-T495 WeakPolarHBondContact O-CB 3.1Å; G491-T495 PolarHBondContact O-N 2.95Å; G491-T495 PolarHBondContact O-OG1 3.5Å; F493-T495 PolarHBondContact O-N 3.39Å; T495-Y497 PolarHBondContact O-N 3.28Å; T495-L498 WeakPolarHBondContact O-CB 3.46Å; T495-L498 PolarHBondContact O-N 2.85Å; T495-L498 VanDerWaalsContact O-N 3.11Å
496G90.7Very high92.3Very high0 Ų019.4 Ų19.40%09%0.094CC..Hα-helixtrans-57.1-35.2172.900000113.1T443 F492 F493 M494T443-G496 WeakPolarHBondContact OG1-CA 3.04Å; T443-G496 PolarHBondContact OG1-O 3.27Å; F492-G496 PolarHBondContact O-N 2.79Å; F493-G496 PolarHBondContact O-N 3.43Å; M494-G496 VanDerWaalsContact C-N 3.35Å; M494-G496 PolarHBondContact O-N 3.46Å
497Y92.8Very high91.8Very high0 Ų020 Ų200%010%0.096CC..Hα-helixtrans-69.6-37175.2-172.3-89.5000113S396 Y397 L400 T457 I460 Y461 F493 M494 T495 S499 I500 G501 T563S396-Y497 PolarHBondContact OG-OH 2.84Å; Y397-Y497 HydrophobicContact CD2-CD1 4.09Å; Y397-Y497 AromaticContact CD2-CE1 3.73Å; Y397-Y497 HydrophobicContact CD2-CE1 3.73Å; Y397-Y497 HydrophobicContact CG-CE1 4.29Å; L400-Y497 HydrophobicContact CB-CD1 4.44Å; L400-Y497 HydrophobicContact CD2-CD1 3.43Å; L400-Y497 VanDerWaalsContact CD2-CD1 3.43Å; L400-Y497 HydrophobicContact CD2-CD2 3.94Å; L400-Y497 HydrophobicContact CD2-CE1 4.16Å; L400-Y497 HydrophobicContact CD2-CG 3.29Å; T457-Y497 HydrophobicContact CG2-CD2 4.1Å; T457-Y497 HydrophobicContact CG2-CE2 3.34Å; I460-Y497 HydrophobicContact CG2-CD2 4.48Å; Y461-Y497 AromaticContact CD2-CD2 3.86Å; Y461-Y497 HydrophobicContact CD2-CD2 3.86Å; Y461-Y497 HydrophobicContact CD2-CE1 4.3Å; Y461-Y497 AromaticContact CD2-CE2 3.24Å; Y461-Y497 HydrophobicContact CD2-CE2 3.24Å; Y461-Y497 AromaticContact CD2-CZ 3.49Å; Y461-Y497 VanDerWaalsContact CD2-CZ 3.49Å; Y461-Y497 HydrophobicContact CE2-CE1 4.16Å; Y461-Y497 AromaticContact CE2-CE2 3.9Å; Y461-Y497 HydrophobicContact CE2-CE2 3.9Å; Y461-Y497 AromaticContact CE2-CZ 3.64Å; Y461-Y497 HydrophobicContact CG-CD2 4.44Å; Y461-Y497 HydrophobicContact CG-CE2 4.15Å; F493-Y497 PolarHBondContact O-N 3.42Å; M494-Y497 WeakPolarHBondContact O-CB 3.25Å; M494-Y497 PolarHBondContact O-N 3.37Å; T495-Y497 PolarHBondContact O-N 3.28Å; Y497-S499 VanDerWaalsContact C-N 3.3Å; Y497-S499 PolarHBondContact O-N 3.02Å; Y497-I500 PolarHBondContact O-N 3.08Å; Y497-G501 PolarHBondContact O-N 3.45Å; Y497-T563 HydrophobicContact CE2-CG2 4.36Å; Y497-T563 PolarHBondContact OH-OG1 3.12Å
498L87.7Confident91.5Very high21 Ų2120 Ų2011%0.1110%0.096CC..Hα-helixtrans-56.3-45.8-179.1-87.270000111.2Y397 T401 M494 T495Y397-L498 WeakPolarHBondContact CE2-O 3.46Å; T401-L498 HydrophobicContact CG2-CD1 4.24Å; T401-L498 HydrophobicContact CG2-CD2 4.05Å; T401-L498 HydrophobicContact CG2-CG 4.21Å; M494-L498 WeakPolarHBondContact O-CD1 3.48Å; M494-L498 PolarHBondContact O-N 3.37Å; T495-L498 WeakPolarHBondContact O-CB 3.46Å; T495-L498 PolarHBondContact O-N 2.85Å; T495-L498 VanDerWaalsContact O-N 3.11Å
499S84.4Confident91Very high33 Ų3316.5 Ų16.523%0.2318%0.081CC..Hα-helixtrans-66.1-45.6179.1-59.10000112.6S440 Y497 G501 F502 E503S440-S499 VanDerWaalsContact CB-OG 3.27Å; S440-S499 WeakPolarHBondContact CB-OG 3.35Å; Y497-S499 VanDerWaalsContact C-N 3.3Å; Y497-S499 PolarHBondContact O-N 3.02Å; S499-G501 VanDerWaalsContact C-N 3.31Å; S499-G501 PolarHBondContact O-N 2.93Å; S499-F502 PolarHBondContact O-N 3.33Å; S499-E503 PolarHBondContact O-N 3.46Å
500I89.6Confident90.2Very high0 Ų016.2 Ų16.20%08%0.078CC..Hα-helixtrans-67.1-34.9-179.3-69169.3000111.5L447 I456 T457 I460 Y497 F502 E503 L504L447-I500 HydrophobicContact CD2-CB 4.27Å; L447-I500 HydrophobicContact CD2-CG1 3.79Å; L447-I500 HydrophobicContact CD2-CG2 3.96Å; I456-I500 HydrophobicContact CG2-CD1 3.63Å; T457-I500 HydrophobicContact CG2-CG2 4.48Å; T457-I500 WeakPolarHBondContact OG1-CG2 3.29Å; I460-I500 HydrophobicContact CD1-CD1 3.18Å; Y497-I500 PolarHBondContact O-N 3.08Å; I500-F502 VanDerWaalsContact C-N 3.29Å; I500-F502 PolarHBondContact O-N 3.18Å; I500-E503 PolarHBondContact O-N 3.11Å; I500-L504 WeakPolarHBondContact O-CB 3.28Å; I500-L504 PolarHBondContact O-N 3.4Å
501G90.4Very high89.4Confident0 Ų018.1 Ų18.10%09%0.091CC..Hα-helixtrans-57.6-40.7176.800000112.6Y497 S499 A505 L521Y497-G501 PolarHBondContact O-N 3.45Å; S499-G501 VanDerWaalsContact C-N 3.31Å; S499-G501 PolarHBondContact O-N 2.93Å; G501-A505 VanDerWaalsContact O-CB 3.27Å; G501-A505 WeakPolarHBondContact O-CB 3.41Å; G501-A505 PolarHBondContact O-N 3.1Å; G501-L521 VanDerWaalsContact O-CD1 3.29Å; G501-L521 WeakPolarHBondContact O-CD1 3.48Å
502F86Confident88.6Confident50 Ų5019.5 Ų19.522%0.21910%0.097CC..Hα-helixtrans-66.8-44.2175.4-65.9-27.6000112.6Y397 S499 I500 A505 A506 L521 N522Y397-F502 HydrophobicContact CE1-CE1 4.47Å; Y397-F502 HydrophobicContact CE2-CE1 4.38Å; Y397-F502 AromaticContact CZ-CE1 3.84Å; Y397-F502 WeakPolarHBondContact OH-CE1 3.17Å; Y397-F502 VanDerWaalsContact OH-CZ 3.3Å; Y397-F502 WeakPolarHBondContact OH-CZ 3.49Å; S499-F502 PolarHBondContact O-N 3.33Å; I500-F502 VanDerWaalsContact C-N 3.29Å; I500-F502 PolarHBondContact O-N 3.18Å; F502-A505 PolarHBondContact O-N 2.96Å; F502-A506 PolarHBondContact O-N 3.11Å; F502-L521 HydrophobicContact CD1-CB 4.23Å; F502-L521 HydrophobicContact CD1-CD1 3.9Å; F502-L521 HydrophobicContact CE1-CB 3.96Å; F502-L521 HydrophobicContact CE1-CD1 4.42Å; F502-N522 WeakPolarHBondContact CZ-OD1 3.46Å
503E86.1Confident87.4Confident64 Ų6421.1 Ų21.130%0.29911%0.112SC..Hα-helixtrans-66.4-43.6178.9-60.1-174.6-163.600111.7L447 F453 S499 I500 A505 A506 E507L447-E503 HydrophobicContact CD2-CB 4.33Å; L447-E503 WeakPolarHBondContact CD2-OE2 3.35Å; F453-E503 HydrophobicContact CE1-CB 3.81Å; S499-E503 PolarHBondContact O-N 3.46Å; I500-E503 PolarHBondContact O-N 3.11Å; E503-A505 VanDerWaalsContact C-N 3.33Å; E503-A505 PolarHBondContact O-N 3.4Å; E503-A506 WeakPolarHBondContact O-CB 3.32Å; E503-A506 PolarHBondContact O-N 3.34Å; E503-E507 WeakPolarHBondContact O-CG 3.39Å; E503-E507 PolarHBondContact O-N 3.34Å
504L90.4Very high86.3Confident4 Ų424.5 Ų24.52%0.02113%0.128CC..Hα-helixtrans-62.5-40175.1177.261.1000111.2L393 F453 T457 I500 A506 E507 L508 I566 L570L393-L504 HydrophobicContact CD1-CD2 3.93Å; L393-L504 HydrophobicContact CD2-CB 4.24Å; L393-L504 HydrophobicContact CD2-CD2 4.11Å; L393-L504 HydrophobicContact CD2-CG 3.92Å; F453-L504 HydrophobicContact CB-CD1 3.99Å; F453-L504 HydrophobicContact CD1-CB 4.22Å; F453-L504 HydrophobicContact CD1-CD1 4.41Å; T457-L504 HydrophobicContact CG2-CD2 4.01Å; I500-L504 WeakPolarHBondContact O-CB 3.28Å; I500-L504 PolarHBondContact O-N 3.4Å; L504-A506 VanDerWaalsContact C-N 3.35Å; L504-A506 PolarHBondContact O-N 3.05Å; L504-E507 PolarHBondContact O-N 3.02Å; L504-L508 HydrophobicContact CD1-CD1 3.94Å; L504-L508 HydrophobicContact CD1-CD2 4.28Å; L504-L508 HydrophobicContact CD1-CG 3.82Å; L504-L508 HydrophobicContact CD2-CD1 4.45Å; L504-L508 HydrophobicContact CG-CD1 3.86Å; L504-L508 HydrophobicContact CG-CG 4.17Å; L504-L508 WeakPolarHBondContact O-CB 3.37Å; L504-L508 VanDerWaalsContact O-CG 3.26Å; L504-L508 WeakPolarHBondContact O-CG 3.45Å; L504-L508 PolarHBondContact O-N 3.36Å; L504-I566 HydrophobicContact CD2-CD1 4.5Å; L504-L570 HydrophobicContact CD1-CD2 4.29Å
