A0A089G6S0_HUMAN Loading...

C-C chemokine receptor type 5

Receptor for a number of inflammatory CC-chemokines including CCL3/MIP-1-alpha, CCL4/MIP-1-beta and RANTES and subsequently transduces a signal by increasing the intracellular calcium ion level. May play a role in the control of granulocytic lineage proliferation or differentiation. Participates in T-lymphocyte migration to the infection site by acting as a chemotactic receptor.

AlphaFold DB , UniProt , Accession A0A089G6S0, Species HUMAN (Homo sapiens, Human), Gene CCR5, Length 352 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
1M40.1Very low38.9Very low216 Ų216149.5 Ų149.5100%1.06477%0.771SS**  087.60-86.1-171.7-179.500104.7Y3M1-Y3 PolarHBondContact O-N 3.04Å
2D34Very low39Very low156 Ų156149.1 Ų149.183%0.83477%0.768SS**  trans-91.9105.8-167.2-61.4-16.5000108.5Q4D2-Q4 PolarHBondContact O-N 3.4Å
3Y39.7Very low38.9Very low213 Ų213147.2 Ų147.284%0.83576%0.76SS**  trans-80.999.9168-80.7-88.1000108.5M1M1-Y3 PolarHBondContact O-N 3.04Å
4Q35.9Very low38.9Very low177 Ų177151.1 Ų151.183%0.82776%0.763SS**  trans-87.9100.5163-86.6172.7-40.900109.2D2D2-Q4 PolarHBondContact O-N 3.4Å
5V47.8Very low39.1Very low142 Ų142154.7 Ų154.786%0.86177%0.765SS**  trans-92.5100.2157.6178.30000106.6
6S41Very low39.8Very low102 Ų102153.2 Ų153.271%0.71377%0.768SS**  trans-137.397.917264.50000110.8
7S38.6Very low40.2Very low79 Ų79150.5 Ų150.555%0.55277%0.767SS**  trans-170116.1151.8172.50000108.7I9S7-I9 VanDerWaalsContact C-N 3.32Å; S7-I9 VanDerWaalsContact OG-CG1 3.32Å; S7-I9 WeakPolarHBondContact OG-CG1 3.48Å; S7-I9 PolarHBondContact OG-N 3.26Å; S7-I9 VanDerWaalsContact OG-N 3.1Å
8P40.1Very low40.8Very low107 Ų107152.2 Ų152.270%0.69577%0.771SS**  trans-94.571.2154.435.5-23.5000107.4Y10P8-Y10 VanDerWaalsContact C-N 3.33Å; P8-Y10 HydrophobicContact CB-CE2 4.18Å; P8-Y10 PolarHBondContact O-N 3.09Å
9I37.2Very low41.9Very low126 Ų126150.1 Ų150.165%0.64677%0.769SS**  trans-72104151.1-71.9165.5000103.7S7 D11S7-I9 VanDerWaalsContact C-N 3.32Å; S7-I9 VanDerWaalsContact OG-CG1 3.32Å; S7-I9 WeakPolarHBondContact OG-CG1 3.48Å; S7-I9 PolarHBondContact OG-N 3.26Å; S7-I9 VanDerWaalsContact OG-N 3.1Å; I9-D11 PolarHBondContact O-N 3.4Å
10Y38.1Very low43.1Very low207 Ų207144.6 Ų144.681%0.81274%0.744SS**  trans-65.287.7168.5-74.2-87.1000107.4P8 I12P8-Y10 VanDerWaalsContact C-N 3.33Å; P8-Y10 HydrophobicContact CB-CE2 4.18Å; P8-Y10 PolarHBondContact O-N 3.09Å; Y10-I12 PolarHBondContact O-N 3.34Å
11D35.3Very low44.1Very low120 Ų120144.8 Ų144.864%0.64274%0.742SS**  trans-62.3105.1161.1-86.5-27.5000106.6I9 N13I9-D11 PolarHBondContact O-N 3.4Å; D11-N13 PolarHBondContact O-N 3.47Å
12I40.5Very low45.4Very low144 Ų144138.7 Ų138.774%0.73871%0.709SS**  trans-69.680.1166.9-55.7176.9000106.1Y10 Y14Y10-I12 PolarHBondContact O-N 3.34Å; I12-Y14 VanDerWaalsContact C-N 3.31Å; I12-Y14 HydrophobicContact CG2-CD2 3.83Å; I12-Y14 HydrophobicContact CG2-CE2 4.08Å; I12-Y14 PolarHBondContact O-N 2.89Å
13N37.7Very low46.9Very low124 Ų124135.6 Ų135.666%0.66369%0.692SS**  trans-71.285.5174.4-85.1-44.4000109.5D11 Y15D11-N13 PolarHBondContact O-N 3.47Å; N13-Y15 PolarHBondContact O-N 3.5Å
14Y39.1Very low48.3Very low203 Ų203131.5 Ų131.580%0.79668%0.684SS**  trans-76.195.7154.5-93.9-89.7000107.7I12 T16I12-Y14 VanDerWaalsContact C-N 3.31Å; I12-Y14 HydrophobicContact CG2-CD2 3.83Å; I12-Y14 HydrophobicContact CG2-CE2 4.08Å; I12-Y14 PolarHBondContact O-N 2.89Å; Y14-T16 PolarHBondContact O-N 3.13Å; Y14-T16 VanDerWaalsContact O-N 3.17Å
15Y42.1Very low50Low204 Ų204124.5 Ų124.580%0.865%0.654SS**SBendtrans-54.3121.1167.9-104.2-103.9000108.9N13N13-Y15 PolarHBondContact O-N 3.5Å
16T48.9Very low51.2Low131 Ų131123.3 Ų123.380%0.80464%0.637SS**SBendtrans68.679.117758.20000117Y14Y14-T16 PolarHBondContact O-N 3.13Å; Y14-T16 VanDerWaalsContact O-N 3.17Å
17S46.6Very low53.1Low107 Ų107124 Ų12475%0.74863%0.628SS**  trans154.978.1133.3-65.20000108.5P19S17-P19 WeakPolarHBondContact O-CD 3.37Å
18E51.2Low55.1Low181 Ų181125.7 Ų125.785%0.84663%0.63SS**  trans-56.5126.3166.5-75.4-174170.200108.3C20E18-C20 PolarHBondContact O-N 3.47Å; E18-C20 VanDerWaalsContact O-N 3.1Å
19P61.5Low57Low112 Ų112121.5 Ų121.573%0.72760%0.604SS**  trans-59.1121.2175.421-29.1000108.5S17 Q21S17-P19 WeakPolarHBondContact O-CD 3.37Å; P19-Q21 PolarHBondContact O-N 3.14Å
20C66.4Low59.3Low40 Ų40116.8 Ų116.827%0.2758%0.584SS.*  trans-49.4106.5-177.7-173.50000109.8E18 K22 C269E18-C20 PolarHBondContact O-N 3.47Å; E18-C20 VanDerWaalsContact O-N 3.1Å; C20-K22 PolarHBondContact O-N 3.36Å; C20-C269 HydrophobicContact CB-CB 4.1Å; C20-C269 WeakPolarHBondContact CB-SG 3.3Å; C20-C269 WeakPolarHBondContact SG-CB 3.07Å; C20-C269 CovalentContact SG-SG 2.07Å; C20-C269 PolarHBondContact SG-SG 3.31Å
21Q64Low61.7Low150 Ų150117 Ų11770%0.70158%0.584SS**  trans-74.6121.4-171.3-71.7-165.7-13.100111.5P19 I23P19-Q21 PolarHBondContact O-N 3.14Å; Q21-I23 HydrophobicContact CB-CD1 4.38Å; Q21-I23 HydrophobicContact CB-CG1 4.45Å
22K66.9Low64.3Low87 Ų87116.6 Ų116.638%0.37858%0.581SS.*  trans-107.627.5-175.4-54.7-178-167.7174.70114C20 N24 V25 D276C20-K22 PolarHBondContact O-N 3.36Å; K22-N24 PolarHBondContact O-N 3.07Å; K22-V25 PolarHBondContact O-N 3.28Å; K22-D276 HydrophobicContact CD-CB 4.41Å; K22-D276 WeakPolarHBondContact CE-OD2 3.41Å; K22-D276 IonicContact NZ-OD1 3.84Å; K22-D276 PolarHBondContact NZ-OD1 3.02Å; K22-D276 IonicContact NZ-OD2 3.57Å; K22-D276 PolarHBondContact NZ-OD2 3.21Å
23I65.6Low66.6Low91 Ų91110.1 Ų110.147%0.46755%0.548SS..Hα-helixtrans-56.5-45.4-166-61.5168.8000112.6Q21 V25 K26 H27Q21-I23 HydrophobicContact CB-CD1 4.38Å; Q21-I23 HydrophobicContact CB-CG1 4.45Å; I23-V25 VanDerWaalsContact C-N 3.33Å; I23-V25 PolarHBondContact O-N 3.42Å; I23-K26 PolarHBondContact O-N 3.04Å; I23-H27 PolarHBondContact O-CD2 3.17Å; I23-H27 PolarHBondContact O-N 3.41Å
24N68.9Low69.3Low128 Ų128105.3 Ų105.368%0.68452%0.523SS*.Hα-helixtrans-64.3-33.7-176.5-70.9-15.4000113.8K22 I28K22-N24 PolarHBondContact O-N 3.07Å; N24-I28 WeakPolarHBondContact O-CG1 3.23Å; N24-I28 PolarHBondContact O-N 3.3Å
25V72.2Confident71.9Confident30 Ų3099.3 Ų99.318%0.18251%0.509CS..Hα-helixtrans-72.5-42.4-176.7-175.10000110.7K22 I23 H27 I28 A29 Q277K22-V25 PolarHBondContact O-N 3.28Å; I23-V25 VanDerWaalsContact C-N 3.33Å; I23-V25 PolarHBondContact O-N 3.42Å; V25-H27 VanDerWaalsContact C-N 3.35Å; V25-H27 PolarHBondContact O-N 3.31Å; V25-I28 PolarHBondContact O-N 3.15Å; V25-A29 WeakPolarHBondContact O-CB 3.3Å; V25-A29 PolarHBondContact O-N 3.02Å; V25-Q277 HydrophobicContact CB-CG 4.27Å; V25-Q277 HydrophobicContact CG1-CG 3.81Å; V25-Q277 HydrophobicContact CG2-CG 3.41Å; V25-Q277 VanDerWaalsContact CG2-CG 3.41Å
26K73.8Confident74.3Confident116 Ų11692.3 Ų92.350%0.50449%0.485SS..Hα-helixtrans-62.7-41.2-179.8-168.6177.7179-176.90111.6I23 A29 A30I23-K26 PolarHBondContact O-N 3.04Å; K26-A29 PolarHBondContact O-N 2.84Å; K26-A30 VanDerWaalsContact O-CB 3.27Å; K26-A30 WeakPolarHBondContact O-CB 3.38Å; K26-A30 PolarHBondContact O-N 3.38Å
27H79.7Confident76.5Confident117 Ų11786.3 Ų86.354%0.54245%0.448SS..Hα-helixtrans-66.9-39.3178.3-74.4-62.9000113.5I23 V25 R31I23-H27 PolarHBondContact O-CD2 3.17Å; I23-H27 PolarHBondContact O-N 3.41Å; V25-H27 VanDerWaalsContact C-N 3.35Å; V25-H27 PolarHBondContact O-N 3.31Å; H27-R31 PolarHBondContact O-N 2.82Å
28I80.6Confident78.8Confident115 Ų11584 Ų8459%0.5943%0.432SS*.Hα-helixtrans-67.6-46.2176.5-66169.5000110N24 V25 A30 R31 L32N24-I28 WeakPolarHBondContact O-CG1 3.23Å; N24-I28 PolarHBondContact O-N 3.3Å; V25-I28 PolarHBondContact O-N 3.15Å; I28-A30 VanDerWaalsContact C-N 3.33Å; I28-A30 PolarHBondContact O-N 3.27Å; I28-R31 PolarHBondContact O-N 3.11Å; I28-L32 WeakPolarHBondContact O-CB 3.17Å; I28-L32 PolarHBondContact O-N 3.08Å
29A81.4Confident80.9Confident18 Ų1879.6 Ų79.615%0.14941%0.414CS..Hα-helixtrans-58.2-44.4176.500000111.8V25 K26 R31 L32 L33V25-A29 WeakPolarHBondContact O-CB 3.3Å; V25-A29 PolarHBondContact O-N 3.02Å; K26-A29 PolarHBondContact O-N 2.84Å; A29-R31 PolarHBondContact O-N 3.29Å; A29-L32 PolarHBondContact O-N 3.5Å; A29-L33 HydrophobicContact CB-CD1 3.78Å; A29-L33 HydrophobicContact CB-CG 4.26Å; A29-L33 VanDerWaalsContact O-CB 3.26Å; A29-L33 WeakPolarHBondContact O-CB 3.29Å; A29-L33 VanDerWaalsContact O-CG 3.23Å; A29-L33 WeakPolarHBondContact O-CG 3.44Å; A29-L33 PolarHBondContact O-N 3.34Å