505A90.3Very high85.2Confident0 Ų027.2 Ų27.20%016%0.157CC..Hα-helixtrans-61.3-44.1174.600000111.6F390 L393 G501 F502 E503 E507 L508 T509 L521F390-A505 HydrophobicContact CE2-CB 4.25Å; L393-A505 HydrophobicContact CD2-CB 3.78Å; G501-A505 VanDerWaalsContact O-CB 3.27Å; G501-A505 WeakPolarHBondContact O-CB 3.41Å; G501-A505 PolarHBondContact O-N 3.1Å; F502-A505 PolarHBondContact O-N 2.96Å; E503-A505 VanDerWaalsContact C-N 3.33Å; E503-A505 PolarHBondContact O-N 3.4Å; A505-E507 VanDerWaalsContact C-N 3.27Å; A505-E507 PolarHBondContact O-N 3.05Å; A505-L508 PolarHBondContact O-N 3.3Å; A505-T509 WeakPolarHBondContact O-CB 3.43Å; A505-T509 VanDerWaalsContact O-CG2 3.3Å; A505-T509 WeakPolarHBondContact O-CG2 3.31Å; A505-T509 PolarHBondContact O-N 2.85Å; A505-T509 PolarHBondContact O-OG1 3.02Å; A505-L521 HydrophobicContact CB-CD1 3.58Å; A505-L521 HydrophobicContact CB-CG 4.29Å
506A85.2Confident84.6Confident9 Ų928.9 Ų28.97%0.07417%0.165CC..Hα-helixtrans-61-36.117700000112.6F502 E503 L504 E514F502-A506 PolarHBondContact O-N 3.11Å; E503-A506 WeakPolarHBondContact O-CB 3.32Å; E503-A506 PolarHBondContact O-N 3.34Å; L504-A506 VanDerWaalsContact C-N 3.35Å; L504-A506 PolarHBondContact O-N 3.05Å; A506-E514 HydrophobicContact CB-CG 4.11Å
507E87.4Confident84.3Confident18 Ų1828.9 Ų28.98%0.08417%0.165CC..Hα-helixtrans-70.8-43.1174.9-71.6-65.2146.700112.8F453 E503 L504 A505 L570 Y571 R572 Q573F453-E507 HydrophobicContact CD1-CG 4.28Å; F453-E507 HydrophobicContact CE1-CG 3.87Å; F453-E507 HydrophobicContact CE2-CG 4.46Å; F453-E507 HydrophobicContact CZ-CG 4Å; E503-E507 WeakPolarHBondContact O-CG 3.39Å; E503-E507 PolarHBondContact O-N 3.34Å; L504-E507 PolarHBondContact O-N 3.02Å; A505-E507 VanDerWaalsContact C-N 3.27Å; A505-E507 PolarHBondContact O-N 3.05Å; E507-L570 HydrophobicContact CB-CD2 3.9Å; E507-L570 HydrophobicContact CG-CD2 4.42Å; E507-Y571 PolarHBondContact O-N 3Å; E507-R572 WeakPolarHBondContact OE2-CB 3.29Å; E507-Q573 WeakPolarHBondContact OE2-CG 3.48Å; E507-Q573 PolarHBondContact OE2-N 3.24Å
508L88.9Confident83.8Confident1 Ų129.9 Ų29.91%0.00517%0.172CC..Hα-helixtrans-74.2-23.1-177.4-69.9178.5000113.9N387 P389 L393 L504 A505 I566 Y571N387-L508 PolarHBondContact ND2-O 2.8Å; P389-L508 HydrophobicContact CB-CD1 4.12Å; P389-L508 HydrophobicContact CB-CD2 3.99Å; L393-L508 HydrophobicContact CB-CD1 4.39Å; L393-L508 HydrophobicContact CD2-CD1 3.98Å; L504-L508 HydrophobicContact CD1-CD1 3.94Å; L504-L508 HydrophobicContact CD1-CD2 4.28Å; L504-L508 HydrophobicContact CD1-CG 3.82Å; L504-L508 HydrophobicContact CD2-CD1 4.45Å; L504-L508 HydrophobicContact CG-CD1 3.86Å; L504-L508 HydrophobicContact CG-CG 4.17Å; L504-L508 WeakPolarHBondContact O-CB 3.37Å; L504-L508 VanDerWaalsContact O-CG 3.26Å; L504-L508 WeakPolarHBondContact O-CG 3.45Å; L504-L508 PolarHBondContact O-N 3.36Å; A505-L508 PolarHBondContact O-N 3.3Å; L508-I566 HydrophobicContact CD1-CG2 3.98Å; L508-Y571 WeakPolarHBondContact O-CD2 3.37Å
509T88.2Confident83.6Confident5 Ų529.7 Ų29.73%0.03118%0.175CC..Hα-helixtrans-109.3-1-172.568.10000114.5L384 F390 A505 E512L384-T509 HydrophobicContact CD2-CG2 3.33Å; F390-T509 HydrophobicContact CB-CG2 4.05Å; F390-T509 HydrophobicContact CD2-CG2 3.22Å; F390-T509 HydrophobicContact CE2-CG2 3.75Å; F390-T509 HydrophobicContact CG-CG2 3.69Å; A505-T509 WeakPolarHBondContact O-CB 3.43Å; A505-T509 VanDerWaalsContact O-CG2 3.3Å; A505-T509 WeakPolarHBondContact O-CG2 3.31Å; A505-T509 PolarHBondContact O-N 2.85Å; A505-T509 PolarHBondContact O-OG1 3.02Å; T509-E512 WeakPolarHBondContact O-CB 3.43Å; T509-E512 VanDerWaalsContact O-CG 3.25Å; T509-E512 WeakPolarHBondContact O-CG 3.38Å; T509-E512 PolarHBondContact O-N 3.19Å
510Y81.2Confident83.8Confident71 Ų7128.8 Ų28.828%0.27817%0.168SC..THydrogen-bonded Turntrans-53.9135.2178.7-178.5-90000111.2R572 A575Y510-R572 HydrophobicContact CD2-CB 4.01Å; Y510-R572 HydrophobicContact CD2-CG 4.06Å; Y510-R572 HydrophobicContact CG-CB 3.89Å; Y510-R572 HydrophobicContact CG-CG 4.43Å; Y510-A575 HydrophobicContact CD1-CB 4.48Å; Y510-A575 HydrophobicContact CE1-CB 3.88Å
511P79.1Confident84Confident40 Ų4028.8 Ų28.826%0.2617%0.168SC..THydrogen-bonded Turncis-91.416.810.537-36.8000116.2Y363 S367Y363-P511 HydrophobicContact CD1-CG 4.06Å; Y363-P511 HydrophobicContact CE1-CG 3.73Å; S367-P511 WeakPolarHBondContact OG-CG 3.31Å
512E80.2Confident84Confident29 Ų2929.6 Ų29.614%0.13617%0.172CC..SBendtrans-60.8150.5176.2-62.1-69172.900112.1A380 R383 L384 T509 E514A380-E512 WeakPolarHBondContact CB-OE2 3.05Å; R383-E512 IonicContact CZ-OE1 3.38Å; R383-E512 IonicContact NE-OE1 3.72Å; R383-E512 PolarHBondContact NE-OE1 3.15Å; R383-E512 IonicContact NH2-OE1 3.78Å; R383-E512 PolarHBondContact NH2-OE1 3.39Å; R383-E512 IonicContact NH2-OE2 2.82Å; R383-E512 PolarHBondContact NH2-OE2 2.97Å; L384-E512 HydrophobicContact CD2-CB 4.19Å; L384-E512 HydrophobicContact CD2-CG 3.86Å; L384-E512 HydrophobicContact CG-CG 4.2Å; T509-E512 WeakPolarHBondContact O-CB 3.43Å; T509-E512 VanDerWaalsContact O-CG 3.25Å; T509-E512 WeakPolarHBondContact O-CG 3.38Å; T509-E512 PolarHBondContact O-N 3.19Å; E512-E514 PolarHBondContact O-N 3.31Å
513S73.2Confident84.4Confident66 Ų6628.1 Ų28.146%0.46217%0.167SC..  trans-65.8133.1-177.876.60000112G515 L516 S517S513-G515 PolarHBondContact O-N 3.31Å; S513-L516 WeakPolarHBondContact O-CB 3.33Å; S513-L516 PolarHBondContact O-N 3.37Å; S513-L516 VanDerWaalsContact OG-CB 3.26Å; S513-L516 WeakPolarHBondContact OG-CB 3.25Å; S513-L516 PolarHBondContact OG-N 2.86Å; S513-S517 PolarHBondContact O-N 3.34Å
514E73.6Confident84.8Confident99 Ų9925.1 Ų25.146%0.46315%0.153SC..Hα-helixtrans-56.1-32.6177-176.6177.4168.300113.1A506 E512 S517 S518A506-E514 HydrophobicContact CB-CG 4.11Å; E512-E514 PolarHBondContact O-N 3.31Å; E514-S517 PolarHBondContact O-OG 2.82Å; E514-S518 VanDerWaalsContact O-CB 3.25Å; E514-S518 WeakPolarHBondContact O-CB 3.28Å; E514-S518 PolarHBondContact O-N 3.31Å; E514-S518 PolarHBondContact O-OG 3.29Å
515G72.4Confident85.1Confident58 Ų5824.9 Ų24.960%0.59815%0.152SC*.Hα-helixtrans-67.4-34.3175.400000113.3S513 G519S513-G515 PolarHBondContact O-N 3.31Å; G515-G519 PolarHBondContact O-N 3.29Å
516L79.3Confident85.4Confident39 Ų3925 Ų2520%0.20415%0.153CC..Hα-helixtrans-71.9-48.1177.4179.461.2000110.9A380 L381 L384 S513 G519 L520A380-L516 HydrophobicContact CB-CD2 3.64Å; L381-L516 HydrophobicContact CD2-CD1 4.2Å; L384-L516 HydrophobicContact CD1-CD2 3.63Å; L384-L516 HydrophobicContact CD1-CG 3.78Å; S513-L516 WeakPolarHBondContact O-CB 3.33Å; S513-L516 PolarHBondContact O-N 3.37Å; S513-L516 VanDerWaalsContact OG-CB 3.26Å; S513-L516 WeakPolarHBondContact OG-CB 3.25Å; S513-L516 PolarHBondContact OG-N 2.86Å; L516-G519 PolarHBondContact O-N 3.21Å; L516-L520 WeakPolarHBondContact O-CG 3.48Å; L516-L520 PolarHBondContact O-N 3.34Å
517S84Confident86Confident0 Ų027.3 Ų27.30%016%0.163CC..Hα-helixtrans-64-46.1179.657.70000111.9S513 E514 G519 L520 L521S513-S517 PolarHBondContact O-N 3.34Å; E514-S517 PolarHBondContact O-OG 2.82Å; S517-G519 PolarHBondContact O-N 2.83Å; S517-L520 PolarHBondContact O-N 3.41Å; S517-L521 PolarHBondContact O-N 2.99Å
518S83Confident86.5Confident20 Ų2028.5 Ų28.514%0.1417%0.168CC..Hα-helixtrans-64.5-38.4175.4-54.20000112.4E514 L520 L521 N522E514-S518 VanDerWaalsContact O-CB 3.25Å; E514-S518 WeakPolarHBondContact O-CB 3.28Å; E514-S518 PolarHBondContact O-N 3.31Å; E514-S518 PolarHBondContact O-OG 3.29Å; S518-L520 VanDerWaalsContact C-N 3.35Å; S518-L520 PolarHBondContact O-N 3.45Å; S518-L521 PolarHBondContact O-N 3.22Å; S518-N522 PolarHBondContact O-N 3.18Å
519G83.3Confident86.9Confident17 Ų1728.4 Ų28.418%0.17517%0.168CC..Hα-helixtrans-60.4-42.8174.800000112.4G515 L516 S517 N522 T523G515-G519 PolarHBondContact O-N 3.29Å; L516-G519 PolarHBondContact O-N 3.21Å; S517-G519 PolarHBondContact O-N 2.83Å; G519-N522 PolarHBondContact O-N 3.39Å; G519-T523 PolarHBondContact O-N 2.6Å; G519-T523 PolarHBondContact O-OG1 3.15Å; G519-T523 VanDerWaalsContact O-OG1 3.1Å