30A84.3Confident82.5Confident28 Ų2874.6 Ų74.623%0.23138%0.381CS..Hα-helixtrans-63.1-26.1179.200000114.2K26 I28 P34 A90K26-A30 VanDerWaalsContact O-CB 3.27Å; K26-A30 WeakPolarHBondContact O-CB 3.38Å; K26-A30 PolarHBondContact O-N 3.38Å; I28-A30 VanDerWaalsContact C-N 3.33Å; I28-A30 PolarHBondContact O-N 3.27Å; A30-P34 VanDerWaalsContact O-CD 3.27Å; A30-P34 WeakPolarHBondContact O-CD 3.49Å; A30-P34 VanDerWaalsContact O-CG 3.28Å; A30-P34 WeakPolarHBondContact O-CG 3.32Å; A30-A90 WeakPolarHBondContact CA-O 3.15Å; A30-A90 WeakPolarHBondContact CB-O 3.14Å
31R88.4Confident83.9Confident212 Ų21275.5 Ų75.580%0.838%0.381SS*.Hα-helixtrans-88.1-36176.1-69.9-177-178.2-178.91.8113H27 I28 A29 P35H27-R31 PolarHBondContact O-N 2.82Å; I28-R31 PolarHBondContact O-N 3.11Å; A29-R31 PolarHBondContact O-N 3.29Å; R31-P35 WeakPolarHBondContact O-CD 3.44Å; R31-P35 WeakPolarHBondContact O-CG 3.35Å
32L89.7Confident85.4Confident110 Ų11073 Ų7358%0.57637%0.371SS*.Hα-helixtrans-90.6-40.3-172.1-170.871.9000113.4I28 A29 P35 L36I28-L32 WeakPolarHBondContact O-CB 3.17Å; I28-L32 PolarHBondContact O-N 3.08Å; A29-L32 PolarHBondContact O-N 3.5Å; L32-P35 WeakPolarHBondContact O-CD 3.2Å; L32-P35 WeakPolarHBondContact O-CG 3.47Å; L32-L36 WeakPolarHBondContact O-CB 3.36Å; L32-L36 PolarHBondContact O-N 3.39Å
33L90.6Very high86.7Confident8 Ų874.7 Ų74.74%0.04238%0.379CS..Hα-helixtrans-68.7-44.3-172.7-61.5178.1000113.4A29 L36 Y37 A90 Q280 T284A29-L33 HydrophobicContact CB-CD1 3.78Å; A29-L33 HydrophobicContact CB-CG 4.26Å; A29-L33 VanDerWaalsContact O-CB 3.26Å; A29-L33 WeakPolarHBondContact O-CB 3.29Å; A29-L33 VanDerWaalsContact O-CG 3.23Å; A29-L33 WeakPolarHBondContact O-CG 3.44Å; A29-L33 PolarHBondContact O-N 3.34Å; L33-L36 PolarHBondContact O-N 3.25Å; L33-Y37 HydrophobicContact CB-CD2 4.39Å; L33-Y37 HydrophobicContact CB-CE2 4.12Å; L33-Y37 HydrophobicContact CD2-CE1 4.27Å; L33-Y37 VanDerWaalsContact O-CB 3.3Å; L33-Y37 WeakPolarHBondContact O-CB 3.48Å; L33-Y37 PolarHBondContact O-N 3.2Å; L33-A90 HydrophobicContact CB-CB 3.9Å; L33-A90 HydrophobicContact CD1-CB 3.93Å; L33-Q280 HydrophobicContact CD1-CG 4.4Å; L33-Q280 VanDerWaalsContact CD1-NE2 3.3Å; L33-T284 HydrophobicContact CD2-CG2 3.53Å; L33-T284 WeakPolarHBondContact CD2-OG1 3.41Å
34P92.8Very high88.1Confident23 Ų2370.4 Ų70.415%0.14936%0.356CS..Hα-helixtrans-59.2-48.4-177.6-22.633.2000114.9A30 S38 A91A30-P34 VanDerWaalsContact O-CD 3.27Å; A30-P34 WeakPolarHBondContact O-CD 3.49Å; A30-P34 VanDerWaalsContact O-CG 3.28Å; A30-P34 WeakPolarHBondContact O-CG 3.32Å; P34-S38 WeakPolarHBondContact O-CB 3.28Å; P34-S38 PolarHBondContact O-N 3.01Å; P34-S38 PolarHBondContact O-OG 3.46Å; P34-A91 HydrophobicContact CB-CB 4.44Å; P34-A91 HydrophobicContact CG-CB 3.69Å
35P94.3Very high89.4Confident78 Ų7867.9 Ų67.951%0.50634%0.34SS..Hα-helixtrans-66.8-37.317725.3-32.8000112R31 L32 S38 L39R31-P35 WeakPolarHBondContact O-CD 3.44Å; R31-P35 WeakPolarHBondContact O-CG 3.35Å; L32-P35 WeakPolarHBondContact O-CD 3.2Å; L32-P35 WeakPolarHBondContact O-CG 3.47Å; P35-S38 PolarHBondContact O-N 2.96Å; P35-L39 PolarHBondContact O-N 2.93Å
36L93.8Very high90.5Very high56 Ų5670.9 Ų70.929%0.29336%0.358SS..Hα-helixtrans-63.8-48.7177.217962.4000111.8L32 L33 S38 L39 V40 T284L32-L36 WeakPolarHBondContact O-CB 3.36Å; L32-L36 PolarHBondContact O-N 3.39Å; L33-L36 PolarHBondContact O-N 3.25Å; L36-S38 VanDerWaalsContact C-N 3.31Å; L36-S38 PolarHBondContact O-N 3.16Å; L36-L39 WeakPolarHBondContact O-CB 3.45Å; L36-L39 PolarHBondContact O-N 3.22Å; L36-L39 VanDerWaalsContact O-N 3.17Å; L36-V40 VanDerWaalsContact O-CG2 3.32Å; L36-V40 WeakPolarHBondContact O-CG2 3.45Å; L36-V40 PolarHBondContact O-N 3.42Å; L36-T284 HydrophobicContact CD2-CG2 3.47Å; L36-T284 VanDerWaalsContact CD2-CG2 3.47Å
37Y94.3Very high91.4Very high5 Ų566.1 Ų66.12%0.0234%0.341CS..Hα-helixtrans-64.7-35.6177.7-74.2-4.1000112.2L33 L39 V40 F41 V83 W86 A87 T284 M287L33-Y37 HydrophobicContact CB-CD2 4.39Å; L33-Y37 HydrophobicContact CB-CE2 4.12Å; L33-Y37 HydrophobicContact CD2-CE1 4.27Å; L33-Y37 VanDerWaalsContact O-CB 3.3Å; L33-Y37 WeakPolarHBondContact O-CB 3.48Å; L33-Y37 PolarHBondContact O-N 3.2Å; Y37-L39 VanDerWaalsContact C-N 3.33Å; Y37-L39 PolarHBondContact O-N 3.38Å; Y37-V40 PolarHBondContact O-N 3.3Å; Y37-F41 WeakPolarHBondContact O-CB 3.4Å; Y37-F41 PolarHBondContact O-N 2.9Å; Y37-V83 HydrophobicContact CG-CG1 4.04Å; Y37-V83 VanDerWaalsContact O-CG1 3.32Å; Y37-V83 WeakPolarHBondContact O-CG1 3.37Å; Y37-W86 HydrophobicContact CD2-CB 4.29Å; Y37-W86 HydrophobicContact CE2-CB 4.13Å; Y37-A87 HydrophobicContact CD2-CB 4.08Å; Y37-A87 HydrophobicContact CG-CB 4.48Å; Y37-T284 HydrophobicContact CE1-CG2 3.92Å; Y37-T284 PolarHBondContact OH-OG1 3.47Å; Y37-M287 HydrophobicContact CE1-CB 4.2Å; Y37-M287 HydrophobicContact CE1-SD 3.67Å; Y37-M287 HydrophobicContact CE2-SD 3.86Å; Y37-M287 PolarHBondContact OH-SD 3.3Å
38S94.5Very high92.2Very high60 Ų6060.6 Ų60.642%0.4232%0.316SS..Hα-helixtrans-61.5-42.9172.1-59.20000111.5P34 P35 L36 F41 I42P34-S38 WeakPolarHBondContact O-CB 3.28Å; P34-S38 PolarHBondContact O-N 3.01Å; P34-S38 PolarHBondContact O-OG 3.46Å; P35-S38 PolarHBondContact O-N 2.96Å; L36-S38 VanDerWaalsContact C-N 3.31Å; L36-S38 PolarHBondContact O-N 3.16Å; S38-F41 PolarHBondContact O-N 3.47Å; S38-I42 VanDerWaalsContact O-CG1 3.3Å; S38-I42 WeakPolarHBondContact O-CG1 3.4Å; S38-I42 PolarHBondContact O-N 3.05Å
39L94.9Very high92.8Very high87 Ų8758.2 Ų58.246%0.45530%0.303SS..Hα-helixtrans-64.7-44.7176.6-16769000111.9P35 L36 Y37 F41 I42 F43P35-L39 PolarHBondContact O-N 2.93Å; L36-L39 WeakPolarHBondContact O-CB 3.45Å; L36-L39 PolarHBondContact O-N 3.22Å; L36-L39 VanDerWaalsContact O-N 3.17Å; Y37-L39 VanDerWaalsContact C-N 3.33Å; Y37-L39 PolarHBondContact O-N 3.38Å; L39-F41 VanDerWaalsContact C-N 3.31Å; L39-F41 PolarHBondContact O-N 3.46Å; L39-I42 PolarHBondContact O-N 3.27Å; L39-F43 HydrophobicContact CD1-CD2 3.85Å; L39-F43 HydrophobicContact CD1-CE2 3.26Å; L39-F43 HydrophobicContact CD1-CZ 4Å; L39-F43 HydrophobicContact CD2-CD2 4.47Å; L39-F43 HydrophobicContact CD2-CE2 4.06Å; L39-F43 HydrophobicContact CG-CD2 3.69Å; L39-F43 HydrophobicContact CG-CE2 3.49Å; L39-F43 VanDerWaalsContact CG-CE2 3.49Å; L39-F43 WeakPolarHBondContact O-CD2 3.37Å; L39-F43 PolarHBondContact O-N 3.38Å
40V95.2Very high93.3Very high7 Ų759.1 Ų59.14%0.04231%0.305CS..Hα-helixtrans-59.6-43.6175.31710000110.6L36 Y37 G44 L80 T288 C291L36-V40 VanDerWaalsContact O-CG2 3.32Å; L36-V40 WeakPolarHBondContact O-CG2 3.45Å; L36-V40 PolarHBondContact O-N 3.42Å; Y37-V40 PolarHBondContact O-N 3.3Å; V40-G44 WeakPolarHBondContact O-CA 3.38Å; V40-G44 PolarHBondContact O-N 3.15Å; V40-L80 HydrophobicContact CG1-CD2 4.27Å; V40-T288 HydrophobicContact CG2-CG2 3.74Å; V40-C291 HydrophobicContact CG1-CB 4.5Å
41F96.1Very high93.7Very high60 Ų6057.9 Ų57.926%0.26330%0.295SS..Hα-helixtrans-61-50177179-103.8000111.7Y37 S38 L39 F45 L80 V83 P84Y37-F41 WeakPolarHBondContact O-CB 3.4Å; Y37-F41 PolarHBondContact O-N 2.9Å; S38-F41 PolarHBondContact O-N 3.47Å; L39-F41 VanDerWaalsContact C-N 3.31Å; L39-F41 PolarHBondContact O-N 3.46Å; F41-F45 HydrophobicContact CE2-CD2 4.34Å; F41-F45 HydrophobicContact CZ-CD2 4.32Å; F41-F45 WeakPolarHBondContact O-CB 3.49Å; F41-F45 PolarHBondContact O-N 2.95Å; F41-L80 HydrophobicContact CD2-CB 4.47Å; F41-L80 VanDerWaalsContact CD2-O 3.31Å; F41-L80 WeakPolarHBondContact CD2-O 3.32Å; F41-V83 HydrophobicContact CB-CG1 4.34Å; F41-P84 HydrophobicContact CD1-CG 4.34Å; F41-P84 HydrophobicContact CD2-CG 3.7Å; F41-P84 HydrophobicContact CE1-CG 4.46Å; F41-P84 HydrophobicContact CE2-CG 3.84Å; F41-P84 HydrophobicContact CG-CG 3.96Å; F41-P84 HydrophobicContact CZ-CG 4.22Å
42I95.4Very high94Very high96 Ų9648.9 Ų48.949%0.49226%0.262SS..Hα-helixtrans-60.7-54.7-178.7-68.1165.2000110.9S38 L39 V46S38-I42 VanDerWaalsContact O-CG1 3.3Å; S38-I42 WeakPolarHBondContact O-CG1 3.4Å; S38-I42 PolarHBondContact O-N 3.05Å; L39-I42 PolarHBondContact O-N 3.27Å; I42-V46 WeakPolarHBondContact O-CB 3.34Å; I42-V46 VanDerWaalsContact O-CG2 3.3Å; I42-V46 WeakPolarHBondContact O-CG2 3.39Å; I42-V46 PolarHBondContact O-N 2.92Å; I42-V46 VanDerWaalsContact O-N 3.11Å