520L88.7Confident87.4Confident15 Ų1529.7 Ų29.78%0.07917%0.174CC..Hα-helixtrans-65.9-42.4175-73.8174.9000112.4L381 L384 F385 F390 F394 L516 S517 S518 N522 T523 S524L381-L520 HydrophobicContact CD2-CD1 3.87Å; L381-L520 HydrophobicContact CD2-CD2 3.78Å; L381-L520 HydrophobicContact CD2-CG 4.26Å; L384-L520 HydrophobicContact CB-CD1 4.44Å; L384-L520 HydrophobicContact CD1-CD1 3.6Å; F385-L520 HydrophobicContact CE2-CD1 4.37Å; F385-L520 HydrophobicContact CE2-CD2 4.26Å; F385-L520 HydrophobicContact CZ-CD2 4.35Å; F390-L520 HydrophobicContact CE1-CD1 3.96Å; F390-L520 HydrophobicContact CZ-CB 4.06Å; F390-L520 HydrophobicContact CZ-CD1 3.87Å; F394-L520 HydrophobicContact CD2-CB 4.19Å; F394-L520 HydrophobicContact CE2-CB 4.05Å; F394-L520 WeakPolarHBondContact CE2-O 3.04Å; L516-L520 WeakPolarHBondContact O-CG 3.48Å; L516-L520 PolarHBondContact O-N 3.34Å; S517-L520 PolarHBondContact O-N 3.41Å; S518-L520 VanDerWaalsContact C-N 3.35Å; S518-L520 PolarHBondContact O-N 3.45Å; L520-N522 VanDerWaalsContact C-N 3.31Å; L520-N522 PolarHBondContact O-N 2.67Å; L520-T523 WeakPolarHBondContact O-CB 3.37Å; L520-T523 PolarHBondContact O-N 3.13Å; L520-T523 VanDerWaalsContact O-N 3.15Å; L520-S524 PolarHBondContact O-N 2.88Å
521L92.6Very high88.2Confident0 Ų030.3 Ų30.30%018%0.182CC..Hα-helixtrans-60.2-41.5175.6-71.3-168.5000112.1F390 L393 F394 Y397 G501 F502 A505 S517 S518 S524 A525F390-L521 HydrophobicContact CE2-CD2 4.41Å; L393-L521 HydrophobicContact CD2-CD1 4.4Å; L393-L521 HydrophobicContact CG-CD2 4.3Å; F394-L521 HydrophobicContact CB-CD2 4.28Å; F394-L521 HydrophobicContact CD2-CD2 4.47Å; Y397-L521 HydrophobicContact CD1-CB 3.86Å; Y397-L521 HydrophobicContact CD1-CD2 4.37Å; Y397-L521 WeakPolarHBondContact CD1-O 3.28Å; Y397-L521 HydrophobicContact CD2-CD1 4.1Å; Y397-L521 HydrophobicContact CE1-CB 3.89Å; Y397-L521 WeakPolarHBondContact CE1-O 3.26Å; Y397-L521 HydrophobicContact CE2-CD1 4.32Å; Y397-L521 HydrophobicContact CG-CB 4.31Å; Y397-L521 HydrophobicContact CG-CD1 4.27Å; Y397-L521 HydrophobicContact CG-CD2 4.2Å; Y397-L521 HydrophobicContact CG-CG 4.5Å; G501-L521 VanDerWaalsContact O-CD1 3.29Å; G501-L521 WeakPolarHBondContact O-CD1 3.48Å; F502-L521 HydrophobicContact CD1-CB 4.23Å; F502-L521 HydrophobicContact CD1-CD1 3.9Å; F502-L521 HydrophobicContact CE1-CB 3.96Å; F502-L521 HydrophobicContact CE1-CD1 4.42Å; A505-L521 HydrophobicContact CB-CD1 3.58Å; A505-L521 HydrophobicContact CB-CG 4.29Å; S517-L521 PolarHBondContact O-N 2.99Å; S518-L521 PolarHBondContact O-N 3.22Å; L521-S524 WeakPolarHBondContact O-CB 3.41Å; L521-S524 PolarHBondContact O-N 3.02Å; L521-A525 PolarHBondContact O-N 2.98Å
522N91.1Very high89.1Confident17 Ų1728.5 Ų28.59%0.09117%0.17CC..Hα-helixtrans-62.6-43.9172.3-80.6-36.7000112.1Y76 F502 S518 G519 L520 S524 A525 Q526Y76-N522 HydrophobicContact CE1-CB 4.24Å; Y76-N522 WeakPolarHBondContact OH-CB 3.4Å; F502-N522 WeakPolarHBondContact CZ-OD1 3.46Å; S518-N522 PolarHBondContact O-N 3.18Å; G519-N522 PolarHBondContact O-N 3.39Å; L520-N522 VanDerWaalsContact C-N 3.31Å; L520-N522 PolarHBondContact O-N 2.67Å; N522-S524 VanDerWaalsContact C-N 3.26Å; N522-S524 PolarHBondContact O-N 3.46Å; N522-A525 WeakPolarHBondContact O-CB 3.48Å; N522-A525 PolarHBondContact O-N 3.31Å; N522-Q526 VanDerWaalsContact O-CG 3.26Å; N522-Q526 WeakPolarHBondContact O-CG 3.25Å; N522-Q526 PolarHBondContact O-N 3.14Å
523T93.3Very high89.9Confident19 Ų1927.1 Ų27.112%0.11716%0.163CC..Hα-helixtrans-58.4-40.3174.3-59.70000111.5G519 L520 Q526 I527G519-T523 PolarHBondContact O-N 2.6Å; G519-T523 PolarHBondContact O-OG1 3.15Å; G519-T523 VanDerWaalsContact O-OG1 3.1Å; L520-T523 WeakPolarHBondContact O-CB 3.37Å; L520-T523 PolarHBondContact O-N 3.13Å; L520-T523 VanDerWaalsContact O-N 3.15Å; T523-Q526 PolarHBondContact O-N 3Å; T523-I527 HydrophobicContact CG2-CD1 3.95Å; T523-I527 HydrophobicContact CG2-CG1 4.49Å; T523-I527 VanDerWaalsContact O-CG1 3.32Å; T523-I527 WeakPolarHBondContact O-CG1 3.23Å; T523-I527 PolarHBondContact O-N 3.13Å
524S95.9Very high91Very high0 Ų028.5 Ų28.50%016%0.162CC..Hα-helixtrans-59.7-49174.4-167.20000111.7F394 G398 L520 L521 N522 Q526 I527 F528F394-S524 WeakPolarHBondContact O-CB 3.11Å; F394-S524 PolarHBondContact O-OG 3.19Å; G398-S524 VanDerWaalsContact CA-OG 3.26Å; G398-S524 WeakPolarHBondContact CA-OG 3.23Å; L520-S524 PolarHBondContact O-N 2.88Å; L521-S524 WeakPolarHBondContact O-CB 3.41Å; L521-S524 PolarHBondContact O-N 3.02Å; N522-S524 VanDerWaalsContact C-N 3.26Å; N522-S524 PolarHBondContact O-N 3.46Å; S524-Q526 VanDerWaalsContact C-N 3.27Å; S524-Q526 PolarHBondContact O-N 2.93Å; S524-I527 PolarHBondContact O-N 2.97Å; S524-F528 WeakPolarHBondContact O-CD2 3.36Å; S524-F528 PolarHBondContact O-N 3.18Å
525A96.2Very high92.1Very high0 Ų026.4 Ų26.40%016%0.156CC..Hα-helixtrans-56-40.5176.900000112.8Y397 T401 Y405 L521 N522 G529Y397-A525 HydrophobicContact CD1-CB 4.46Å; Y397-A525 HydrophobicContact CE1-CB 4.06Å; T401-A525 HydrophobicContact CG2-CB 3.45Å; T401-A525 VanDerWaalsContact CG2-CB 3.45Å; Y405-A525 HydrophobicContact CE2-CB 4.04Å; L521-A525 PolarHBondContact O-N 2.98Å; N522-A525 WeakPolarHBondContact O-CB 3.48Å; N522-A525 PolarHBondContact O-N 3.31Å; A525-G529 PolarHBondContact O-N 3.29Å
526Q96.6Very high93.2Very high3 Ų323.7 Ų23.71%0.01413%0.128CC..Hα-helixtrans-69-42.3177.7-59.4-72.619.100112.1M73 Y76 I77 N522 T523 S524 L530M73-Q526 VanDerWaalsContact CA-OE1 3.32Å; M73-Q526 HydrophobicContact CB-CB 4.24Å; M73-Q526 VanDerWaalsContact CG-OE1 3.24Å; Y76-Q526 HydrophobicContact CD1-CB 4.31Å; Y76-Q526 HydrophobicContact CD1-CG 3.55Å; Y76-Q526 HydrophobicContact CE1-CG 4.12Å; Y76-Q526 HydrophobicContact CG-CG 3.84Å; I77-Q526 HydrophobicContact CD1-CB 4.44Å; I77-Q526 HydrophobicContact CG1-CB 4.04Å; N522-Q526 VanDerWaalsContact O-CG 3.26Å; N522-Q526 WeakPolarHBondContact O-CG 3.25Å; N522-Q526 PolarHBondContact O-N 3.14Å; T523-Q526 PolarHBondContact O-N 3Å; S524-Q526 VanDerWaalsContact C-N 3.27Å; S524-Q526 PolarHBondContact O-N 2.93Å; Q526-L530 VanDerWaalsContact O-CB 3.32Å; Q526-L530 WeakPolarHBondContact O-CB 3.37Å; Q526-L530 PolarHBondContact O-N 3.41Å
527I97.8Very high94Very high57 Ų5721.9 Ų21.929%0.29212%0.119SC..Hα-helixtrans-60.9-51.9177.2-69.8165.5000110.4I77 T523 S524 L530 I531I77-I527 HydrophobicContact CD1-CG1 3.71Å; I77-I527 HydrophobicContact CG1-CG1 4.01Å; T523-I527 HydrophobicContact CG2-CD1 3.95Å; T523-I527 HydrophobicContact CG2-CG1 4.49Å; T523-I527 VanDerWaalsContact O-CG1 3.32Å; T523-I527 WeakPolarHBondContact O-CG1 3.23Å; T523-I527 PolarHBondContact O-N 3.13Å; S524-I527 PolarHBondContact O-N 2.97Å; I527-L530 PolarHBondContact O-N 3.06Å; I527-I531 HydrophobicContact CG2-CD1 3.84Å; I527-I531 WeakPolarHBondContact O-CG1 3.36Å; I527-I531 PolarHBondContact O-N 3.41Å; I527-I531 VanDerWaalsContact O-N 3.1Å
528F98.1Very high94.5Very high42 Ų4223.7 Ų23.718%0.18413%0.13CC..Hα-helixtrans-66.5-45.2-179.7-83-85.3000111I395 G398 I399 S524 L530 I531 L532I395-F528 HydrophobicContact CG2-CE2 4.38Å; I395-F528 HydrophobicContact CG2-CZ 3.83Å; G398-F528 VanDerWaalsContact C-CB 3.4Å; G398-F528 VanDerWaalsContact C-CG 3.47Å; G398-F528 WeakPolarHBondContact O-CB 3.4Å; I399-F528 HydrophobicContact CB-CD1 4.48Å; I399-F528 HydrophobicContact CD1-CE1 4.23Å; I399-F528 HydrophobicContact CG1-CD1 3.64Å; I399-F528 HydrophobicContact CG1-CE1 3.45Å; I399-F528 VanDerWaalsContact CG1-CE1 3.45Å; I399-F528 HydrophobicContact CG1-CG 4.37Å; I399-F528 HydrophobicContact CG1-CZ 4.04Å; S524-F528 WeakPolarHBondContact O-CD2 3.36Å; S524-F528 PolarHBondContact O-N 3.18Å; F528-L530 PolarHBondContact O-N 3.27Å; F528-I531 PolarHBondContact O-N 2.82Å; F528-I531 VanDerWaalsContact O-N 3.13Å; F528-L532 WeakPolarHBondContact O-CB 3.38Å; F528-L532 WeakPolarHBondContact O-CG 3.45Å; F528-L532 PolarHBondContact O-N 2.93Å