43F94.3Very high94.1Very high124 Ų12447.3 Ų47.354%0.54425%0.254SS..Hα-helixtrans-68.5-40.1-177.8-70.8-51.1000112.4L39 G47 C291L39-F43 HydrophobicContact CD1-CD2 3.85Å; L39-F43 HydrophobicContact CD1-CE2 3.26Å; L39-F43 HydrophobicContact CD1-CZ 4Å; L39-F43 HydrophobicContact CD2-CD2 4.47Å; L39-F43 HydrophobicContact CD2-CE2 4.06Å; L39-F43 HydrophobicContact CG-CD2 3.69Å; L39-F43 HydrophobicContact CG-CE2 3.49Å; L39-F43 VanDerWaalsContact CG-CE2 3.49Å; L39-F43 WeakPolarHBondContact O-CD2 3.37Å; L39-F43 PolarHBondContact O-N 3.38Å; F43-G47 WeakPolarHBondContact O-CA 3.3Å; F43-G47 PolarHBondContact O-N 3.31Å; F43-C291 HydrophobicContact CB-CB 4.42Å
44G95.3Very high94Very high0 Ų046.9 Ų46.90%025%0.252CS..Hα-helixtrans-64.8-45.4178.400000112V40 N48 L80 C291V40-G44 WeakPolarHBondContact O-CA 3.38Å; V40-G44 PolarHBondContact O-N 3.15Å; G44-N48 VanDerWaalsContact O-CB 3.29Å; G44-N48 WeakPolarHBondContact O-CB 2.95Å; G44-N48 PolarHBondContact O-N 3.12Å; G44-N48 PolarHBondContact O-ND2 3.13Å; G44-L80 WeakPolarHBondContact O-CD1 3.35Å; G44-C291 VanDerWaalsContact CA-CB 3.49Å
45F96Very high93.8Very high75 Ų7546 Ų4633%0.32925%0.246SC..Hα-helixtrans-66.1-51.3-179.1-172.3-92.3000111.1F41 G47 M49 L77F41-F45 HydrophobicContact CE2-CD2 4.34Å; F41-F45 HydrophobicContact CZ-CD2 4.32Å; F41-F45 WeakPolarHBondContact O-CB 3.49Å; F41-F45 PolarHBondContact O-N 2.95Å; F45-G47 VanDerWaalsContact C-N 3.35Å; F45-G47 PolarHBondContact O-N 2.71Å; F45-M49 HydrophobicContact CD1-CG 4.17Å; F45-M49 HydrophobicContact CD2-CE 4.36Å; F45-M49 HydrophobicContact CE1-CE 4.31Å; F45-M49 HydrophobicContact CE1-CG 3.94Å; F45-M49 HydrophobicContact CE2-CE 3.57Å; F45-M49 HydrophobicContact CE2-CG 4.48Å; F45-M49 HydrophobicContact CZ-CE 3.54Å; F45-M49 HydrophobicContact CZ-CG 4.12Å; F45-M49 VanDerWaalsContact O-CB 3.25Å; F45-M49 WeakPolarHBondContact O-CB 3.24Å; F45-M49 WeakPolarHBondContact O-CG 3.35Å; F45-M49 PolarHBondContact O-N 3.08Å; F45-L77 HydrophobicContact CD2-CD2 3.95Å; F45-L77 HydrophobicContact CE2-CD2 4.35Å
46V94.6Very high93.6Very high94 Ų9446 Ų4657%0.5724%0.241SC*.Hα-helixtrans-61.5-44.9178.7175.20000110.9I42 L50I42-V46 WeakPolarHBondContact O-CB 3.34Å; I42-V46 VanDerWaalsContact O-CG2 3.3Å; I42-V46 WeakPolarHBondContact O-CG2 3.39Å; I42-V46 PolarHBondContact O-N 2.92Å; I42-V46 VanDerWaalsContact O-N 3.11Å; V46-L50 WeakPolarHBondContact O-CB 3.48Å; V46-L50 PolarHBondContact O-N 2.9Å
47G93.5Very high93.2Very high15 Ų1547.8 Ų47.816%0.15525%0.251CS..Hα-helixtrans-62.6-51.6-179.700000112.7F43 F45 L50 V51 P294F43-G47 WeakPolarHBondContact O-CA 3.3Å; F43-G47 PolarHBondContact O-N 3.31Å; F45-G47 VanDerWaalsContact C-N 3.35Å; F45-G47 PolarHBondContact O-N 2.71Å; G47-L50 PolarHBondContact O-N 2.86Å; G47-V51 WeakPolarHBondContact O-CG2 3.2Å; G47-V51 PolarHBondContact O-N 2.64Å; G47-P294 VanDerWaalsContact C-CG 3.41Å
48N95.6Very high92.7Very high1 Ų149.6 Ų49.61%0.00526%0.263CS..Hα-helixtrans-69.8-36.3-178.4-74.2-62.6000112.2G44 L50 V51 I52 A73 L77 C290G44-N48 VanDerWaalsContact O-CB 3.29Å; G44-N48 WeakPolarHBondContact O-CB 2.95Å; G44-N48 PolarHBondContact O-N 3.12Å; G44-N48 PolarHBondContact O-ND2 3.13Å; N48-L50 VanDerWaalsContact C-N 3.33Å; N48-L50 PolarHBondContact O-N 3.41Å; N48-V51 WeakPolarHBondContact O-CB 3.4Å; N48-V51 PolarHBondContact O-N 2.93Å; N48-I52 WeakPolarHBondContact O-CG1 3.36Å; N48-I52 PolarHBondContact O-N 3.35Å; N48-A73 HydrophobicContact CB-CB 4.49Å; N48-L77 HydrophobicContact CB-CD2 3.97Å; N48-L77 HydrophobicContact CB-CG 4.1Å; N48-C290 PolarHBondContact ND2-O 3.37Å
49M94.8Very high92.1Very high65 Ų6548.6 Ų48.632%0.3225%0.251SS..Hα-helixtrans-61.7-41.7171.8-73.9-62177.700111.9F45 V51 I52 L53 L77F45-M49 HydrophobicContact CD1-CG 4.17Å; F45-M49 HydrophobicContact CD2-CE 4.36Å; F45-M49 HydrophobicContact CE1-CE 4.31Å; F45-M49 HydrophobicContact CE1-CG 3.94Å; F45-M49 HydrophobicContact CE2-CE 3.57Å; F45-M49 HydrophobicContact CE2-CG 4.48Å; F45-M49 HydrophobicContact CZ-CE 3.54Å; F45-M49 HydrophobicContact CZ-CG 4.12Å; F45-M49 VanDerWaalsContact O-CB 3.25Å; F45-M49 WeakPolarHBondContact O-CB 3.24Å; F45-M49 WeakPolarHBondContact O-CG 3.35Å; F45-M49 PolarHBondContact O-N 3.08Å; M49-V51 VanDerWaalsContact C-N 3.33Å; M49-V51 PolarHBondContact O-N 3.48Å; M49-I52 PolarHBondContact O-N 2.99Å; M49-I52 HydrophobicContact SD-CD1 4.46Å; M49-L53 WeakPolarHBondContact O-CB 3.37Å; M49-L53 VanDerWaalsContact O-CG 3.31Å; M49-L53 WeakPolarHBondContact O-CG 3.14Å; M49-L53 PolarHBondContact O-N 3.35Å; M49-L77 HydrophobicContact CE-CD1 3.45Å; M49-L77 VanDerWaalsContact CE-CD1 3.45Å; M49-L77 HydrophobicContact CE-CD2 3.9Å; M49-L77 HydrophobicContact CE-CG 4.33Å; M49-L77 HydrophobicContact CG-CD2 4.39Å; M49-L77 HydrophobicContact SD-CD1 3.87Å
50L92.1Very high91.7Very high37 Ų3753.1 Ų53.119%0.19426%0.263CS..Hα-helixtrans-63-40.5175.6-175.961.9000111.8V46 G47 N48 L53 I54 L308 F311V46-L50 WeakPolarHBondContact O-CB 3.48Å; V46-L50 PolarHBondContact O-N 2.9Å; G47-L50 PolarHBondContact O-N 2.86Å; N48-L50 VanDerWaalsContact C-N 3.33Å; N48-L50 PolarHBondContact O-N 3.41Å; L50-L53 PolarHBondContact O-N 2.73Å; L50-I54 HydrophobicContact CD1-CD1 4.06Å; L50-I54 HydrophobicContact CD1-CG1 4.35Å; L50-I54 HydrophobicContact CG-CD1 3.89Å; L50-I54 WeakPolarHBondContact O-CB 3.45Å; L50-I54 VanDerWaalsContact O-CG1 3.31Å; L50-I54 WeakPolarHBondContact O-CG1 3.43Å; L50-I54 PolarHBondContact O-N 2.76Å; L50-L308 HydrophobicContact CD2-CD1 3.57Å; L50-L308 HydrophobicContact CD2-CG 4.24Å; L50-L308 HydrophobicContact CG-CD1 4.48Å; L50-F311 HydrophobicContact CD1-CD1 3.69Å; L50-F311 HydrophobicContact CD1-CE1 3.58Å; L50-F311 HydrophobicContact CD1-CZ 4.36Å
51V92.3Very high91.4Very high2 Ų255.1 Ų55.11%0.01227%0.273CS..Hα-helixtrans-58.2-50.4174.2172.20000110.6G47 N48 M49 L53 I54 L55 A73 P294 Y297 F304G47-V51 WeakPolarHBondContact O-CG2 3.2Å; G47-V51 PolarHBondContact O-N 2.64Å; N48-V51 WeakPolarHBondContact O-CB 3.4Å; N48-V51 PolarHBondContact O-N 2.93Å; M49-V51 VanDerWaalsContact C-N 3.33Å; M49-V51 PolarHBondContact O-N 3.48Å; V51-L53 PolarHBondContact O-N 3.31Å; V51-I54 PolarHBondContact O-N 2.72Å; V51-L55 HydrophobicContact CG1-CD1 3.79Å; V51-L55 HydrophobicContact CG1-CG 4.25Å; V51-L55 WeakPolarHBondContact O-CB 3.32Å; V51-L55 VanDerWaalsContact O-CG 3.25Å; V51-L55 WeakPolarHBondContact O-CG 3.38Å; V51-L55 PolarHBondContact O-N 3.47Å; V51-A73 HydrophobicContact CB-CB 4.45Å; V51-A73 HydrophobicContact CG1-CB 4.05Å; V51-P294 HydrophobicContact CG2-CB 4.11Å; V51-P294 HydrophobicContact CG2-CG 4.18Å; V51-Y297 HydrophobicContact CG1-CD2 4.31Å; V51-Y297 HydrophobicContact CG1-CE2 4.21Å; V51-Y297 HydrophobicContact CG2-CD2 3.7Å; V51-Y297 HydrophobicContact CG2-CE2 4.16Å; V51-F304 HydrophobicContact CB-CE2 4.35Å; V51-F304 HydrophobicContact CB-CZ 4.39Å; V51-F304 HydrophobicContact CG1-CE2 4.45Å; V51-F304 HydrophobicContact CG2-CE2 3.94Å; V51-F304 HydrophobicContact CG2-CZ 3.62Å
52I94.2Very high90.9Very high24 Ų2459.8 Ų59.812%0.12329%0.293CS..Hα-helixtrans-57.8-48.6178.6-68.5168.1000110.9N48 M49 I54 L55 I56 L70 A73 I74 L77N48-I52 WeakPolarHBondContact O-CG1 3.36Å; N48-I52 PolarHBondContact O-N 3.35Å; M49-I52 PolarHBondContact O-N 2.99Å; M49-I52 HydrophobicContact SD-CD1 4.46Å; I52-I54 PolarHBondContact O-N 3.14Å; I52-L55 PolarHBondContact O-N 3.42Å; I52-I56 HydrophobicContact CG2-CD1 3.67Å; I52-I56 HydrophobicContact CG2-CG1 4.48Å; I52-I56 WeakPolarHBondContact O-CG1 3.24Å; I52-I56 PolarHBondContact O-N 3.16Å; I52-L70 HydrophobicContact CB-CD1 4.27Å; I52-L70 HydrophobicContact CG1-CD1 3.98Å; I52-L70 HydrophobicContact CG2-CD1 3.94Å; I52-A73 HydrophobicContact CD1-CB 4.22Å; I52-A73 HydrophobicContact CG1-CB 3.79Å; I52-I74 HydrophobicContact CD1-CG1 4.25Å; I52-L77 HydrophobicContact CD1-CD1 3.36Å; I52-L77 HydrophobicContact CD1-CG 4.39Å