529G97.8Very high95Very high0 Ų025 Ų250%014%0.135CC..Hα-helixtrans-52.3-44.5175.200000112.7A525 L532 I533A525-G529 PolarHBondContact O-N 3.29Å; G529-L532 PolarHBondContact O-N 2.95Å; G529-I533 WeakPolarHBondContact O-CB 3.34Å; G529-I533 VanDerWaalsContact O-CG1 3.3Å; G529-I533 WeakPolarHBondContact O-CG1 3.31Å; G529-I533 PolarHBondContact O-N 3.47Å
530L97.7Very high95.5Very high32 Ų3225.6 Ų25.617%0.16813%0.132CC..Hα-helixtrans-61.9-49.6178.2-178.268.3000111.4W67 M70 M73 L74 I77 Q526 I527 F528 H534W67-L530 HydrophobicContact CZ3-CD1 4.43Å; M70-L530 HydrophobicContact CB-CD1 3.73Å; M70-L530 HydrophobicContact CE-CD1 3.46Å; M70-L530 VanDerWaalsContact CE-CD1 3.46Å; M70-L530 HydrophobicContact CE-CG 4.36Å; M70-L530 HydrophobicContact CG-CD1 4.25Å; M73-L530 HydrophobicContact CB-CB 4.18Å; M73-L530 HydrophobicContact SD-CB 4.25Å; M73-L530 PolarHBondContact SD-N 2.99Å; L74-L530 HydrophobicContact CD1-CD2 4.36Å; I77-L530 HydrophobicContact CD1-CD2 4.44Å; Q526-L530 VanDerWaalsContact O-CB 3.32Å; Q526-L530 WeakPolarHBondContact O-CB 3.37Å; Q526-L530 PolarHBondContact O-N 3.41Å; I527-L530 PolarHBondContact O-N 3.06Å; F528-L530 PolarHBondContact O-N 3.27Å; L530-H534 VanDerWaalsContact O-CB 3.26Å; L530-H534 WeakPolarHBondContact O-CB 3.38Å; L530-H534 PolarHBondContact O-N 3.35Å; L530-H534 VanDerWaalsContact O-N 3.13Å
531I97.9Very high95.6Very high84 Ų8426.1 Ų26.143%0.43114%0.136SC..Hα-helixtrans-63.3-45.9179.7-65.8166.8000110.6I527 F528 H534 V535I527-I531 HydrophobicContact CG2-CD1 3.84Å; I527-I531 WeakPolarHBondContact O-CG1 3.36Å; I527-I531 PolarHBondContact O-N 3.41Å; I527-I531 VanDerWaalsContact O-N 3.1Å; F528-I531 PolarHBondContact O-N 2.82Å; F528-I531 VanDerWaalsContact O-N 3.13Å; I531-H534 PolarHBondContact O-N 3.31Å; I531-V535 HydrophobicContact CG2-CG2 4.47Å; I531-V535 WeakPolarHBondContact O-CG2 3.48Å; I531-V535 PolarHBondContact O-N 3.48Å
532L98Very high95.5Very high2 Ų231.7 Ų31.71%0.0116%0.162CC..Hα-helixtrans-68.6-42.8-173-63.1-155.2000111.8V403 A406 F528 G529 V535 A536 F551 L552 L555V403-L532 HydrophobicContact CB-CD1 4.36Å; V403-L532 HydrophobicContact CG2-CD1 3.47Å; V403-L532 VanDerWaalsContact CG2-CD1 3.47Å; A406-L532 HydrophobicContact CB-CB 4.26Å; F528-L532 WeakPolarHBondContact O-CB 3.38Å; F528-L532 WeakPolarHBondContact O-CG 3.45Å; F528-L532 PolarHBondContact O-N 2.93Å; G529-L532 PolarHBondContact O-N 2.95Å; L532-V535 PolarHBondContact O-N 2.86Å; L532-A536 WeakPolarHBondContact O-CB 3.44Å; L532-A536 PolarHBondContact O-N 3.46Å; L532-F551 HydrophobicContact CD2-CE1 4.12Å; L532-F551 HydrophobicContact CD2-CZ 3.94Å; L532-L552 HydrophobicContact CB-CD2 4.15Å; L532-L552 HydrophobicContact CD1-CD2 4.09Å; L532-L555 HydrophobicContact CD1-CD1 4.01Å; L532-L555 HydrophobicContact CD2-CD1 3.13Å; L532-L555 HydrophobicContact CG-CD1 4.2Å
533I97.6Very high95.5Very high0 Ų039 Ų390%019%0.19CC..Hα-helixtrans-63.2-46.4174.6-65.8166000109.8D66 M70 M73 A406 T409 L410 G529 V535 A536 T537D66-I533 HydrophobicContact CB-CG2 4.07Å; M70-I533 HydrophobicContact CG-CB 4.04Å; M70-I533 HydrophobicContact CG-CD1 4.15Å; M70-I533 HydrophobicContact CG-CG2 3.71Å; M70-I533 HydrophobicContact SD-CB 4.06Å; M70-I533 HydrophobicContact SD-CG2 3.48Å; M70-I533 WeakPolarHBondContact SD-CG2 3.4Å; M73-I533 HydrophobicContact CE-CD1 3.46Å; M73-I533 VanDerWaalsContact CE-CD1 3.46Å; M73-I533 HydrophobicContact SD-CD1 4.03Å; A406-I533 HydrophobicContact CB-CG1 3.84Å; T409-I533 HydrophobicContact CG2-CD1 4.15Å; T409-I533 HydrophobicContact CG2-CG2 4.23Å; L410-I533 HydrophobicContact CD2-CG2 4.35Å; G529-I533 WeakPolarHBondContact O-CB 3.34Å; G529-I533 VanDerWaalsContact O-CG1 3.3Å; G529-I533 WeakPolarHBondContact O-CG1 3.31Å; G529-I533 PolarHBondContact O-N 3.47Å; I533-V535 PolarHBondContact O-N 3.47Å; I533-A536 PolarHBondContact O-N 3.45Å; I533-T537 PolarHBondContact O-N 3.04Å; I533-T537 PolarHBondContact O-OG1 3.38Å
534H95.6Very high95.4Very high94 Ų9439.7 Ų39.744%0.43520%0.2SC..Hα-helixtrans-59.8-33.6-178.3-164.465.8000113.4M70 L530 I531 P538M70-H534 HydrophobicContact CE-CB 3.69Å; L530-H534 VanDerWaalsContact O-CB 3.26Å; L530-H534 WeakPolarHBondContact O-CB 3.38Å; L530-H534 PolarHBondContact O-N 3.35Å; L530-H534 VanDerWaalsContact O-N 3.13Å; I531-H534 PolarHBondContact O-N 3.31Å; H534-P538 WeakPolarHBondContact O-CD 3.33Å; H534-P538 WeakPolarHBondContact O-CG 3.47Å
535V96.6Very high95.2Very high56 Ų5640.4 Ų40.434%0.33921%0.205SC..Hα-helixtrans-86.7-40.7177.5176.40000112I531 L532 I533 T537 P538 L539 F551I531-V535 HydrophobicContact CG2-CG2 4.47Å; I531-V535 WeakPolarHBondContact O-CG2 3.48Å; I531-V535 PolarHBondContact O-N 3.48Å; L532-V535 PolarHBondContact O-N 2.86Å; I533-V535 PolarHBondContact O-N 3.47Å; V535-T537 PolarHBondContact O-N 2.83Å; V535-P538 WeakPolarHBondContact O-CD 3.39Å; V535-L539 HydrophobicContact CG1-CD1 3.95Å; V535-L539 WeakPolarHBondContact O-CG 3.38Å; V535-L539 PolarHBondContact O-N 2.71Å; V535-F551 HydrophobicContact CB-CE1 3.96Å; V535-F551 HydrophobicContact CB-CZ 3.86Å; V535-F551 HydrophobicContact CG1-CD1 4.34Å; V535-F551 HydrophobicContact CG1-CD2 4.4Å; V535-F551 HydrophobicContact CG1-CE1 3.81Å; V535-F551 HydrophobicContact CG1-CE2 3.88Å; V535-F551 HydrophobicContact CG1-CZ 3.55Å
536A96.7Very high95.2Very high1 Ų143.4 Ų43.41%0.00822%0.22CC..Hα-helixtrans-68.4-33.6-176.800000112.6L410 L532 I533 L539 R540 F551 L552L410-A536 HydrophobicContact CD1-CB 3.77Å; L532-A536 WeakPolarHBondContact O-CB 3.44Å; L532-A536 PolarHBondContact O-N 3.46Å; I533-A536 PolarHBondContact O-N 3.45Å; A536-L539 PolarHBondContact O-N 3.4Å; A536-R540 WeakPolarHBondContact O-CB 3.16Å; A536-R540 PolarHBondContact O-N 3.4Å; A536-F551 HydrophobicContact CB-CD1 4.28Å; A536-F551 HydrophobicContact CB-CE1 4.47Å; A536-L552 HydrophobicContact CB-CD2 4.33Å; A536-L552 HydrophobicContact CB-CG 4.5Å
537T95Very high95.1Very high1 Ų145.4 Ų45.41%0.00623%0.234CC..Hα-helixtrans-63.1-55.9179.5-61.80000112.3T62 I63 D66 L410 I533 V535 L539 R540 T541T62-T537 HydrophobicContact CG2-CG2 4.26Å; I63-T537 HydrophobicContact CB-CG2 4.37Å; I63-T537 HydrophobicContact CG1-CG2 3.52Å; D66-T537 WeakPolarHBondContact OD2-CB 3.48Å; D66-T537 WeakPolarHBondContact OD2-CG2 3.3Å; D66-T537 PolarHBondContact OD2-OG1 3.24Å; L410-T537 VanDerWaalsContact CD2-OG1 3.25Å; L410-T537 WeakPolarHBondContact CD2-OG1 3.46Å; I533-T537 PolarHBondContact O-N 3.04Å; I533-T537 PolarHBondContact O-OG1 3.38Å; V535-T537 PolarHBondContact O-N 2.83Å; T537-L539 VanDerWaalsContact C-N 3.31Å; T537-L539 PolarHBondContact O-N 3.02Å; T537-R540 WeakPolarHBondContact O-CB 3.33Å; T537-R540 PolarHBondContact O-N 3.34Å; T537-R540 VanDerWaalsContact O-N 3.09Å; T537-T541 HydrophobicContact CG2-CG2 4.17Å; T537-T541 WeakPolarHBondContact O-CG2 3.49Å; T537-T541 PolarHBondContact O-N 3.06Å; T537-T541 PolarHBondContact O-OG1 3.46Å
538P94.2Very high95Very high38 Ų3842.8 Ų42.825%0.24722%0.221CC..Hα-helixtrans-58.6-39.4176-24.433.2000113.5I63 H534 V535 R540 T541 H542I63-P538 HydrophobicContact CD1-CG 3.97Å; H534-P538 WeakPolarHBondContact O-CD 3.33Å; H534-P538 WeakPolarHBondContact O-CG 3.47Å; V535-P538 WeakPolarHBondContact O-CD 3.39Å; P538-R540 VanDerWaalsContact C-N 3.26Å; P538-R540 PolarHBondContact O-N 3.38Å; P538-T541 WeakPolarHBondContact CA-OG1 3.48Å; P538-T541 PolarHBondContact O-N 3.07Å; P538-T541 PolarHBondContact O-OG1 3.18Å; P538-H542 WeakPolarHBondContact O-CB 3.38Å; P538-H542 PolarHBondContact O-CD2 3.28Å; P538-H542 PolarHBondContact O-N 2.94Å