53L91.3Very high90.6Very high76 Ų7657 Ų5740%0.39828%0.282SS..Hα-helixtrans-59.8-43.2179.3-72.8171.5000112.3M49 L50 V51 N57 F311M49-L53 WeakPolarHBondContact O-CB 3.37Å; M49-L53 VanDerWaalsContact O-CG 3.31Å; M49-L53 WeakPolarHBondContact O-CG 3.14Å; M49-L53 PolarHBondContact O-N 3.35Å; L50-L53 PolarHBondContact O-N 2.73Å; V51-L53 PolarHBondContact O-N 3.31Å; L53-N57 WeakPolarHBondContact O-CB 3.25Å; L53-N57 PolarHBondContact O-N 3.5Å; L53-N57 PolarHBondContact O-ND2 2.65Å; L53-F311 HydrophobicContact CD1-CZ 4.31Å
54I88.2Confident90.4Very high0 Ų052 Ų520%026%0.26CS..Iπ-helixtrans-66.3-42.2177.7-72.1168.8000110.9L50 V51 I52 C58 K59 F304 Y307 L308L50-I54 HydrophobicContact CD1-CD1 4.06Å; L50-I54 HydrophobicContact CD1-CG1 4.35Å; L50-I54 HydrophobicContact CG-CD1 3.89Å; L50-I54 WeakPolarHBondContact O-CB 3.45Å; L50-I54 VanDerWaalsContact O-CG1 3.31Å; L50-I54 WeakPolarHBondContact O-CG1 3.43Å; L50-I54 PolarHBondContact O-N 2.76Å; V51-I54 PolarHBondContact O-N 2.72Å; I52-I54 PolarHBondContact O-N 3.14Å; I54-C58 HydrophobicContact CG2-CB 4.3Å; I54-C58 WeakPolarHBondContact O-CA 3.29Å; I54-C58 VanDerWaalsContact O-CB 3.24Å; I54-C58 WeakPolarHBondContact O-CB 3.45Å; I54-C58 PolarHBondContact O-N 3.48Å; I54-K59 PolarHBondContact O-N 2.89Å; I54-F304 HydrophobicContact CB-CE2 4.1Å; I54-F304 HydrophobicContact CD1-CD2 4.46Å; I54-F304 HydrophobicContact CD1-CE1 4.28Å; I54-F304 HydrophobicContact CD1-CE2 3.71Å; I54-F304 HydrophobicContact CD1-CZ 3.61Å; I54-F304 HydrophobicContact CG2-CD2 4.11Å; I54-F304 HydrophobicContact CG2-CE2 3.96Å; I54-Y307 HydrophobicContact CG2-CG 4.33Å; I54-L308 HydrophobicContact CD1-CB 4Å; I54-L308 HydrophobicContact CD1-CD1 4.41Å; I54-L308 HydrophobicContact CD1-CG 4.43Å
55L89.4Confident90.2Very high3 Ų352.8 Ų52.82%0.01627%0.265CS..Iπ-helixtrans-64.5-42-179.5-71.3177.5000112.1V51 I52 K59 R60 L61 D66 L69 L70V51-L55 HydrophobicContact CG1-CD1 3.79Å; V51-L55 HydrophobicContact CG1-CG 4.25Å; V51-L55 WeakPolarHBondContact O-CB 3.32Å; V51-L55 VanDerWaalsContact O-CG 3.25Å; V51-L55 WeakPolarHBondContact O-CG 3.38Å; V51-L55 PolarHBondContact O-N 3.47Å; I52-L55 PolarHBondContact O-N 3.42Å; L55-K59 HydrophobicContact CD2-CD 3.95Å; L55-K59 CarbonylContact O-C 3.59Å; L55-R60 PolarHBondContact O-N 3.4Å; L55-L61 HydrophobicContact CB-CD2 3.93Å; L55-L61 PolarHBondContact O-N 3.48Å; L55-D66 HydrophobicContact CD2-CB 4.33Å; L55-L69 HydrophobicContact CD1-CB 3.89Å; L55-L70 HydrophobicContact CD1-CB 4.01Å
56I90.1Very high90Very high80 Ų8050 Ų5041%0.4125%0.254SS..Iπ-helixtrans-76.2-53.7179.9-63.9173.2000110.9I52 R60 L61 L70I52-I56 HydrophobicContact CG2-CD1 3.67Å; I52-I56 HydrophobicContact CG2-CG1 4.48Å; I52-I56 WeakPolarHBondContact O-CG1 3.24Å; I52-I56 PolarHBondContact O-N 3.16Å; I56-R60 WeakPolarHBondContact O-CA 3.31Å; I56-R60 PolarHBondContact O-N 2.89Å; I56-L61 HydrophobicContact CG1-CD1 4.39Å; I56-L70 HydrophobicContact CD1-CD1 4.4Å; I56-L70 HydrophobicContact CG1-CD1 4.39Å
57N85.9Confident90Very high93 Ų9346 Ų4650%0.49723%0.229SC..Iπ-helixtrans-84.3-37.5-168.4-62.4-34.1000113.4L53L53-N57 WeakPolarHBondContact O-CB 3.25Å; L53-N57 PolarHBondContact O-N 3.5Å; L53-N57 PolarHBondContact O-ND2 2.65Å
58C83.5Confident90.1Very high42 Ų4245.5 Ų45.528%0.28422%0.223SC..Iπ-helixtrans-95.2-48.6-175.5-55.20000111.8I54 Y307I54-C58 HydrophobicContact CG2-CB 4.3Å; I54-C58 WeakPolarHBondContact O-CA 3.29Å; I54-C58 VanDerWaalsContact O-CB 3.24Å; I54-C58 WeakPolarHBondContact O-CB 3.45Å; I54-C58 PolarHBondContact O-N 3.48Å; C58-Y307 HydrophobicContact CB-CD1 3.64Å; C58-Y307 HydrophobicContact CB-CE1 4.18Å; C58-Y307 HydrophobicContact CB-CG 4.17Å
59K82.1Confident90Very high39 Ų3946.2 Ų46.217%0.1723%0.226CC..Iπ-helixtrans-86.9-23.2-178.3-73.7-159.4-178.2172.20114.6I54 L55 L61 D66 Y307I54-K59 PolarHBondContact O-N 2.89Å; L55-K59 HydrophobicContact CD2-CD 3.95Å; L55-K59 CarbonylContact O-C 3.59Å; K59-L61 PolarHBondContact O-N 3.02Å; K59-D66 WeakPolarHBondContact CD-OD1 3.48Å; K59-D66 IonicContact NZ-OD1 3.33Å; K59-D66 PolarHBondContact NZ-OD1 2.93Å; K59-Y307 HydrophobicContact CD-CE2 4.3Å; K59-Y307 HydrophobicContact CG-CD2 4.05Å; K59-Y307 HydrophobicContact CG-CE2 3.72Å
60R86.9Confident90Very high183 Ų18344.3 Ų44.369%0.69122%0.217SC*.THydrogen-bonded Turntrans55.332.7-179.8-53.7-175.1-178.8-177.2-0.7114.1L55 I56 K62L55-R60 PolarHBondContact O-N 3.4Å; I56-R60 WeakPolarHBondContact O-CA 3.31Å; I56-R60 PolarHBondContact O-N 2.89Å; R60-K62 HydrophobicContact CB-CG 4.39Å; R60-K62 PolarHBondContact O-N 2.87Å
61L87.6Confident90.3Very high49 Ų4943.5 Ų43.526%0.25721%0.213SC..THydrogen-bonded Turntrans47.139.2172.4-54.6174.3000115.1L55 I56 K59 S63 D66 L70L55-L61 HydrophobicContact CB-CD2 3.93Å; L55-L61 PolarHBondContact O-N 3.48Å; I56-L61 HydrophobicContact CG1-CD1 4.39Å; K59-L61 PolarHBondContact O-N 3.02Å; L61-S63 PolarHBondContact O-N 3.42Å; L61-D66 HydrophobicContact CD2-CB 4.25Å; L61-L70 HydrophobicContact CD1-CD2 3.77Å; L61-L70 HydrophobicContact CD2-CB 4.17Å; L61-L70 HydrophobicContact CD2-CD2 4.02Å
62K86.3Confident90.5Very high157 Ų15743.5 Ų43.568%0.68321%0.213SC*.  trans-74.3-6.7-172.5-66.3-177179.4-173.30114.6R60R60-K62 HydrophobicContact CB-CG 4.39Å; R60-K62 PolarHBondContact O-N 2.87Å
63S88.2Confident90.6Very high38 Ų3842.4 Ų42.427%0.26621%0.208SC..SBendtrans-134.8151.5-176.775.50000112L61 T65 D66 I67L61-S63 PolarHBondContact O-N 3.42Å; S63-T65 PolarHBondContact O-N 3.06Å; S63-D66 PolarHBondContact O-N 3.16Å; S63-D66 PolarHBondContact OG-N 3.33Å; S63-D66 PolarHBondContact OG-OD2 2.9Å; S63-I67 PolarHBondContact O-N 2.83Å
64M91.2Very high90.9Very high18 Ų1841.1 Ų41.19%0.08920%0.201CC..Hα-helixtrans-52.9-36.7174.2-174.1173.3-175.100112.5I67 Y68 R140M64-I67 WeakPolarHBondContact O-CB 3.36Å; M64-I67 PolarHBondContact O-N 3.4Å; M64-Y68 HydrophobicContact CE-CE2 3.85Å; M64-Y68 WeakPolarHBondContact CE-OH 3.42Å; M64-Y68 HydrophobicContact CG-CD2 4.42Å; M64-Y68 HydrophobicContact CG-CE2 3.88Å; M64-Y68 PolarHBondContact O-N 2.82Å; M64-Y68 VanDerWaalsContact O-N 3.08Å; M64-R140 HydrophobicContact SD-CB 4Å; M64-R140 HydrophobicContact SD-CG 4.18Å
65T90.8Very high91.4Very high17 Ų1741.1 Ų41.110%0.10420%0.201CC..Hα-helixtrans-64.1-40.5174.9-44.30000112.5S63 I67 Y68 L69 L122 D125 R126 R140S63-T65 PolarHBondContact O-N 3.06Å; T65-I67 VanDerWaalsContact C-N 3.26Å; T65-I67 PolarHBondContact O-N 2.94Å; T65-Y68 PolarHBondContact O-N 3.31Å; T65-L69 HydrophobicContact CG2-CD1 4.22Å; T65-L69 HydrophobicContact CG2-CG 4.46Å; T65-L69 WeakPolarHBondContact O-CB 3.39Å; T65-L69 VanDerWaalsContact O-CG 3.28Å; T65-L69 WeakPolarHBondContact O-CG 3.28Å; T65-L69 PolarHBondContact O-N 2.63Å; T65-L122 HydrophobicContact CG2-CD2 3.68Å; T65-D125 PolarHBondContact OG1-OD2 2.93Å; T65-R126 PolarHBondContact OG1-NH2 3.41Å; T65-R140 PolarHBondContact OG1-NH2 3.12Å
66D91.3Very high91.7Very high16 Ų1641.4 Ų41.49%0.08620%0.202CC..Hα-helixtrans-67.2-31.5178.7-60.5-49.5000110.9L55 K59 L61 S63 L70L55-D66 HydrophobicContact CD2-CB 4.33Å; K59-D66 WeakPolarHBondContact CD-OD1 3.48Å; K59-D66 IonicContact NZ-OD1 3.33Å; K59-D66 PolarHBondContact NZ-OD1 2.93Å; L61-D66 HydrophobicContact CD2-CB 4.25Å; S63-D66 PolarHBondContact O-N 3.16Å; S63-D66 PolarHBondContact OG-N 3.33Å; S63-D66 PolarHBondContact OG-OD2 2.9Å; D66-L70 WeakPolarHBondContact O-CB 3.26Å; D66-L70 PolarHBondContact O-N 3.04Å
67I94.9Very high92.1Very high12 Ų1238.5 Ų38.56%0.06219%0.187CC..Hα-helixtrans-65.5-46.9172.5-58.4170.4000110.8S63 M64 T65 L70 N71 V142 V146S63-I67 PolarHBondContact O-N 2.83Å; M64-I67 WeakPolarHBondContact O-CB 3.36Å; M64-I67 PolarHBondContact O-N 3.4Å; T65-I67 VanDerWaalsContact C-N 3.26Å; T65-I67 PolarHBondContact O-N 2.94Å; I67-L70 WeakPolarHBondContact O-CB 3.34Å; I67-L70 PolarHBondContact O-N 3.46Å; I67-N71 PolarHBondContact O-N 3.14Å; I67-N71 PolarHBondContact O-ND2 3.23Å; I67-V142 HydrophobicContact CD1-CB 4.12Å; I67-V142 HydrophobicContact CD1-CG1 3.65Å; I67-V142 HydrophobicContact CD1-CG2 4.41Å; I67-V142 WeakPolarHBondContact CD1-O 3.39Å; I67-V146 HydrophobicContact CD1-CG2 4.12Å
68Y95.3Very high92.6Very high4 Ų437.3 Ų37.32%0.01618%0.178CC..Hα-helixtrans-66.9-38.4178.5-64.4-24.9000112.8M64 T65 L70 N71 L72 F118 L121 L122 D125 T148M64-Y68 HydrophobicContact CE-CE2 3.85Å; M64-Y68 WeakPolarHBondContact CE-OH 3.42Å; M64-Y68 HydrophobicContact CG-CD2 4.42Å; M64-Y68 HydrophobicContact CG-CE2 3.88Å; M64-Y68 PolarHBondContact O-N 2.82Å; M64-Y68 VanDerWaalsContact O-N 3.08Å; T65-Y68 PolarHBondContact O-N 3.31Å; Y68-L70 VanDerWaalsContact C-N 3.29Å; Y68-L70 PolarHBondContact O-N 3.1Å; Y68-N71 PolarHBondContact O-N 2.89Å; Y68-L72 WeakPolarHBondContact O-CB 3.23Å; Y68-L72 PolarHBondContact O-N 3.46Å; Y68-F118 HydrophobicContact CD1-CD1 4.06Å; Y68-F118 HydrophobicContact CD1-CE1 4.23Å; Y68-L121 HydrophobicContact CD2-CB 4.02Å; Y68-L121 HydrophobicContact CE1-CB 4.32Å; Y68-L121 HydrophobicContact CE1-CD1 4.04Å; Y68-L121 HydrophobicContact CE2-CB 3.76Å; Y68-L121 HydrophobicContact CG-CB 4.38Å; Y68-L122 HydrophobicContact CD2-CD2 4.31Å; Y68-D125 HydrophobicContact CD2-CB 4.3Å; Y68-D125 HydrophobicContact CE2-CB 4.07Å; Y68-T148 WeakPolarHBondContact CE1-OG1 3.19Å; Y68-T148 WeakPolarHBondContact OH-CB 3.46Å; Y68-T148 PolarHBondContact OH-OG1 3.4Å
69L93.4Very high93.1Very high15 Ų1535.6 Ų35.68%0.07917%0.166CC..Hα-helixtrans-63.2-36.3173-70.8172000112L55 T65 A73 L122 Y297L55-L69 HydrophobicContact CD1-CB 3.89Å; T65-L69 HydrophobicContact CG2-CD1 4.22Å; T65-L69 HydrophobicContact CG2-CG 4.46Å; T65-L69 WeakPolarHBondContact O-CB 3.39Å; T65-L69 VanDerWaalsContact O-CG 3.28Å; T65-L69 WeakPolarHBondContact O-CG 3.28Å; T65-L69 PolarHBondContact O-N 2.63Å; L69-A73 PolarHBondContact O-N 3.1Å; L69-A73 VanDerWaalsContact O-N 3.09Å; L69-L122 HydrophobicContact CD2-CD1 3.9Å; L69-L122 HydrophobicContact CD2-CD2 4.26Å; L69-L122 HydrophobicContact CG-CD2 4.15Å; L69-Y297 HydrophobicContact CD2-CE1 3.84Å; L69-Y297 WeakPolarHBondContact CD2-OH 3.44Å
70L95.8Very high93.8Very high25 Ų2533.8 Ų33.813%0.13116%0.158CC..Hα-helixtrans-64.1-49.6174.8177.170000110.9I52 L55 I56 L61 D66 I67 Y68 L72 A73 I74I52-L70 HydrophobicContact CB-CD1 4.27Å; I52-L70 HydrophobicContact CG1-CD1 3.98Å; I52-L70 HydrophobicContact CG2-CD1 3.94Å; L55-L70 HydrophobicContact CD1-CB 4.01Å; I56-L70 HydrophobicContact CD1-CD1 4.4Å; I56-L70 HydrophobicContact CG1-CD1 4.39Å; L61-L70 HydrophobicContact CD1-CD2 3.77Å; L61-L70 HydrophobicContact CD2-CB 4.17Å; L61-L70 HydrophobicContact CD2-CD2 4.02Å; D66-L70 WeakPolarHBondContact O-CB 3.26Å; D66-L70 PolarHBondContact O-N 3.04Å; I67-L70 WeakPolarHBondContact O-CB 3.34Å; I67-L70 PolarHBondContact O-N 3.46Å; Y68-L70 VanDerWaalsContact C-N 3.29Å; Y68-L70 PolarHBondContact O-N 3.1Å; L70-L72 VanDerWaalsContact C-N 3.31Å; L70-L72 PolarHBondContact O-N 3.2Å; L70-A73 PolarHBondContact O-N 3.04Å; L70-I74 HydrophobicContact CD1-CD1 4.44Å; L70-I74 HydrophobicContact CG-CD1 4.06Å; L70-I74 WeakPolarHBondContact O-CG1 3.18Å; L70-I74 PolarHBondContact O-N 3.48Å
71N97.8Very high94.3Very high21 Ų2128.9 Ų28.911%0.11215%0.145CC..Hα-helixtrans-66-34.2180-75.2-82000112.6I67 Y68 I74 S75 F118 S149 W153I67-N71 PolarHBondContact O-N 3.14Å; I67-N71 PolarHBondContact O-ND2 3.23Å; Y68-N71 PolarHBondContact O-N 2.89Å; N71-I74 PolarHBondContact O-N 3.19Å; N71-S75 WeakPolarHBondContact O-CB 3.28Å; N71-S75 PolarHBondContact O-N 3.37Å; N71-F118 HydrophobicContact CB-CD1 3.74Å; N71-F118 HydrophobicContact CB-CD2 3.76Å; N71-F118 HydrophobicContact CB-CE1 3.41Å; N71-F118 VanDerWaalsContact CB-CE1 3.41Å; N71-F118 HydrophobicContact CB-CE2 3.46Å; N71-F118 VanDerWaalsContact CB-CE2 3.46Å; N71-F118 HydrophobicContact CB-CG 3.94Å; N71-F118 HydrophobicContact CB-CZ 3.29Å; N71-S149 PolarHBondContact ND2-OG 3.43Å; N71-W153 PolarHBondContact OD1-NE1 3.38Å
72L95.9Very high94.7Very high1 Ų126.5 Ų26.51%0.00513%0.133CC..Hα-helixtrans-61.5-44.5172-177.958.8000111.4Y68 L70 I74 S75 D76 G115 F118 I119 L122 Y297Y68-L72 WeakPolarHBondContact O-CB 3.23Å; Y68-L72 PolarHBondContact O-N 3.46Å; L70-L72 VanDerWaalsContact C-N 3.31Å; L70-L72 PolarHBondContact O-N 3.2Å; L72-I74 VanDerWaalsContact C-N 3.34Å; L72-I74 PolarHBondContact O-N 3.3Å; L72-S75 VanDerWaalsContact O-CB 3.27Å; L72-S75 WeakPolarHBondContact O-CB 3.47Å; L72-S75 PolarHBondContact O-N 3.27Å; L72-D76 PolarHBondContact O-N 3.26Å; L72-G115 WeakPolarHBondContact CD1-O 3.33Å; L72-F118 HydrophobicContact CB-CB 4.11Å; L72-F118 HydrophobicContact CD1-CB 4.35Å; L72-I119 HydrophobicContact CD1-CD1 4.44Å; L72-I119 HydrophobicContact CD1-CG1 4.05Å; L72-I119 HydrophobicContact CD2-CG1 4.1Å; L72-L122 HydrophobicContact CD2-CD1 3.97Å; L72-Y297 WeakPolarHBondContact CD2-OH 3.14Å
73A96.5Very high95.1Very high1 Ų119.1 Ų19.11%0.00810%0.1CC..Hα-helixtrans-64.7-36.3175.300000112.6N48 V51 I52 L69 L70 D76 L77N48-A73 HydrophobicContact CB-CB 4.49Å; V51-A73 HydrophobicContact CB-CB 4.45Å; V51-A73 HydrophobicContact CG1-CB 4.05Å; I52-A73 HydrophobicContact CD1-CB 4.22Å; I52-A73 HydrophobicContact CG1-CB 3.79Å; L69-A73 PolarHBondContact O-N 3.1Å; L69-A73 VanDerWaalsContact O-N 3.09Å; L70-A73 PolarHBondContact O-N 3.04Å; A73-D76 PolarHBondContact O-N 2.88Å; A73-L77 WeakPolarHBondContact O-CG 3.45Å; A73-L77 PolarHBondContact O-N 3.44Å
74I97.8Very high95.5Very high50 Ų5019.8 Ų19.826%0.25610%0.104SC..Hα-helixtrans-65.8-40.7173.9-66.8167.2000110.8I52 L70 N71 L72 L77 F78 W153I52-I74 HydrophobicContact CD1-CG1 4.25Å; L70-I74 HydrophobicContact CD1-CD1 4.44Å; L70-I74 HydrophobicContact CG-CD1 4.06Å; L70-I74 WeakPolarHBondContact O-CG1 3.18Å; L70-I74 PolarHBondContact O-N 3.48Å; N71-I74 PolarHBondContact O-N 3.19Å; L72-I74 VanDerWaalsContact C-N 3.34Å; L72-I74 PolarHBondContact O-N 3.3Å; I74-L77 WeakPolarHBondContact O-CB 3.47Å; I74-L77 PolarHBondContact O-N 3.2Å; I74-F78 HydrophobicContact CG2-CE1 4.41Å; I74-F78 HydrophobicContact CG2-CE2 4.34Å; I74-F78 HydrophobicContact CG2-CZ 4.18Å; I74-F78 PolarHBondContact O-N 2.89Å; I74-W153 HydrophobicContact CB-CZ2 4.28Å; I74-W153 HydrophobicContact CG2-CH2 4.01Å; I74-W153 HydrophobicContact CG2-CZ2 3.8Å
75S97.8Very high95.7Very high0 Ų021.5 Ų21.50%011%0.111CC..Hα-helixtrans-58.6-47.7174.2-173.60000112.1N71 L72 L77 F78 F79 G111 S114 G115N71-S75 WeakPolarHBondContact O-CB 3.28Å; N71-S75 PolarHBondContact O-N 3.37Å; L72-S75 VanDerWaalsContact O-CB 3.27Å; L72-S75 WeakPolarHBondContact O-CB 3.47Å; L72-S75 PolarHBondContact O-N 3.27Å; S75-L77 VanDerWaalsContact C-N 3.27Å; S75-L77 PolarHBondContact O-N 3.35Å; S75-F78 PolarHBondContact O-N 3.44Å; S75-F79 PolarHBondContact O-N 2.98Å; S75-F79 VanDerWaalsContact O-N 3.12Å; S75-G111 PolarHBondContact OG-O 3.5Å; S75-S114 WeakPolarHBondContact CB-OG 3.26Å; S75-S114 PolarHBondContact OG-OG 2.7Å; S75-G115 VanDerWaalsContact OG-CA 3.25Å; S75-G115 WeakPolarHBondContact OG-CA 3.15Å; S75-G115 PolarHBondContact OG-N 3.16Å
76D96.9Very high95.8Very high9 Ų922.4 Ų22.45%0.04811%0.113CC..Hα-helixtrans-61.3-37.3175.9-71-34.5000111.1L72 A73 F79 L80 C290 N293L72-D76 PolarHBondContact O-N 3.26Å; A73-D76 PolarHBondContact O-N 2.88Å; D76-F79 WeakPolarHBondContact O-CB 3.26Å; D76-F79 PolarHBondContact O-N 3.48Å; D76-L80 WeakPolarHBondContact O-CB 3.19Å; D76-L80 WeakPolarHBondContact O-CD1 3.12Å; D76-L80 WeakPolarHBondContact O-CG 3.44Å; D76-L80 PolarHBondContact O-N 3.38Å; D76-C290 HydrophobicContact CB-CB 4.38Å; D76-N293 PolarHBondContact OD2-ND2 2.93Å
77L97.3Very high95.9Very high18 Ų1822 Ų229%0.09411%0.111CC..Hα-helixtrans-65.3-42.9174.8-73.6178.2000113F45 N48 M49 I52 A73 I74 S75 F79 L80 L81F45-L77 HydrophobicContact CD2-CD2 3.95Å; F45-L77 HydrophobicContact CE2-CD2 4.35Å; N48-L77 HydrophobicContact CB-CD2 3.97Å; N48-L77 HydrophobicContact CB-CG 4.1Å; M49-L77 HydrophobicContact CE-CD1 3.45Å; M49-L77 VanDerWaalsContact CE-CD1 3.45Å; M49-L77 HydrophobicContact CE-CD2 3.9Å; M49-L77 HydrophobicContact CE-CG 4.33Å; M49-L77 HydrophobicContact CG-CD2 4.39Å; M49-L77 HydrophobicContact SD-CD1 3.87Å; I52-L77 HydrophobicContact CD1-CD1 3.36Å; I52-L77 HydrophobicContact CD1-CG 4.39Å; A73-L77 WeakPolarHBondContact O-CG 3.45Å; A73-L77 PolarHBondContact O-N 3.44Å; I74-L77 WeakPolarHBondContact O-CB 3.47Å; I74-L77 PolarHBondContact O-N 3.2Å; S75-L77 VanDerWaalsContact C-N 3.27Å; S75-L77 PolarHBondContact O-N 3.35Å; L77-F79 VanDerWaalsContact C-N 3.25Å; L77-F79 PolarHBondContact O-N 2.96Å; L77-L80 HydrophobicContact CD2-CD1 4.25Å; L77-L80 PolarHBondContact O-N 2.83Å; L77-L81 VanDerWaalsContact O-CG 3.28Å; L77-L81 WeakPolarHBondContact O-CG 3.34Å; L77-L81 PolarHBondContact O-N 2.82Å