539L95.4Very high94.9Very high47 Ų4741 Ų4125%0.24621%0.213CC..Hα-helixtrans-58.1-43175.7-76.8173.9000111.2V535 A536 T537 Y543 F551V535-L539 HydrophobicContact CG1-CD1 3.95Å; V535-L539 WeakPolarHBondContact O-CG 3.38Å; V535-L539 PolarHBondContact O-N 2.71Å; A536-L539 PolarHBondContact O-N 3.4Å; T537-L539 VanDerWaalsContact C-N 3.31Å; T537-L539 PolarHBondContact O-N 3.02Å; L539-Y543 HydrophobicContact CD2-CD2 4.15Å; L539-Y543 HydrophobicContact CD2-CE2 4.42Å; L539-Y543 WeakPolarHBondContact O-CB 3.44Å; L539-Y543 PolarHBondContact O-N 2.79Å; L539-F551 HydrophobicContact CD1-CB 3.75Å; L539-F551 HydrophobicContact CD1-CD1 4.16Å; L539-F551 HydrophobicContact CD1-CD2 4.32Å; L539-F551 HydrophobicContact CD1-CG 3.82Å
540R93.7Very high94.9Very high30 Ų3045.5 Ų45.511%0.11324%0.236CC..Hα-helixtrans-70.3-45179.4-178.5-178.559.172-2112.7T62 S413 A536 T537 P538 G544 V545T62-R540 VanDerWaalsContact CG2-NH2 3.32Å; S413-R540 PolarHBondContact OG-NH2 3.3Å; A536-R540 WeakPolarHBondContact O-CB 3.16Å; A536-R540 PolarHBondContact O-N 3.4Å; T537-R540 WeakPolarHBondContact O-CB 3.33Å; T537-R540 PolarHBondContact O-N 3.34Å; T537-R540 VanDerWaalsContact O-N 3.09Å; P538-R540 VanDerWaalsContact C-N 3.26Å; P538-R540 PolarHBondContact O-N 3.38Å; R540-G544 WeakPolarHBondContact CA-O 3.43Å; R540-G544 CarbonylContact O-C 3.4Å; R540-G544 WeakPolarHBondContact O-CA 3.35Å; R540-G544 PolarHBondContact O-N 3.27Å; R540-V545 HydrophobicContact CG-CG2 4.21Å
541T89.9Confident94.9Very high26 Ų2646.5 Ų46.516%0.1624%0.24CC..Hα-helixtrans-70.4-39.1-176.255.90000111.7D59 T62 T537 P538D59-T541 HydrophobicContact CB-CG2 4.26Å; T62-T541 HydrophobicContact CG2-CG2 4.24Å; T537-T541 HydrophobicContact CG2-CG2 4.17Å; T537-T541 WeakPolarHBondContact O-CG2 3.49Å; T537-T541 PolarHBondContact O-N 3.06Å; T537-T541 PolarHBondContact O-OG1 3.46Å; P538-T541 WeakPolarHBondContact CA-OG1 3.48Å; P538-T541 PolarHBondContact O-N 3.07Å; P538-T541 PolarHBondContact O-OG1 3.18Å
542H90.1Very high94.9Very high116 Ų11642.6 Ų42.654%0.53722%0.22SC..Hα-helixtrans-86.6-34.8-178.2-68-62.8000114.6D59 P538D59-H542 IonicContact OD2-CE1 2.92Å; D59-H542 IonicContact OD2-ND1 3.47Å; P538-H542 WeakPolarHBondContact O-CB 3.38Å; P538-H542 PolarHBondContact O-CD2 3.28Å; P538-H542 PolarHBondContact O-N 2.94Å
543Y91.9Very high94.9Very high172 Ų17243.7 Ų43.768%0.67523%0.226SC*.Hα-helixtrans-119.83.8-172.3-52.2-73000114L539L539-Y543 HydrophobicContact CD2-CD2 4.15Å; L539-Y543 HydrophobicContact CD2-CE2 4.42Å; L539-Y543 WeakPolarHBondContact O-CB 3.44Å; L539-Y543 PolarHBondContact O-N 2.79Å
544G90.5Very high94.9Very high33 Ų3345.2 Ų45.234%0.3424%0.242SC..  trans85.5176.3-178.400000113.9R540 L546 P547R540-G544 WeakPolarHBondContact CA-O 3.43Å; R540-G544 CarbonylContact O-C 3.4Å; R540-G544 WeakPolarHBondContact O-CA 3.35Å; R540-G544 PolarHBondContact O-N 3.27Å; G544-L546 VanDerWaalsContact C-N 3.33Å; G544-L546 PolarHBondContact O-N 3.41Å; G544-P547 WeakPolarHBondContact O-CD 3.39Å
545V92.7Very high95Very high15 Ų1542.4 Ų42.49%0.09123%0.23CC..Hα-helixtrans-64.2-33.8-170.5-179.70000113.8I414 Y418 L475 R540 G548 N549I414-V545 HydrophobicContact CB-CG1 4.42Å; I414-V545 HydrophobicContact CG1-CG1 4.33Å; I414-V545 HydrophobicContact CG2-CG1 3.92Å; Y418-V545 HydrophobicContact CE2-CB 3.75Å; Y418-V545 HydrophobicContact CE2-CG1 3.81Å; Y418-V545 HydrophobicContact CE2-CG2 3.95Å; L475-V545 HydrophobicContact CD1-CG1 4.31Å; R540-V545 HydrophobicContact CG-CG2 4.21Å; V545-G548 PolarHBondContact O-N 2.95Å; V545-N549 PolarHBondContact O-N 2.89Å
546L94.9Very high95Very high62 Ų6239.8 Ų39.833%0.32521%0.214SC..Hα-helixtrans-62.1-53.3-173.4174.871.9000113.1T472 Y476 G544 G548 N549 L550T472-L546 HydrophobicContact CG2-CD1 3.86Å; Y476-L546 HydrophobicContact CE2-CD1 4.22Å; Y476-L546 VanDerWaalsContact OH-CB 3.29Å; Y476-L546 WeakPolarHBondContact OH-CB 3.38Å; Y476-L546 WeakPolarHBondContact OH-CD2 3.35Å; G544-L546 VanDerWaalsContact C-N 3.33Å; G544-L546 PolarHBondContact O-N 3.41Å; L546-G548 VanDerWaalsContact C-N 3.3Å; L546-G548 PolarHBondContact O-N 3.07Å; L546-N549 PolarHBondContact O-N 2.98Å; L546-L550 HydrophobicContact CD1-CD1 3.87Å; L546-L550 HydrophobicContact CD1-CD2 4.27Å; L546-L550 HydrophobicContact CD1-CG 3.8Å; L546-L550 HydrophobicContact CD2-CD1 4.37Å; L546-L550 HydrophobicContact CG-CD1 3.84Å; L546-L550 HydrophobicContact CG-CG 4.16Å; L546-L550 WeakPolarHBondContact O-CB 3.38Å; L546-L550 WeakPolarHBondContact O-CG 3.43Å; L546-L550 PolarHBondContact O-N 3.02Å
547P96Very high95.1Very high46 Ų4644 Ų4430%0.29924%0.236SC..Hα-helixtrans-54.8-41.5176.2-31.638000114.2G544 F551G544-P547 WeakPolarHBondContact O-CD 3.39Å; P547-F551 WeakPolarHBondContact O-CB 2.98Å; P547-F551 PolarHBondContact O-N 3.11Å
548G95.6Very high95.2Very high2 Ų247.9 Ų47.92%0.02126%0.256CS..Hα-helixtrans-62.2-45.7176.500000112.5V545 L546 F551 L552V545-G548 PolarHBondContact O-N 2.95Å; L546-G548 VanDerWaalsContact C-N 3.3Å; L546-G548 PolarHBondContact O-N 3.07Å; G548-F551 WeakPolarHBondContact O-CB 3.35Å; G548-F551 PolarHBondContact O-N 2.99Å; G548-L552 WeakPolarHBondContact O-CG 3.41Å; G548-L552 PolarHBondContact O-N 3.41Å; G548-L552 VanDerWaalsContact O-N 3.15Å
549N96.4Very high95.4Very high4 Ų446 Ų462%0.02124%0.244CC..Hα-helixtrans-71.7-35.2179.4-77.712.5000113.1T472 V545 L546 F551 L552 T553T472-N549 HydrophobicContact CG2-CB 3.64Å; T472-N549 WeakPolarHBondContact OG1-CB 3.46Å; V545-N549 PolarHBondContact O-N 2.89Å; L546-N549 PolarHBondContact O-N 2.98Å; N549-F551 VanDerWaalsContact C-N 3.34Å; N549-L552 PolarHBondContact O-N 3.37Å; N549-T553 WeakPolarHBondContact O-CB 3.4Å; N549-T553 PolarHBondContact O-N 3.09Å; N549-T553 PolarHBondContact O-OG1 2.68Å
550L97.1Very high95.5Very high94 Ų9444.4 Ų44.449%0.49224%0.236SC..Hα-helixtrans-65.4-38.2173.1-72.6-179.9000111.6T472 L546 T553 G554T472-L550 HydrophobicContact CG2-CD2 4.3Å; L546-L550 HydrophobicContact CD1-CD1 3.87Å; L546-L550 HydrophobicContact CD1-CD2 4.27Å; L546-L550 HydrophobicContact CD1-CG 3.8Å; L546-L550 HydrophobicContact CD2-CD1 4.37Å; L546-L550 HydrophobicContact CG-CD1 3.84Å; L546-L550 HydrophobicContact CG-CG 4.16Å; L546-L550 WeakPolarHBondContact O-CB 3.38Å; L546-L550 WeakPolarHBondContact O-CG 3.43Å; L546-L550 PolarHBondContact O-N 3.02Å; L550-T553 PolarHBondContact O-N 3.49Å; L550-G554 PolarHBondContact O-N 2.89Å
551F97.8Very high95.6Very high54 Ų5447.3 Ų47.324%0.23725%0.253CS..Hα-helixtrans-58.3-50.2172.2165.3-104.6000111.5L532 V535 A536 L539 P547 G548 N549 T553 G554 L555L532-F551 HydrophobicContact CD2-CE1 4.12Å; L532-F551 HydrophobicContact CD2-CZ 3.94Å; V535-F551 HydrophobicContact CB-CE1 3.96Å; V535-F551 HydrophobicContact CB-CZ 3.86Å; V535-F551 HydrophobicContact CG1-CD1 4.34Å; V535-F551 HydrophobicContact CG1-CD2 4.4Å; V535-F551 HydrophobicContact CG1-CE1 3.81Å; V535-F551 HydrophobicContact CG1-CE2 3.88Å; V535-F551 HydrophobicContact CG1-CZ 3.55Å; A536-F551 HydrophobicContact CB-CD1 4.28Å; A536-F551 HydrophobicContact CB-CE1 4.47Å; L539-F551 HydrophobicContact CD1-CB 3.75Å; L539-F551 HydrophobicContact CD1-CD1 4.16Å; L539-F551 HydrophobicContact CD1-CD2 4.32Å; L539-F551 HydrophobicContact CD1-CG 3.82Å; P547-F551 WeakPolarHBondContact O-CB 2.98Å; P547-F551 PolarHBondContact O-N 3.11Å; G548-F551 WeakPolarHBondContact O-CB 3.35Å; G548-F551 PolarHBondContact O-N 2.99Å; N549-F551 VanDerWaalsContact C-N 3.34Å; F551-T553 VanDerWaalsContact C-N 3.34Å; F551-T553 PolarHBondContact O-N 3.47Å; F551-G554 PolarHBondContact O-N 2.83Å; F551-L555 HydrophobicContact CE1-CD1 4.22Å; F551-L555 HydrophobicContact CE2-CD1 3.89Å; F551-L555 HydrophobicContact CE2-CG 4.13Å; F551-L555 HydrophobicContact CZ-CD1 3.64Å; F551-L555 HydrophobicContact CZ-CG 4.32Å; F551-L555 PolarHBondContact O-N 2.74Å