78F96.8Very high95.9Very high69 Ų6924.9 Ų24.930%0.30312%0.124SC..Hα-helixtrans-59.1-40.6174.6-74.3-12.3000111.8I74 S75 L81 L107 I110 W153I74-F78 HydrophobicContact CG2-CE1 4.41Å; I74-F78 HydrophobicContact CG2-CE2 4.34Å; I74-F78 HydrophobicContact CG2-CZ 4.18Å; I74-F78 PolarHBondContact O-N 2.89Å; S75-F78 PolarHBondContact O-N 3.44Å; F78-L81 HydrophobicContact CD1-CD1 4.48Å; F78-L107 HydrophobicContact CB-CD2 4.49Å; F78-L107 HydrophobicContact CD1-CD2 4.5Å; F78-L107 HydrophobicContact CG-CD2 4.35Å; F78-I110 HydrophobicContact CD2-CG2 4.02Å; F78-I110 HydrophobicContact CE2-CG2 4.48Å; F78-W153 AromaticContact CD2-CH2 3.56Å; F78-W153 HydrophobicContact CD2-CH2 3.56Å; F78-W153 AromaticContact CD2-CZ3 3.57Å; F78-W153 HydrophobicContact CD2-CZ3 3.57Å; F78-W153 HydrophobicContact CE2-CE3 4.38Å; F78-W153 AromaticContact CE2-CH2 3.46Å; F78-W153 HydrophobicContact CE2-CH2 3.46Å; F78-W153 VanDerWaalsContact CE2-CH2 3.46Å; F78-W153 HydrophobicContact CE2-CZ2 4.42Å; F78-W153 AromaticContact CE2-CZ3 3.44Å; F78-W153 HydrophobicContact CE2-CZ3 3.44Å; F78-W153 VanDerWaalsContact CE2-CZ3 3.44Å
79F95.2Very high95.7Very high6 Ų627.8 Ų27.83%0.02614%0.136CC..Hα-helixtrans-63.4-49.3173.8-164.3-87.6000111.5S75 D76 L77 L81 T82 V83 Y108 W248 M287 C290S75-F79 PolarHBondContact O-N 2.98Å; S75-F79 VanDerWaalsContact O-N 3.12Å; D76-F79 WeakPolarHBondContact O-CB 3.26Å; D76-F79 PolarHBondContact O-N 3.48Å; L77-F79 VanDerWaalsContact C-N 3.25Å; L77-F79 PolarHBondContact O-N 2.96Å; F79-L81 VanDerWaalsContact C-N 3.33Å; F79-L81 PolarHBondContact O-N 2.99Å; F79-T82 PolarHBondContact O-N 3.24Å; F79-T82 PolarHBondContact O-OG1 3.28Å; F79-V83 HydrophobicContact CD1-CG2 4.33Å; F79-V83 HydrophobicContact CE1-CG2 4.46Å; F79-Y108 HydrophobicContact CD2-CD2 4.04Å; F79-Y108 HydrophobicContact CD2-CE2 4.34Å; F79-Y108 HydrophobicContact CE1-CE2 4.44Å; F79-Y108 AromaticContact CE2-CD2 3.39Å; F79-Y108 HydrophobicContact CE2-CD2 3.39Å; F79-Y108 HydrophobicContact CE2-CE1 4.5Å; F79-Y108 AromaticContact CE2-CE2 3.27Å; F79-Y108 HydrophobicContact CE2-CE2 3.27Å; F79-Y108 HydrophobicContact CE2-CG 4.11Å; F79-Y108 AromaticContact CE2-CZ 3.87Å; F79-Y108 AromaticContact CZ-CD2 3.75Å; F79-Y108 HydrophobicContact CZ-CD2 3.75Å; F79-Y108 AromaticContact CZ-CE2 3.34Å; F79-Y108 HydrophobicContact CZ-CE2 3.34Å; F79-W248 HydrophobicContact CE2-CH2 4.11Å; F79-W248 HydrophobicContact CE2-CZ2 4.22Å; F79-W248 AromaticContact CZ-CH2 3.99Å; F79-W248 HydrophobicContact CZ-CH2 3.99Å; F79-W248 HydrophobicContact CZ-CZ2 4.07Å; F79-M287 HydrophobicContact CE1-CB 4.1Å; F79-M287 HydrophobicContact CE1-CG 4Å; F79-M287 HydrophobicContact CZ-CB 4.39Å; F79-M287 HydrophobicContact CZ-CG 3.9Å; F79-C290 HydrophobicContact CD1-CB 4.02Å
80L96.8Very high95.5Very high0 Ų028.1 Ų28.10%014%0.141CC..Hα-helixtrans-60-36.5-179.5-78.1161.3000113.5V40 F41 G44 D76 L77 T82 V83 P84 C290V40-L80 HydrophobicContact CG1-CD2 4.27Å; F41-L80 HydrophobicContact CD2-CB 4.47Å; F41-L80 VanDerWaalsContact CD2-O 3.31Å; F41-L80 WeakPolarHBondContact CD2-O 3.32Å; G44-L80 WeakPolarHBondContact O-CD1 3.35Å; D76-L80 WeakPolarHBondContact O-CB 3.19Å; D76-L80 WeakPolarHBondContact O-CD1 3.12Å; D76-L80 WeakPolarHBondContact O-CG 3.44Å; D76-L80 PolarHBondContact O-N 3.38Å; L77-L80 HydrophobicContact CD2-CD1 4.25Å; L77-L80 PolarHBondContact O-N 2.83Å; L80-T82 PolarHBondContact O-N 3.44Å; L80-T82 VanDerWaalsContact O-N 3.15Å; L80-V83 WeakPolarHBondContact O-CB 3.25Å; L80-V83 PolarHBondContact O-N 3.21Å; L80-V83 VanDerWaalsContact O-N 3.09Å; L80-P84 VanDerWaalsContact O-CD 3.29Å; L80-P84 WeakPolarHBondContact O-CD 3.47Å; L80-C290 WeakPolarHBondContact CD2-SG 3.44Å; L80-C290 HydrophobicContact CG-CB 4.23Å
81L96.6Very high95.1Very high80 Ų8029.6 Ų29.642%0.41916%0.157SC..Hα-helixtrans-60.5-23.7177.1-73.1171.8000112.7L77 F78 F79 F85L77-L81 VanDerWaalsContact O-CG 3.28Å; L77-L81 WeakPolarHBondContact O-CG 3.34Å; L77-L81 PolarHBondContact O-N 2.82Å; F78-L81 HydrophobicContact CD1-CD1 4.48Å; F79-L81 VanDerWaalsContact C-N 3.33Å; F79-L81 PolarHBondContact O-N 2.99Å; L81-F85 WeakPolarHBondContact O-CD2 3.24Å; L81-F85 WeakPolarHBondContact O-CE2 3.36Å
82T96.2Very high94.7Very high0 Ų030.9 Ų30.90%017%0.17CC..Hα-helixtrans-85-24.4177.274.40000113.4F79 L80 F85 W86 L104 L107F79-T82 PolarHBondContact O-N 3.24Å; F79-T82 PolarHBondContact O-OG1 3.28Å; L80-T82 PolarHBondContact O-N 3.44Å; L80-T82 VanDerWaalsContact O-N 3.15Å; T82-F85 WeakPolarHBondContact O-CB 3.39Å; T82-F85 PolarHBondContact O-N 3.02Å; T82-F85 VanDerWaalsContact O-N 3.07Å; T82-W86 PolarHBondContact O-N 2.87Å; T82-W86 PolarHBondContact OG1-NE1 3.29Å; T82-L104 HydrophobicContact CG2-CB 4.42Å; T82-L104 HydrophobicContact CG2-CD2 4Å; T82-L104 WeakPolarHBondContact CG2-O 3.39Å; T82-L107 HydrophobicContact CG2-CB 3.57Å
83V95.4Very high94.4Very high1 Ų133.3 Ų33.31%0.00618%0.182CC..Hα-helixtrans-57.5-42.6-172175.10000113.7Y37 F41 F79 L80 F85 W86 A87Y37-V83 HydrophobicContact CG-CG1 4.04Å; Y37-V83 VanDerWaalsContact O-CG1 3.32Å; Y37-V83 WeakPolarHBondContact O-CG1 3.37Å; F41-V83 HydrophobicContact CB-CG1 4.34Å; F79-V83 HydrophobicContact CD1-CG2 4.33Å; F79-V83 HydrophobicContact CE1-CG2 4.46Å; L80-V83 WeakPolarHBondContact O-CB 3.25Å; L80-V83 PolarHBondContact O-N 3.21Å; L80-V83 VanDerWaalsContact O-N 3.09Å; V83-F85 VanDerWaalsContact C-N 3.26Å; V83-F85 PolarHBondContact O-N 3.26Å; V83-W86 PolarHBondContact O-N 3.47Å; V83-A87 WeakPolarHBondContact O-CB 3.36Å; V83-A87 PolarHBondContact O-N 3.2Å
84P95.4Very high94.3Very high53 Ų5333.4 Ų33.434%0.34418%0.182SC..Hα-helixtrans-60.4-34176.9-25.835.6000113.7F41 L80 A87 H88F41-P84 HydrophobicContact CD1-CG 4.34Å; F41-P84 HydrophobicContact CD2-CG 3.7Å; F41-P84 HydrophobicContact CE1-CG 4.46Å; F41-P84 HydrophobicContact CE2-CG 3.84Å; F41-P84 HydrophobicContact CG-CG 3.96Å; F41-P84 HydrophobicContact CZ-CG 4.22Å; L80-P84 VanDerWaalsContact O-CD 3.29Å; L80-P84 WeakPolarHBondContact O-CD 3.47Å; P84-A87 WeakPolarHBondContact O-CB 3.42Å; P84-A87 PolarHBondContact O-N 2.87Å; P84-H88 PolarHBondContact O-N 3.31Å
85F95.5Very high94.1Very high54 Ų5435.2 Ų35.224%0.23719%0.192CC..Hα-helixtrans-72.6-40.1178.6-61.6-91.6000111.2L81 T82 V83 A87 H88 Y89 F96 L104L81-F85 WeakPolarHBondContact O-CD2 3.24Å; L81-F85 WeakPolarHBondContact O-CE2 3.36Å; T82-F85 WeakPolarHBondContact O-CB 3.39Å; T82-F85 PolarHBondContact O-N 3.02Å; T82-F85 VanDerWaalsContact O-N 3.07Å; V83-F85 VanDerWaalsContact C-N 3.26Å; V83-F85 PolarHBondContact O-N 3.26Å; F85-A87 VanDerWaalsContact C-N 3.29Å; F85-A87 PolarHBondContact O-N 3.3Å; F85-H88 PolarHBondContact O-N 3.4Å; F85-Y89 WeakPolarHBondContact O-CB 3.38Å; F85-Y89 PolarHBondContact O-N 2.65Å; F85-F96 HydrophobicContact CB-CE2 4.27Å; F85-F96 AromaticContact CD1-CD1 3.89Å; F85-F96 HydrophobicContact CD1-CD1 3.89Å; F85-F96 AromaticContact CD1-CD2 3.91Å; F85-F96 HydrophobicContact CD1-CD2 3.91Å; F85-F96 AromaticContact CD1-CE1 3.71Å; F85-F96 HydrophobicContact CD1-CE1 3.71Å; F85-F96 AromaticContact CD1-CE2 3.74Å; F85-F96 HydrophobicContact CD1-CE2 3.74Å; F85-F96 AromaticContact CD1-CG 3.99Å; F85-F96 HydrophobicContact CD1-CG 3.99Å; F85-F96 AromaticContact CD1-CZ 3.64Å; F85-F96 HydrophobicContact CD1-CZ 3.64Å; F85-F96 AromaticContact CE1-CD1 3.97Å; F85-F96 HydrophobicContact CE1-CD1 3.97Å; F85-F96 AromaticContact CE1-CE1 3.89Å; F85-F96 HydrophobicContact CE1-CE1 3.89Å; F85-F96 HydrophobicContact CE1-CG 4.4Å; F85-F96 HydrophobicContact CE1-CZ 4.27Å; F85-F96 HydrophobicContact CG-CE2 4.5Å; F85-L104 HydrophobicContact CB-CD1 3.51Å; F85-L104 HydrophobicContact CD1-CD1 3.57Å; F85-L104 HydrophobicContact CD2-CD1 3.77Å; F85-L104 HydrophobicContact CD2-CD2 3.71Å; F85-L104 HydrophobicContact CD2-CG 4.43Å; F85-L104 HydrophobicContact CE1-CD1 4.18Å; F85-L104 HydrophobicContact CE2-CD1 4.36Å; F85-L104 HydrophobicContact CE2-CD2 3.91Å; F85-L104 HydrophobicContact CG-CD1 3.33Å; F85-L104 HydrophobicContact CG-CD2 4.18Å; F85-L104 HydrophobicContact CG-CG 4.42Å