552L97.6Very high95.9Very high2 Ų247.6 Ų47.61%0.0125%0.253CS..Hα-helixtrans-62.6-39.9177.6-65.1178000112.3V403 A406 V407 M468 L532 A536 G548 N549 L555 T556V403-L552 HydrophobicContact CG1-CB 4.24Å; V403-L552 HydrophobicContact CG2-CB 4.47Å; V403-L552 HydrophobicContact CG2-CD2 4.28Å; A406-L552 HydrophobicContact CB-CD1 4.2Å; A406-L552 HydrophobicContact CB-CD2 3.9Å; V407-L552 HydrophobicContact CG2-CD1 4.32Å; M468-L552 HydrophobicContact CE-CB 3.67Å; M468-L552 HydrophobicContact CE-CD1 4.04Å; L532-L552 HydrophobicContact CB-CD2 4.15Å; L532-L552 HydrophobicContact CD1-CD2 4.09Å; A536-L552 HydrophobicContact CB-CD2 4.33Å; A536-L552 HydrophobicContact CB-CG 4.5Å; G548-L552 WeakPolarHBondContact O-CG 3.41Å; G548-L552 PolarHBondContact O-N 3.41Å; G548-L552 VanDerWaalsContact O-N 3.15Å; N549-L552 PolarHBondContact O-N 3.37Å; L552-L555 PolarHBondContact O-N 3.35Å; L552-T556 PolarHBondContact O-N 3.36Å; L552-T556 PolarHBondContact O-OG1 3.15Å
553T97.7Very high96.2Very high24 Ų2442.1 Ų42.115%0.14723%0.228CC..Hα-helixtrans-65-44.4176.4-56.60000111.2L465 T472 N549 L550 F551 L555 T556 L557L465-T553 HydrophobicContact CD1-CG2 4.03Å; L465-T553 WeakPolarHBondContact CD1-O 3.49Å; T472-T553 PolarHBondContact OG1-OG1 3.43Å; N549-T553 WeakPolarHBondContact O-CB 3.4Å; N549-T553 PolarHBondContact O-N 3.09Å; N549-T553 PolarHBondContact O-OG1 2.68Å; L550-T553 PolarHBondContact O-N 3.49Å; F551-T553 VanDerWaalsContact C-N 3.34Å; F551-T553 PolarHBondContact O-N 3.47Å; T553-L555 PolarHBondContact O-N 2.77Å; T553-T556 WeakPolarHBondContact O-CB 3.49Å; T553-T556 PolarHBondContact O-N 3.47Å; T553-T556 VanDerWaalsContact O-N 3.15Å; T553-L557 PolarHBondContact O-N 3.21Å
554G97.6Very high96.4Very high32 Ų3237.2 Ų37.233%0.3322%0.215SC..Hα-helixtrans-62.7-39178.200000112.9L550 F551 L557 I558L550-G554 PolarHBondContact O-N 2.89Å; F551-G554 PolarHBondContact O-N 2.83Å; G554-L557 WeakPolarHBondContact O-CB 3.47Å; G554-L557 PolarHBondContact O-N 3.17Å; G554-I558 PolarHBondContact O-N 3.49Å; G554-I558 VanDerWaalsContact O-N 3.15Å
555L97.7Very high96.6Very high36 Ų3640.8 Ų40.819%0.18823%0.226CC..Hα-helixtrans-68.2-38.7172.1-68.2-165.2000112.4I399 L532 F551 L552 T553 L557 I558 G559I399-L555 HydrophobicContact CG2-CB 4.07Å; I399-L555 VanDerWaalsContact CG2-O 3.3Å; I399-L555 WeakPolarHBondContact CG2-O 3.2Å; L532-L555 HydrophobicContact CD1-CD1 4.01Å; L532-L555 HydrophobicContact CD2-CD1 3.13Å; L532-L555 HydrophobicContact CG-CD1 4.2Å; F551-L555 HydrophobicContact CE1-CD1 4.22Å; F551-L555 HydrophobicContact CE2-CD1 3.89Å; F551-L555 HydrophobicContact CE2-CG 4.13Å; F551-L555 HydrophobicContact CZ-CD1 3.64Å; F551-L555 HydrophobicContact CZ-CG 4.32Å; F551-L555 PolarHBondContact O-N 2.74Å; L552-L555 PolarHBondContact O-N 3.35Å; T553-L555 PolarHBondContact O-N 2.77Å; L555-L557 PolarHBondContact O-N 3.39Å; L555-I558 HydrophobicContact CD2-CD1 3.86Å; L555-I558 WeakPolarHBondContact O-CB 3.42Å; L555-I558 PolarHBondContact O-N 3.19Å; L555-I558 VanDerWaalsContact O-N 3.08Å; L555-G559 PolarHBondContact O-N 2.85Å
556T97.4Very high96.6Very high0 Ų040.4 Ų40.40%022%0.223CC..Hα-helixtrans-59.7-34173.9-50.70000111.4L400 Y461 L465 L552 T553 G559 T560L400-T556 HydrophobicContact CD1-CG2 3.96Å; Y461-T556 HydrophobicContact CD1-CG2 4.31Å; Y461-T556 HydrophobicContact CE1-CG2 3.82Å; Y461-T556 WeakPolarHBondContact CE1-O 3.24Å; L465-T556 HydrophobicContact CB-CG2 3.89Å; L465-T556 HydrophobicContact CD1-CG2 4.03Å; L552-T556 PolarHBondContact O-N 3.36Å; L552-T556 PolarHBondContact O-OG1 3.15Å; T553-T556 WeakPolarHBondContact O-CB 3.49Å; T553-T556 PolarHBondContact O-N 3.47Å; T553-T556 VanDerWaalsContact O-N 3.15Å; T556-G559 PolarHBondContact O-N 3.37Å; T556-T560 WeakPolarHBondContact O-CB 3.32Å; T556-T560 PolarHBondContact O-N 3.42Å; T556-T560 PolarHBondContact O-OG1 2.81Å
557L97.9Very high96.4Very high89 Ų8943 Ų4347%0.46623%0.232SC..Hα-helixtrans-65-45.7172.4175.164.8000111.8L465 T553 G554 L555 G559 T560 I561L465-L557 HydrophobicContact CD1-CB 4.1Å; L465-L557 HydrophobicContact CD2-CB 4.27Å; L465-L557 HydrophobicContact CD2-CD1 3.82Å; T553-L557 PolarHBondContact O-N 3.21Å; G554-L557 WeakPolarHBondContact O-CB 3.47Å; G554-L557 PolarHBondContact O-N 3.17Å; L555-L557 PolarHBondContact O-N 3.39Å; L557-G559 VanDerWaalsContact C-N 3.33Å; L557-G559 PolarHBondContact O-N 3.11Å; L557-T560 WeakPolarHBondContact O-CB 3.47Å; L557-T560 PolarHBondContact O-N 3.1Å; L557-I561 HydrophobicContact CG-CD1 4.4Å; L557-I561 WeakPolarHBondContact O-CG1 3.44Å; L557-I561 PolarHBondContact O-N 3.1Å
558I97.6Very high95.5Very high83 Ų8344.5 Ų44.543%0.42624%0.235SC..Hα-helixtrans-58.8-47.3175-67.2169.6000110.3I399 G554 L555 T560 I561 M562I399-I558 HydrophobicContact CD1-CG2 4.3Å; G554-I558 PolarHBondContact O-N 3.49Å; G554-I558 VanDerWaalsContact O-N 3.15Å; L555-I558 HydrophobicContact CD2-CD1 3.86Å; L555-I558 WeakPolarHBondContact O-CB 3.42Å; L555-I558 PolarHBondContact O-N 3.19Å; L555-I558 VanDerWaalsContact O-N 3.08Å; I558-T560 VanDerWaalsContact C-N 3.3Å; I558-T560 PolarHBondContact O-N 2.95Å; I558-I561 PolarHBondContact O-N 3.05Å; I558-M562 HydrophobicContact CG2-SD 4.27Å; I558-M562 WeakPolarHBondContact O-CG 3.29Å; I558-M562 PolarHBondContact O-N 2.85Å
559G97.6Very high94.6Very high0 Ų047.5 Ų47.50%025%0.251CS..Hα-helixtrans-58.5-40.7176.100000112.9Y461 L555 T556 L557 I561 M562 T563Y461-G559 VanDerWaalsContact OH-CA 3.31Å; Y461-G559 WeakPolarHBondContact OH-CA 3.36Å; L555-G559 PolarHBondContact O-N 2.85Å; T556-G559 PolarHBondContact O-N 3.37Å; L557-G559 VanDerWaalsContact C-N 3.33Å; L557-G559 PolarHBondContact O-N 3.11Å; G559-I561 PolarHBondContact O-N 3Å; G559-M562 PolarHBondContact O-N 3.48Å; G559-T563 PolarHBondContact O-N 3.28Å; G559-T563 PolarHBondContact O-OG1 3.44Å; G559-T563 VanDerWaalsContact O-OG1 3.07Å
560T97.1Very high93.8Very high12 Ų1248 Ų487%0.07425%0.253CS..Hα-helixtrans-60.1-46.4175.1-570000111.5Y461 I462 T556 L557 I558 M562 T563 V564Y461-T560 WeakPolarHBondContact CD1-OG1 3.47Å; I462-T560 HydrophobicContact CG1-CG2 3.61Å; T556-T560 WeakPolarHBondContact O-CB 3.32Å; T556-T560 PolarHBondContact O-N 3.42Å; T556-T560 PolarHBondContact O-OG1 2.81Å; L557-T560 WeakPolarHBondContact O-CB 3.47Å; L557-T560 PolarHBondContact O-N 3.1Å; I558-T560 VanDerWaalsContact C-N 3.3Å; I558-T560 PolarHBondContact O-N 2.95Å; T560-M562 VanDerWaalsContact C-N 3.33Å; T560-M562 PolarHBondContact O-N 2.9Å; T560-T563 PolarHBondContact O-N 3.33Å; T560-V564 WeakPolarHBondContact O-CG2 2.96Å; T560-V564 PolarHBondContact O-N 2.81Å
561I97.3Very high92.6Very high91 Ų9145.8 Ų45.847%0.46724%0.238SC..Hα-helixtrans-59.4-47.1177.1-66165.5000109.9L557 I558 G559 T563 V564 L565L557-I561 HydrophobicContact CG-CD1 4.4Å; L557-I561 WeakPolarHBondContact O-CG1 3.44Å; L557-I561 PolarHBondContact O-N 3.1Å; I558-I561 PolarHBondContact O-N 3.05Å; G559-I561 PolarHBondContact O-N 3Å; I561-T563 VanDerWaalsContact C-N 3.33Å; I561-T563 PolarHBondContact O-N 2.59Å; I561-V564 PolarHBondContact O-N 2.98Å; I561-L565 HydrophobicContact CG2-CD1 4.04Å; I561-L565 VanDerWaalsContact O-CG 3.3Å; I561-L565 WeakPolarHBondContact O-CG 3.2Å; I561-L565 PolarHBondContact O-N 2.73Å; I561-L565 VanDerWaalsContact O-N 3.16Å
562M95.8Very high91.5Very high32 Ų3247.3 Ų47.316%0.15824%0.243CC..Hα-helixtrans-61.3-41178.9-65.9-175.580.500112.4L392 I395 I399 I558 G559 T560 L565 I566L392-M562 HydrophobicContact CD2-CB 4.38Å; L392-M562 HydrophobicContact CD2-CE 3.69Å; I395-M562 HydrophobicContact CB-CE 3.56Å; I395-M562 HydrophobicContact CB-SD 4.1Å; I395-M562 HydrophobicContact CD1-CE 3.69Å; I395-M562 HydrophobicContact CG1-CE 4.21Å; I395-M562 HydrophobicContact CG2-CE 3.48Å; I395-M562 VanDerWaalsContact CG2-CE 3.48Å; I395-M562 HydrophobicContact CG2-SD 3.45Å; I395-M562 WeakPolarHBondContact CG2-SD 3.22Å; I399-M562 HydrophobicContact CD1-SD 4.4Å; I558-M562 HydrophobicContact CG2-SD 4.27Å; I558-M562 WeakPolarHBondContact O-CG 3.29Å; I558-M562 PolarHBondContact O-N 2.85Å; G559-M562 PolarHBondContact O-N 3.48Å; T560-M562 VanDerWaalsContact C-N 3.33Å; T560-M562 PolarHBondContact O-N 2.9Å; M562-L565 PolarHBondContact O-N 2.97Å; M562-I566 PolarHBondContact O-N 3.22Å
563T95.6Very high90.4Very high2 Ų249.3 Ų49.31%0.01225%0.252CS..Hα-helixtrans-62.5-41.5176.5-62.80000112.3S396 T457 Y461 Y497 G559 T560 I561 L565 I566S396-T563 VanDerWaalsContact CB-OG1 3.26Å; S396-T563 WeakPolarHBondContact CB-OG1 3.2Å; S396-T563 PolarHBondContact OG-OG1 2.91Å; T457-T563 HydrophobicContact CG2-CG2 3.71Å; Y461-T563 HydrophobicContact CD2-CG2 4.06Å; Y461-T563 WeakPolarHBondContact CD2-OG1 3.4Å; Y461-T563 VanDerWaalsContact CE2-OG1 3.25Å; Y461-T563 WeakPolarHBondContact CE2-OG1 3.39Å; Y497-T563 HydrophobicContact CE2-CG2 4.36Å; Y497-T563 PolarHBondContact OH-OG1 3.12Å; G559-T563 PolarHBondContact O-N 3.28Å; G559-T563 PolarHBondContact O-OG1 3.44Å; G559-T563 VanDerWaalsContact O-OG1 3.07Å; T560-T563 PolarHBondContact O-N 3.33Å; I561-T563 VanDerWaalsContact C-N 3.33Å; I561-T563 PolarHBondContact O-N 2.59Å; T563-L565 VanDerWaalsContact C-N 3.26Å; T563-L565 PolarHBondContact O-N 3.27Å; T563-I566 WeakPolarHBondContact O-CB 3.27Å; T563-I566 WeakPolarHBondContact O-CG1 3.23Å; T563-I566 PolarHBondContact O-N 2.9Å
564V95.9Very high89.5Confident69 Ų6952.1 Ų52.142%0.41826%0.263SS..Hα-helixtrans-63.3-34.31771710000111.8K454 T560 I561 I566K454-V564 PolarHBondContact NZ-O 3.23Å; T560-V564 WeakPolarHBondContact O-CG2 2.96Å; T560-V564 PolarHBondContact O-N 2.81Å; I561-V564 PolarHBondContact O-N 2.98Å; V564-I566 VanDerWaalsContact C-N 3.29Å; V564-I566 PolarHBondContact O-N 3.13Å
565L95.5Very high88.4Confident107 Ų10751.8 Ų51.856%0.5626%0.257SS*.THydrogen-bonded Turntrans-75.2-9.8179.8-66.3173.6000114.2L392 I561 M562 T563 K567L392-L565 HydrophobicContact CD1-CB 4.01Å; I561-L565 HydrophobicContact CG2-CD1 4.04Å; I561-L565 VanDerWaalsContact O-CG 3.3Å; I561-L565 WeakPolarHBondContact O-CG 3.2Å; I561-L565 PolarHBondContact O-N 2.73Å; I561-L565 VanDerWaalsContact O-N 3.16Å; M562-L565 PolarHBondContact O-N 2.97Å; T563-L565 VanDerWaalsContact C-N 3.26Å; T563-L565 PolarHBondContact O-N 3.27Å; L565-K567 PolarHBondContact O-N 3.25Å
566I93.6Very high87.3Confident7 Ų755 Ų554%0.03627%0.271CS..  trans-62.5121.4176.2-62.4171000109.2P389 L392 L393 K454 L504 L508 M562 T563 V564P389-I566 HydrophobicContact CB-CG2 4.23Å; L392-I566 HydrophobicContact CB-CG1 3.73Å; L392-I566 HydrophobicContact CD1-CG1 4.44Å; L393-I566 HydrophobicContact CB-CD1 3.94Å; L393-I566 HydrophobicContact CD1-CD1 4.12Å; K454-I566 WeakPolarHBondContact CD-O 3.12Å; K454-I566 WeakPolarHBondContact CE-O 3.34Å; K454-I566 PolarHBondContact NZ-O 2.94Å; L504-I566 HydrophobicContact CD2-CD1 4.5Å; L508-I566 HydrophobicContact CD1-CG2 3.98Å; M562-I566 PolarHBondContact O-N 3.22Å; T563-I566 WeakPolarHBondContact O-CB 3.27Å; T563-I566 WeakPolarHBondContact O-CG1 3.23Å; T563-I566 PolarHBondContact O-N 2.9Å; V564-I566 VanDerWaalsContact C-N 3.29Å; V564-I566 PolarHBondContact O-N 3.13Å
567K88.8Confident86.3Confident118 Ų11860.2 Ų60.251%0.51330%0.296SS..  trans-74.4133.3171.9-67-172.5176.5-174.80109.3E353 P389 L565 N569E353-K567 IonicContact OE1-NZ 3.2Å; E353-K567 PolarHBondContact OE1-NZ 2.97Å; P389-K567 HydrophobicContact CG-CB 4.28Å; L565-K567 PolarHBondContact O-N 3.25Å; K567-N569 VanDerWaalsContact C-N 3.3Å; K567-N569 PolarHBondContact O-N 3.24Å
568E79Confident84.7Confident77 Ų7760 Ų6036%0.3629%0.289SS..  trans-84.266.9-176.6-171.5166.8-146.100111.1K454 L570K454-E568 HydrophobicContact CB-CB 4.06Å; K454-E568 VanDerWaalsContact CB-CD 3.47Å; K454-E568 HydrophobicContact CB-CG 4.02Å; K454-E568 WeakPolarHBondContact CB-OE1 3.46Å; K454-E568 HydrophobicContact CD-CB 3.97Å; K454-E568 PolarHBondContact N-OE1 3Å; E568-L570 HydrophobicContact CG-CD1 3.97Å; E568-L570 HydrophobicContact CG-CD2 4.14Å; E568-L570 HydrophobicContact CG-CG 3.81Å; E568-L570 PolarHBondContact O-N 3.2Å
569N75.9Confident83.5Confident65 Ų6561.3 Ų61.335%0.34829%0.291SS..  trans-9687.1172.2-69.1-2.7000108.7K567 Y571K567-N569 VanDerWaalsContact C-N 3.3Å; K567-N569 PolarHBondContact O-N 3.24Å; N569-Y571 VanDerWaalsContact C-N 3.34Å; N569-Y571 HydrophobicContact CB-CE1 4.27Å; N569-Y571 HydrophobicContact CB-CE2 4.11Å; N569-Y571 WeakPolarHBondContact O-CD2 3.42Å; N569-Y571 PolarHBondContact O-N 2.88Å
570L78.5Confident82.2Confident13 Ų1368.1 Ų68.17%0.06832%0.321CS..  trans-82.275.7-176.8-56177.9000110.8F453 L504 E507 E568 R572 Q573 Q574F453-L570 HydrophobicContact CB-CD1 4.49Å; F453-L570 HydrophobicContact CB-CD2 4.04Å; F453-L570 HydrophobicContact CD2-CD1 4.04Å; F453-L570 HydrophobicContact CD2-CD2 4.41Å; F453-L570 HydrophobicContact CG-CD2 4.21Å; L504-L570 HydrophobicContact CD1-CD2 4.29Å; E507-L570 HydrophobicContact CB-CD2 3.9Å; E507-L570 HydrophobicContact CG-CD2 4.42Å; E568-L570 HydrophobicContact CG-CD1 3.97Å; E568-L570 HydrophobicContact CG-CD2 4.14Å; E568-L570 HydrophobicContact CG-CG 3.81Å; E568-L570 PolarHBondContact O-N 3.2Å; L570-R572 VanDerWaalsContact C-N 3.28Å; L570-R572 PolarHBondContact O-N 2.79Å; L570-Q573 HydrophobicContact CB-CB 4.11Å; L570-Q573 HydrophobicContact CB-CG 4.47Å; L570-Q573 VanDerWaalsContact CD1-OE1 3.3Å; L570-Q573 PolarHBondContact O-N 3.4Å; L570-Q574 VanDerWaalsContact O-CG 3.3Å; L570-Q574 WeakPolarHBondContact O-CG 3.14Å; L570-Q574 PolarHBondContact O-N 3.49Å
571Y73.2Confident80.8Confident48 Ų4873.9 Ų73.919%0.18835%0.345CS..Hα-helixtrans-58.3-36.7-171.9-65.6-65.3000113.5E507 L508 N569 A575E507-Y571 PolarHBondContact O-N 3Å; L508-Y571 WeakPolarHBondContact O-CD2 3.37Å; N569-Y571 VanDerWaalsContact C-N 3.34Å; N569-Y571 HydrophobicContact CB-CE1 4.27Å; N569-Y571 HydrophobicContact CB-CE2 4.11Å; N569-Y571 WeakPolarHBondContact O-CD2 3.42Å; N569-Y571 PolarHBondContact O-N 2.88Å; Y571-A575 WeakPolarHBondContact O-CB 3.4Å; Y571-A575 PolarHBondContact O-N 2.99Å
572R73.6Confident79.3Confident86 Ų8675 Ų7533%0.32535%0.348SS..Hα-helixtrans-72.4-42.2-179.5179.4-176.7-174177.84.9112.1E507 Y510 L570 A575 H576E507-R572 WeakPolarHBondContact OE2-CB 3.29Å; Y510-R572 HydrophobicContact CD2-CB 4.01Å; Y510-R572 HydrophobicContact CD2-CG 4.06Å; Y510-R572 HydrophobicContact CG-CB 3.89Å; Y510-R572 HydrophobicContact CG-CG 4.43Å; L570-R572 VanDerWaalsContact C-N 3.28Å; L570-R572 PolarHBondContact O-N 2.79Å; R572-A575 PolarHBondContact O-N 3.27Å; R572-H576 PolarHBondContact O-CD2 3.24Å; R572-H576 VanDerWaalsContact O-CD2 3.28Å; R572-H576 PolarHBondContact O-N 3.1Å
573Q74.6Confident77.9Confident44 Ų4479 Ų7921%0.20638%0.375CS..Hα-helixtrans-59.1-46.4170.9-77.5-177.511.800112.2E507 L570 A575 H576 E577E507-Q573 WeakPolarHBondContact OE2-CG 3.48Å; E507-Q573 PolarHBondContact OE2-N 3.24Å; L570-Q573 HydrophobicContact CB-CB 4.11Å; L570-Q573 HydrophobicContact CB-CG 4.47Å; L570-Q573 VanDerWaalsContact CD1-OE1 3.3Å; L570-Q573 PolarHBondContact O-N 3.4Å; Q573-A575 VanDerWaalsContact C-N 3.29Å; Q573-A575 PolarHBondContact O-N 3Å; Q573-H576 PolarHBondContact O-N 2.92Å; Q573-E577 WeakPolarHBondContact O-CG 3.07Å; Q573-E577 PolarHBondContact O-N 3.24Å