86W93.8Very high93.8Very high36 Ų3638.6 Ų38.614%0.13621%0.207CC..Hα-helixtrans-65.9-32.8172.8-59.3123000112.3Y37 T82 V83 Y89 A90 W94 M287Y37-W86 HydrophobicContact CD2-CB 4.29Å; Y37-W86 HydrophobicContact CE2-CB 4.13Å; T82-W86 PolarHBondContact O-N 2.87Å; T82-W86 PolarHBondContact OG1-NE1 3.29Å; V83-W86 PolarHBondContact O-N 3.47Å; W86-Y89 HydrophobicContact CE3-CD1 4.02Å; W86-Y89 HydrophobicContact CZ3-CD1 4.25Å; W86-Y89 PolarHBondContact O-N 3.29Å; W86-A90 WeakPolarHBondContact O-CB 3.44Å; W86-A90 PolarHBondContact O-N 2.95Å; W86-W94 HydrophobicContact CE3-CZ3 4.23Å; W86-W94 HydrophobicContact CH2-CZ3 4.36Å; W86-W94 AromaticContact CZ3-CZ3 3.89Å; W86-W94 HydrophobicContact CZ3-CZ3 3.89Å; W86-M287 HydrophobicContact CG-CE 4.38Å
87A93.3Very high93.7Very high7 Ų739.7 Ų39.76%0.05822%0.22CC..Hα-helixtrans-64.1-46.9173.200000111.7Y37 V83 P84 F85 A90 A91Y37-A87 HydrophobicContact CD2-CB 4.08Å; Y37-A87 HydrophobicContact CG-CB 4.48Å; V83-A87 WeakPolarHBondContact O-CB 3.36Å; V83-A87 PolarHBondContact O-N 3.2Å; P84-A87 WeakPolarHBondContact O-CB 3.42Å; P84-A87 PolarHBondContact O-N 2.87Å; F85-A87 VanDerWaalsContact C-N 3.29Å; F85-A87 PolarHBondContact O-N 3.3Å; A87-A90 PolarHBondContact O-N 3.29Å; A87-A91 PolarHBondContact O-N 3.01Å; A87-A91 VanDerWaalsContact O-N 3.15Å
88H94.1Very high93.5Very high72 Ų7241.7 Ų41.733%0.33323%0.231SC..Hα-helixtrans-62.6-45.3174.2-177.677.2000111.7P84 F85 A90 A91 A92 D95 F96P84-H88 PolarHBondContact O-N 3.31Å; F85-H88 PolarHBondContact O-N 3.4Å; H88-A90 VanDerWaalsContact C-N 3.29Å; H88-A90 PolarHBondContact O-N 3.08Å; H88-A91 PolarHBondContact O-N 2.91Å; H88-A91 VanDerWaalsContact O-N 3.08Å; H88-A92 PolarHBondContact O-N 3.2Å; H88-D95 IonicContact CD2-OD2 3.25Å; H88-D95 IonicContact CE1-OD2 3.76Å; H88-D95 IonicContact NE2-OD2 2.84Å; H88-D95 PolarHBondContact NE2-OD2 3.04Å; H88-F96 HydrophobicContact CB-CE2 4.27Å; H88-F96 HydrophobicContact CB-CZ 4.15Å; H88-F96 AromaticContact CD2-CE2 3.64Å; H88-F96 AromaticContact CD2-CZ 3.67Å; H88-F96 AromaticContact CG-CZ 3.98Å
89Y91.8Very high93.4Very high65 Ų6543.8 Ų43.826%0.25525%0.25SC..Hα-helixtrans-59.2-40.1178.6179.2-122.2000112.5F85 W86 W94 T177F85-Y89 WeakPolarHBondContact O-CB 3.38Å; F85-Y89 PolarHBondContact O-N 2.65Å; W86-Y89 HydrophobicContact CE3-CD1 4.02Å; W86-Y89 HydrophobicContact CZ3-CD1 4.25Å; W86-Y89 PolarHBondContact O-N 3.29Å; Y89-W94 HydrophobicContact CD2-CB 3.89Å; Y89-W94 AromaticContact CD2-CE3 3.86Å; Y89-W94 HydrophobicContact CD2-CE3 3.86Å; Y89-W94 HydrophobicContact CE2-CB 3.92Å; Y89-W94 HydrophobicContact CE2-CE3 4.49Å; Y89-W94 AromaticContact CG-CE3 3.98Å; Y89-W94 HydrophobicContact CG-CE3 3.98Å; Y89-T177 WeakPolarHBondContact OH-CB 3.18Å
90A88.4Confident93.4Very high22 Ų2246.4 Ų46.418%0.18226%0.263CS..Hα-helixtrans-66.6-36.7175.500000112.7A30 L33 W86 A87 H88A30-A90 WeakPolarHBondContact CA-O 3.15Å; A30-A90 WeakPolarHBondContact CB-O 3.14Å; L33-A90 HydrophobicContact CB-CB 3.9Å; L33-A90 HydrophobicContact CD1-CB 3.93Å; W86-A90 WeakPolarHBondContact O-CB 3.44Å; W86-A90 PolarHBondContact O-N 2.95Å; A87-A90 PolarHBondContact O-N 3.29Å; H88-A90 VanDerWaalsContact C-N 3.29Å; H88-A90 PolarHBondContact O-N 3.08Å
91A88.5Confident93.3Very high56 Ų5646.4 Ų46.446%0.46326%0.263SS..Hα-helixtrans-74.1-35.9-179.800000113.1P34 A87 H88P34-A91 HydrophobicContact CB-CB 4.44Å; P34-A91 HydrophobicContact CG-CB 3.69Å; A87-A91 PolarHBondContact O-N 3.01Å; A87-A91 VanDerWaalsContact O-N 3.15Å; H88-A91 PolarHBondContact O-N 2.91Å; H88-A91 VanDerWaalsContact O-N 3.08Å
92A89Confident93.3Very high48 Ų4845.2 Ų45.240%0.39726%0.255SS..SBendtrans-134.2-108.9-171.300000111.6H88H88-A92 PolarHBondContact O-N 3.2Å
93Q89.7Confident93.2Very high53 Ų5350 Ų5025%0.24828%0.28CS..  trans-146.3178.9-17869.8-176.81.500110.1D95 H175Q93-D95 WeakPolarHBondContact CG-OD1 3.08Å; Q93-D95 PolarHBondContact NE2-OD1 2.78Å; Q93-D95 PolarHBondContact O-N 3.4Å; Q93-H175 HydrophobicContact CB-CB 4.28Å; Q93-H175 PolarHBondContact OE1-ND1 3.37Å
94W93.8Very high93.3Very high3 Ų350.2 Ų50.21%0.01128%0.281CS..  trans-83.897.3177.9-169.9-93.6000112.4W86 Y89 F96 G97 M100 C101 L104 Y176 C178W86-W94 HydrophobicContact CE3-CZ3 4.23Å; W86-W94 HydrophobicContact CH2-CZ3 4.36Å; W86-W94 AromaticContact CZ3-CZ3 3.89Å; W86-W94 HydrophobicContact CZ3-CZ3 3.89Å; Y89-W94 HydrophobicContact CD2-CB 3.89Å; Y89-W94 AromaticContact CD2-CE3 3.86Å; Y89-W94 HydrophobicContact CD2-CE3 3.86Å; Y89-W94 HydrophobicContact CE2-CB 3.92Å; Y89-W94 HydrophobicContact CE2-CE3 4.49Å; Y89-W94 AromaticContact CG-CE3 3.98Å; Y89-W94 HydrophobicContact CG-CE3 3.98Å; W94-F96 HydrophobicContact CD2-CD2 4.23Å; W94-F96 HydrophobicContact CE3-CD2 4.27Å; W94-F96 HydrophobicContact CH2-CD2 4.19Å; W94-F96 HydrophobicContact CZ2-CB 3.93Å; W94-F96 HydrophobicContact CZ2-CD2 4.06Å; W94-F96 HydrophobicContact CZ2-CG 4.46Å; W94-F96 HydrophobicContact CZ3-CD2 4.27Å; W94-G97 PolarHBondContact NE1-O 3.39Å; W94-M100 HydrophobicContact CZ2-CB 4.47Å; W94-C101 HydrophobicContact CH2-CB 4.47Å; W94-C101 HydrophobicContact CZ2-CB 3.62Å; W94-L104 HydrophobicContact CH2-CD1 3.61Å; W94-L104 HydrophobicContact CZ2-CD1 4.13Å; W94-Y176 WeakPolarHBondContact CB-O 3.3Å; W94-Y176 PolarHBondContact N-O 3.48Å; W94-Y176 WeakPolarHBondContact O-CB 3.44Å; W94-C178 HydrophobicContact CB-CB 4.42Å; W94-C178 HydrophobicContact CD2-CB 3.48Å; W94-C178 VanDerWaalsContact CD2-CB 3.48Å; W94-C178 HydrophobicContact CE3-CB 3.61Å; W94-C178 HydrophobicContact CG-CB 3.82Å; W94-C178 HydrophobicContact CH2-CB 4.42Å; W94-C178 HydrophobicContact CZ2-CB 4.39Å; W94-C178 HydrophobicContact CZ3-CB 4.07Å
95D93.2Very high93.3Very high87 Ų8748.1 Ų48.147%0.46527%0.268SS..  trans-96.4-2.6-177.8-59.2-50.8000114.2H88 Q93H88-D95 IonicContact CD2-OD2 3.25Å; H88-D95 IonicContact CE1-OD2 3.76Å; H88-D95 IonicContact NE2-OD2 2.84Å; H88-D95 PolarHBondContact NE2-OD2 3.04Å; Q93-D95 WeakPolarHBondContact CG-OD1 3.08Å; Q93-D95 PolarHBondContact NE2-OD1 2.78Å; Q93-D95 PolarHBondContact O-N 3.4Å
96F93Very high93.4Very high71 Ų7145.8 Ų45.831%0.31126%0.258SS..SBendtrans-91.40.1-170-51.3-75.5000114.7F85 H88 W94 M100F85-F96 HydrophobicContact CB-CE2 4.27Å; F85-F96 AromaticContact CD1-CD1 3.89Å; F85-F96 HydrophobicContact CD1-CD1 3.89Å; F85-F96 AromaticContact CD1-CD2 3.91Å; F85-F96 HydrophobicContact CD1-CD2 3.91Å; F85-F96 AromaticContact CD1-CE1 3.71Å; F85-F96 HydrophobicContact CD1-CE1 3.71Å; F85-F96 AromaticContact CD1-CE2 3.74Å; F85-F96 HydrophobicContact CD1-CE2 3.74Å; F85-F96 AromaticContact CD1-CG 3.99Å; F85-F96 HydrophobicContact CD1-CG 3.99Å; F85-F96 AromaticContact CD1-CZ 3.64Å; F85-F96 HydrophobicContact CD1-CZ 3.64Å; F85-F96 AromaticContact CE1-CD1 3.97Å; F85-F96 HydrophobicContact CE1-CD1 3.97Å; F85-F96 AromaticContact CE1-CE1 3.89Å; F85-F96 HydrophobicContact CE1-CE1 3.89Å; F85-F96 HydrophobicContact CE1-CG 4.4Å; F85-F96 HydrophobicContact CE1-CZ 4.27Å; F85-F96 HydrophobicContact CG-CE2 4.5Å; H88-F96 HydrophobicContact CB-CE2 4.27Å; H88-F96 HydrophobicContact CB-CZ 4.15Å; H88-F96 AromaticContact CD2-CE2 3.64Å; H88-F96 AromaticContact CD2-CZ 3.67Å; H88-F96 AromaticContact CG-CZ 3.98Å; W94-F96 HydrophobicContact CD2-CD2 4.23Å; W94-F96 HydrophobicContact CE3-CD2 4.27Å; W94-F96 HydrophobicContact CH2-CD2 4.19Å; W94-F96 HydrophobicContact CZ2-CB 3.93Å; W94-F96 HydrophobicContact CZ2-CD2 4.06Å; W94-F96 HydrophobicContact CZ2-CG 4.46Å; W94-F96 HydrophobicContact CZ3-CD2 4.27Å; F96-M100 HydrophobicContact CB-CB 3.72Å; F96-M100 HydrophobicContact CB-CG 3.76Å; F96-M100 HydrophobicContact CG-CG 4.48Å; F96-M100 VanDerWaalsContact O-CB 3.25Å; F96-M100 WeakPolarHBondContact O-CB 3.42Å
97G93.2Very high93.5Very high33 Ų3345.9 Ų45.934%0.3426%0.261SS..Hα-helixtrans73.5176.3-179.400000114.8W94 C101W94-G97 PolarHBondContact NE1-O 3.39Å; G97-C101 PolarHBondContact O-N 2.84Å
98N93.8Very high93.7Very high59 Ų5946.2 Ų46.232%0.31626%0.261SS..Hα-helixtrans-69.8-38.7-171.9-176.273.5000113.8M100 C101 Q102 R168 S169N98-M100 PolarHBondContact O-N 2.9Å; N98-C101 WeakPolarHBondContact O-CB 3.49Å; N98-C101 PolarHBondContact O-N 3.26Å; N98-Q102 PolarHBondContact O-N 3.11Å; N98-R168 VanDerWaalsContact OD1-CA 3.27Å; N98-R168 WeakPolarHBondContact OD1-CA 3.26Å; N98-S169 PolarHBondContact OD1-N 2.99Å