574Q78.6Confident76.1Confident83 Ų8386.2 Ų86.239%0.38841%0.408SS..Hα-helixtrans-57.7-41.9177.5-70170.9-3.200111.7L570 E577 R578L570-Q574 VanDerWaalsContact O-CG 3.3Å; L570-Q574 WeakPolarHBondContact O-CG 3.14Å; L570-Q574 PolarHBondContact O-N 3.49Å; Q574-E577 PolarHBondContact O-N 3.2Å; Q574-R578 WeakPolarHBondContact O-CG 3.21Å; Q574-R578 PolarHBondContact O-N 3.17Å; Q574-R578 VanDerWaalsContact O-N 3.11Å
575A74.2Confident74.2Confident25 Ų2587.7 Ų87.721%0.20742%0.418CS..Hα-helixtrans-65.5-36.7175.400000113Y510 Y571 R572 Q573 K579Y510-A575 HydrophobicContact CD1-CB 4.48Å; Y510-A575 HydrophobicContact CE1-CB 3.88Å; Y571-A575 WeakPolarHBondContact O-CB 3.4Å; Y571-A575 PolarHBondContact O-N 2.99Å; R572-A575 PolarHBondContact O-N 3.27Å; Q573-A575 VanDerWaalsContact C-N 3.29Å; Q573-A575 PolarHBondContact O-N 3Å; A575-K579 PolarHBondContact O-N 3.32Å
576H76Confident71.8Confident103 Ų10387.7 Ų87.748%0.47742%0.422SS..Hα-helixtrans-70.9-38.5176.5-83.3-57.6000113.1R572 Q573 K580R572-H576 PolarHBondContact O-CD2 3.24Å; R572-H576 VanDerWaalsContact O-CD2 3.28Å; R572-H576 PolarHBondContact O-N 3.1Å; Q573-H576 PolarHBondContact O-N 2.92Å; H576-K580 PolarHBondContact O-N 2.96Å
577E75.1Confident69.4Low111 Ų11191.7 Ų91.752%0.51945%0.449SS..Hα-helixtrans-64.6-45.5176.2-72-179.8166.800110.9Q573 Q574 K579 K580 F581Q573-E577 WeakPolarHBondContact O-CG 3.07Å; Q573-E577 PolarHBondContact O-N 3.24Å; Q574-E577 PolarHBondContact O-N 3.2Å; E577-K579 PolarHBondContact O-N 3.09Å; E577-K580 WeakPolarHBondContact O-CB 3.38Å; E577-K580 PolarHBondContact O-N 2.66Å; E577-K580 VanDerWaalsContact O-N 3.1Å; E577-F581 WeakPolarHBondContact O-CD2 3.39Å; E577-F581 PolarHBondContact O-N 2.73Å
578R66.3Low67.3Low84 Ų8492.6 Ų92.632%0.31746%0.459SS..Hα-helixtrans-57.8-46.1175.8-73.5179.8-174.5-145.9-0.5113.3I357 D361 Q574 K580 F581 E582I357-R578 VanDerWaalsContact CG2-CZ 3.46Å; D361-R578 IonicContact OD1-NH1 3.04Å; D361-R578 IonicContact OD2-NH1 3.7Å; D361-R578 PolarHBondContact OD2-NH1 3.36Å; Q574-R578 WeakPolarHBondContact O-CG 3.21Å; Q574-R578 PolarHBondContact O-N 3.17Å; Q574-R578 VanDerWaalsContact O-N 3.11Å; R578-K580 VanDerWaalsContact C-N 3.26Å; R578-K580 PolarHBondContact O-N 2.92Å; R578-F581 CarbonylContact O-C 3.6Å; R578-F581 WeakPolarHBondContact O-CA 3.47Å; R578-F581 WeakPolarHBondContact O-CB 3.17Å; R578-F581 PolarHBondContact O-N 2.83Å; R578-E582 WeakPolarHBondContact O-CG 3.23Å; R578-E582 PolarHBondContact O-N 3.39Å
579K71.7Confident65.6Low111 Ų11196.5 Ų96.548%0.48348%0.477SS..Hα-helixtrans-59.7-36176-76.5-176.4178.7-178.30112.8A575 E577 T583A575-K579 PolarHBondContact O-N 3.32Å; E577-K579 PolarHBondContact O-N 3.09Å; K579-T583 WeakPolarHBondContact O-CB 3.39Å; K579-T583 PolarHBondContact O-N 3.3Å; K579-T583 PolarHBondContact O-OG1 2.99Å
580K69Low64Low143 Ų143102 Ų10262%0.62250%0.501SS*.Hα-helixtrans-66-42.1174.2-74.6179.2179.2177.30111.2H576 E577 R578 T583 Q584H576-K580 PolarHBondContact O-N 2.96Å; E577-K580 WeakPolarHBondContact O-CB 3.38Å; E577-K580 PolarHBondContact O-N 2.66Å; E577-K580 VanDerWaalsContact O-N 3.1Å; R578-K580 VanDerWaalsContact C-N 3.26Å; R578-K580 PolarHBondContact O-N 2.92Å; K580-T583 PolarHBondContact O-N 3.28Å; K580-Q584 WeakPolarHBondContact O-CB 3.35Å; K580-Q584 VanDerWaalsContact O-CG 3.25Å; K580-Q584 WeakPolarHBondContact O-CG 3.31Å; K580-Q584 PolarHBondContact O-N 3.13Å; K580-Q584 VanDerWaalsContact O-N 3.1Å
581F68.3Low62.2Low133 Ų133105.9 Ų105.958%0.58353%0.525SS*.Hα-helixtrans-61.9-50.5174.7-78.4-71.8000111.5E577 R578 T583 Q584 T585E577-F581 WeakPolarHBondContact O-CD2 3.39Å; E577-F581 PolarHBondContact O-N 2.73Å; R578-F581 CarbonylContact O-C 3.6Å; R578-F581 WeakPolarHBondContact O-CA 3.47Å; R578-F581 WeakPolarHBondContact O-CB 3.17Å; R578-F581 PolarHBondContact O-N 2.83Å; F581-T583 VanDerWaalsContact C-N 3.29Å; F581-T583 PolarHBondContact O-N 3.24Å; F581-Q584 CarbonylContact O-C 3.55Å; F581-Q584 WeakPolarHBondContact O-CA 3.39Å; F581-Q584 PolarHBondContact O-N 3.32Å; F581-T585 WeakPolarHBondContact O-CG2 3.41Å; F581-T585 PolarHBondContact O-N 2.99Å; F581-T585 PolarHBondContact O-OG1 3.32Å
582E67Low60.7Low114 Ų114107.1 Ų107.153%0.53354%0.541SS..Hα-helixtrans-56.9-40.6177.3-70.7169.8179.700112.5R578 Q584 V586R578-E582 WeakPolarHBondContact O-CG 3.23Å; R578-E582 PolarHBondContact O-N 3.39Å; E582-Q584 VanDerWaalsContact C-N 3.26Å; E582-Q584 PolarHBondContact O-N 3.44Å; E582-V586 WeakPolarHBondContact O-CG2 3.3Å; E582-V586 PolarHBondContact O-N 3.35Å
583T64.9Low59.4Low116 Ų116110.1 Ų110.171%0.71256%0.563SS**Hα-helixtrans-70.8-22.9177.6-47.40000112.4K579 K580 F581K579-T583 WeakPolarHBondContact O-CB 3.39Å; K579-T583 PolarHBondContact O-N 3.3Å; K579-T583 PolarHBondContact O-OG1 2.99Å; K580-T583 PolarHBondContact O-N 3.28Å; F581-T583 VanDerWaalsContact C-N 3.29Å; F581-T583 PolarHBondContact O-N 3.24Å
584Q59Low58.1Low153 Ų153116.5 Ų116.572%0.71559%0.593SS**Hα-helixtrans-94-26179.4-73.8177.1-3.300113.2K580 F581 E582K580-Q584 WeakPolarHBondContact O-CB 3.35Å; K580-Q584 VanDerWaalsContact O-CG 3.25Å; K580-Q584 WeakPolarHBondContact O-CG 3.31Å; K580-Q584 PolarHBondContact O-N 3.13Å; K580-Q584 VanDerWaalsContact O-N 3.1Å; F581-Q584 CarbonylContact O-C 3.55Å; F581-Q584 WeakPolarHBondContact O-CA 3.39Å; F581-Q584 PolarHBondContact O-N 3.32Å; E582-Q584 VanDerWaalsContact C-N 3.26Å; E582-Q584 PolarHBondContact O-N 3.44Å
585T54.9Low56.4Low100 Ų100123 Ų12361%0.61361%0.614SS**Hα-helixtrans-94.1-4.9-176.953.90000114.2F581 P587F581-T585 WeakPolarHBondContact O-CG2 3.41Å; F581-T585 PolarHBondContact O-N 2.99Å; F581-T585 PolarHBondContact O-OG1 3.32Å; T585-P587 VanDerWaalsContact O-CD 3.27Å; T585-P587 WeakPolarHBondContact O-CD 3.37Å
586V45.9Very low54.9Low107 Ų107133.1 Ų133.165%0.64867%0.665SS**SBendtrans-94.4101.4168.4-179.90000107.4E582E582-V586 WeakPolarHBondContact O-CG2 3.3Å; E582-V586 PolarHBondContact O-N 3.35Å
587P42Very low53.8Low92 Ų92134.6 Ų134.660%0.59767%0.674SS**  trans-64150.4169.1-9.226.9000108.5T585 E589T585-P587 VanDerWaalsContact O-CD 3.27Å; T585-P587 WeakPolarHBondContact O-CD 3.37Å; P587-E589 PolarHBondContact O-N 3.22Å
588D46.2Very low52.7Low136 Ų136135.8 Ų135.873%0.72768%0.682SS**  trans-6357.9174.8-71.1-48.7000113.1Q590 T591D588-Q590 PolarHBondContact O-N 3.03Å; D588-T591 PolarHBondContact O-N 3.18Å; D588-T591 VanDerWaalsContact O-N 3.15Å; D588-T591 PolarHBondContact O-OG1 3.14Å
589E43.4Very low52Low159 Ų159138.7 Ų138.774%0.74370%0.702SS**THydrogen-bonded Turntrans-66.10.7176.2-98.2-174.4166.300113.3P587P587-E589 PolarHBondContact O-N 3.22Å
590Q42.3Very low50.8Low181 Ų181140.4 Ų140.485%0.84672%0.715SS**THydrogen-bonded Turntrans-102.63.8173.5-72.3-174.8-21.200114.6D588D588-Q590 PolarHBondContact O-N 3.03Å
591T41Very low49.6Very low94 Ų94140.2 Ų140.258%0.57772%0.721SS**SBendtrans-108.30.7176.153.30000115.5D588D588-T591 PolarHBondContact O-N 3.18Å; D588-T591 VanDerWaalsContact O-N 3.15Å; D588-T591 PolarHBondContact O-OG1 3.14Å
592S40.3Very low48.4Very low75 Ų75140.7 Ų140.752%0.52473%0.73SS.*SBendtrans-97.6-10.2177.352.50000115.3
593N46.4Very low47.1Very low148 Ų148142.6 Ų142.679%0.79174%0.744SS**SBendtrans-98.75.1-179.6-80.2-11.8000115.1
594E46.8Very low45.7Very low178 Ų178144.6 Ų144.683%0.83275%0.747SS**SBendtrans-113.317175.9-67.4-171.3156.600113.4
595R43Very low44.6Very low221 Ų221143.9 Ų143.983%0.83475%0.75SS**  trans-124.125.8179.6-72.4-164.8-164.7-176.77.2115.8
596N43.2Very low43.7Very low236 Ų236147.9 Ų147.9100%1.26276%0.762SS**  trans-124.70167.5-82.3-22.2000111.5

Retrieved 596 of 596 residues in 968.1 ms (Link to these results)

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