99T93.9Very high93.8Very high113 Ų11343.8 Ų43.869%0.69325%0.25SC*.Hα-helixtrans-62.6-44.5-178.849.20000111.5C101 Q102 L103T99-C101 VanDerWaalsContact C-N 3.35Å; T99-Q102 PolarHBondContact O-N 2.99Å; T99-L103 WeakPolarHBondContact O-CB 3.38Å; T99-L103 PolarHBondContact O-N 3.41Å
100M95.1Very high94.1Very high62 Ų6241.9 Ų41.931%0.30524%0.244SC..Hα-helixtrans-68.2-35.6176.7-165.565.487.100111.6W94 F96 N98 Q102 L103 L104W94-M100 HydrophobicContact CZ2-CB 4.47Å; F96-M100 HydrophobicContact CB-CB 3.72Å; F96-M100 HydrophobicContact CB-CG 3.76Å; F96-M100 HydrophobicContact CG-CG 4.48Å; F96-M100 VanDerWaalsContact O-CB 3.25Å; F96-M100 WeakPolarHBondContact O-CB 3.42Å; N98-M100 PolarHBondContact O-N 2.9Å; M100-Q102 PolarHBondContact O-N 3.44Å; M100-L103 PolarHBondContact O-N 3.24Å; M100-L103 HydrophobicContact SD-CD2 4.12Å; M100-L104 HydrophobicContact CG-CD1 3.54Å; M100-L104 HydrophobicContact CG-CG 3.96Å; M100-L104 VanDerWaalsContact O-CB 3.31Å; M100-L104 WeakPolarHBondContact O-CB 3.47Å; M100-L104 VanDerWaalsContact O-CG 3.25Å; M100-L104 WeakPolarHBondContact O-CG 3.4Å; M100-L104 PolarHBondContact O-N 3.3Å; M100-L104 HydrophobicContact SD-CD1 4.17Å; M100-L104 HydrophobicContact SD-CD2 4.47Å; M100-L104 HydrophobicContact SD-CG 4.07Å
101C95.6Very high94.5Very high0 Ų041 Ų410%024%0.237CC..Hα-helixtrans-58.1-50.4175.21730000110.6W94 G97 N98 T99 L103 L104 T105 T167 C178W94-C101 HydrophobicContact CH2-CB 4.47Å; W94-C101 HydrophobicContact CZ2-CB 3.62Å; G97-C101 PolarHBondContact O-N 2.84Å; N98-C101 WeakPolarHBondContact O-CB 3.49Å; N98-C101 PolarHBondContact O-N 3.26Å; T99-C101 VanDerWaalsContact C-N 3.35Å; C101-L103 PolarHBondContact O-N 3.45Å; C101-L104 PolarHBondContact O-N 2.91Å; C101-T105 VanDerWaalsContact O-CB 3.3Å; C101-T105 WeakPolarHBondContact O-CB 3.4Å; C101-T105 PolarHBondContact O-N 3.36Å; C101-T105 PolarHBondContact O-OG1 3.31Å; C101-T167 WeakPolarHBondContact SG-CG2 3.37Å; C101-C178 HydrophobicContact CB-CB 3.97Å; C101-C178 WeakPolarHBondContact CB-SG 3.25Å; C101-C178 VanDerWaalsContact SG-CA 3.6Å; C101-C178 WeakPolarHBondContact SG-CB 3.31Å; C101-C178 CovalentContact SG-SG 2.03Å; C101-C178 PolarHBondContact SG-SG 2.88Å
102Q95.6Very high94.9Very high55 Ų5538.9 Ų38.926%0.25722%0.217SC..Hα-helixtrans-63-42.8177.6-69.6-179.7-31.100113N98 T99 M100 G106 I164 T167N98-Q102 PolarHBondContact O-N 3.11Å; T99-Q102 PolarHBondContact O-N 2.99Å; M100-Q102 PolarHBondContact O-N 3.44Å; Q102-G106 PolarHBondContact O-N 2.86Å; Q102-I164 HydrophobicContact CB-CG2 4.22Å; Q102-T167 WeakPolarHBondContact CG-O 3.49Å; Q102-T167 PolarHBondContact NE2-O 3.31Å
103L96.1Very high95.2Very high101 Ų10136.6 Ų36.653%0.52920%0.198SC..Hα-helixtrans-64.1-48.6179179.764000111.9T99 M100 C101 G106 L107T99-L103 WeakPolarHBondContact O-CB 3.38Å; T99-L103 PolarHBondContact O-N 3.41Å; M100-L103 PolarHBondContact O-N 3.24Å; M100-L103 HydrophobicContact SD-CD2 4.12Å; C101-L103 PolarHBondContact O-N 3.45Å; L103-G106 WeakPolarHBondContact O-CA 3.34Å; L103-G106 PolarHBondContact O-N 3.21Å; L103-G106 VanDerWaalsContact O-N 3.16Å; L103-L107 HydrophobicContact CG-CD1 4.41Å; L103-L107 PolarHBondContact O-N 3.01Å
104L96.6Very high95.6Very high5 Ų534 Ų343%0.02619%0.186CC..Hα-helixtrans-69-38.8-178-68.3173.5000111.7T82 F85 W94 M100 C101 G106 L107 Y108T82-L104 HydrophobicContact CG2-CB 4.42Å; T82-L104 HydrophobicContact CG2-CD2 4Å; T82-L104 WeakPolarHBondContact CG2-O 3.39Å; F85-L104 HydrophobicContact CB-CD1 3.51Å; F85-L104 HydrophobicContact CD1-CD1 3.57Å; F85-L104 HydrophobicContact CD2-CD1 3.77Å; F85-L104 HydrophobicContact CD2-CD2 3.71Å; F85-L104 HydrophobicContact CD2-CG 4.43Å; F85-L104 HydrophobicContact CE1-CD1 4.18Å; F85-L104 HydrophobicContact CE2-CD1 4.36Å; F85-L104 HydrophobicContact CE2-CD2 3.91Å; F85-L104 HydrophobicContact CG-CD1 3.33Å; F85-L104 HydrophobicContact CG-CD2 4.18Å; F85-L104 HydrophobicContact CG-CG 4.42Å; W94-L104 HydrophobicContact CH2-CD1 3.61Å; W94-L104 HydrophobicContact CZ2-CD1 4.13Å; M100-L104 HydrophobicContact CG-CD1 3.54Å; M100-L104 HydrophobicContact CG-CG 3.96Å; M100-L104 VanDerWaalsContact O-CB 3.31Å; M100-L104 WeakPolarHBondContact O-CB 3.47Å; M100-L104 VanDerWaalsContact O-CG 3.25Å; M100-L104 WeakPolarHBondContact O-CG 3.4Å; M100-L104 PolarHBondContact O-N 3.3Å; M100-L104 HydrophobicContact SD-CD1 4.17Å; M100-L104 HydrophobicContact SD-CD2 4.47Å; M100-L104 HydrophobicContact SD-CG 4.07Å; C101-L104 PolarHBondContact O-N 2.91Å; L104-G106 VanDerWaalsContact C-N 3.28Å; L104-G106 PolarHBondContact O-N 3.41Å; L104-L107 PolarHBondContact O-N 2.96Å; L104-Y108 VanDerWaalsContact O-CB 3.3Å; L104-Y108 WeakPolarHBondContact O-CB 3.35Å; L104-Y108 PolarHBondContact O-N 3.31Å
105T95.8Very high95.8Very high9 Ų934.2 Ų34.26%0.05519%0.189CC..Hα-helixtrans-61.1-39.4169.9-62.80000111.4C101 Y108 F109 T167C101-T105 VanDerWaalsContact O-CB 3.3Å; C101-T105 WeakPolarHBondContact O-CB 3.4Å; C101-T105 PolarHBondContact O-N 3.36Å; C101-T105 PolarHBondContact O-OG1 3.31Å; T105-Y108 PolarHBondContact O-N 3.34Å; T105-F109 HydrophobicContact CG2-CD2 3.64Å; T105-F109 HydrophobicContact CG2-CE2 3.53Å; T105-F109 VanDerWaalsContact O-CD2 3.26Å; T105-F109 WeakPolarHBondContact O-CD2 3.48Å; T105-F109 PolarHBondContact O-N 3.1Å; T105-T167 HydrophobicContact CG2-CG2 4.12Å; T105-T167 WeakPolarHBondContact OG1-CG2 3.43Å
106G96.7Very high95.9Very high4 Ų430.1 Ų30.14%0.04117%0.167CC..Hα-helixtrans-60.6-51.9173.700000112.5Q102 L103 L104 Y108 F109 I110Q102-G106 PolarHBondContact O-N 2.86Å; L103-G106 WeakPolarHBondContact O-CA 3.34Å; L103-G106 PolarHBondContact O-N 3.21Å; L103-G106 VanDerWaalsContact O-N 3.16Å; L104-G106 VanDerWaalsContact C-N 3.28Å; L104-G106 PolarHBondContact O-N 3.41Å; G106-Y108 VanDerWaalsContact C-N 3.3Å; G106-Y108 PolarHBondContact O-N 3.44Å; G106-F109 PolarHBondContact O-N 3.5Å; G106-I110 VanDerWaalsContact O-CB 3.26Å; G106-I110 WeakPolarHBondContact O-CB 3.48Å; G106-I110 WeakPolarHBondContact O-CD1 3.5Å; G106-I110 WeakPolarHBondContact O-CG1 3.43Å; G106-I110 PolarHBondContact O-N 2.98Å
107L97.3Very high96.2Very high39 Ų3927.8 Ų27.820%0.20416%0.157CC..Hα-helixtrans-60.7-39177.7-71.8174.9000112.4F78 T82 L103 L104 G111F78-L107 HydrophobicContact CB-CD2 4.49Å; F78-L107 HydrophobicContact CD1-CD2 4.5Å; F78-L107 HydrophobicContact CG-CD2 4.35Å; T82-L107 HydrophobicContact CG2-CB 3.57Å; L103-L107 HydrophobicContact CG-CD1 4.41Å; L103-L107 PolarHBondContact O-N 3.01Å; L104-L107 PolarHBondContact O-N 2.96Å; L107-G111 PolarHBondContact O-N 2.92Å
108Y96.3Very high96.3Very high13 Ų1326.2 Ų26.25%0.05114%0.141CC..Hα-helixtrans-59.1-53.8174.9174.1-86.6000111.1F79 L104 T105 G106 G111 F112 M287F79-Y108 HydrophobicContact CD2-CD2 4.04Å; F79-Y108 HydrophobicContact CD2-CE2 4.34Å; F79-Y108 HydrophobicContact CE1-CE2 4.44Å; F79-Y108 AromaticContact CE2-CD2 3.39Å; F79-Y108 HydrophobicContact CE2-CD2 3.39Å; F79-Y108 HydrophobicContact CE2-CE1 4.5Å; F79-Y108 AromaticContact CE2-CE2 3.27Å; F79-Y108 HydrophobicContact CE2-CE2 3.27Å; F79-Y108 HydrophobicContact CE2-CG 4.11Å; F79-Y108 AromaticContact CE2-CZ 3.87Å; F79-Y108 AromaticContact CZ-CD2 3.75Å; F79-Y108 HydrophobicContact CZ-CD2 3.75Å; F79-Y108 AromaticContact CZ-CE2 3.34Å; F79-Y108 HydrophobicContact CZ-CE2 3.34Å; L104-Y108 VanDerWaalsContact O-CB 3.3Å; L104-Y108 WeakPolarHBondContact O-CB 3.35Å; L104-Y108 PolarHBondContact O-N 3.31Å; T105-Y108 PolarHBondContact O-N 3.34Å; G106-Y108 VanDerWaalsContact C-N 3.3Å; G106-Y108 PolarHBondContact O-N 3.44Å; Y108-G111 PolarHBondContact O-N 3.04Å; Y108-F112 WeakPolarHBondContact O-CB 3.01Å; Y108-F112 PolarHBondContact O-N 3.32Å; Y108-M287 HydrophobicContact CE2-CE 3.85Å
109F96.4Very high96.4Very high22 Ų2223.5 Ų23.510%0.09613%0.126CC..Hα-helixtrans-69.9-37.6-178.9-78.3-60.3000112.7T105 G106 F112 F113 S160 I198T105-F109 HydrophobicContact CG2-CD2 3.64Å; T105-F109 HydrophobicContact CG2-CE2 3.53Å; T105-F109 VanDerWaalsContact O-CD2 3.26Å; T105-F109 WeakPolarHBondContact O-CD2 3.48Å; T105-F109 PolarHBondContact O-N 3.1Å; G106-F109 PolarHBondContact O-N 3.5Å; F109-F112 PolarHBondContact O-N 3.39Å; F109-F113 HydrophobicContact CB-CD2 4.22Å; F109-F113 HydrophobicContact CB-CE2 4.14Å; F109-F113 AromaticContact CD1-CE2 3.91Å; F109-F113 HydrophobicContact CD1-CE2 3.91Å; F109-F113 HydrophobicContact CD1-CZ 4.49Å; F109-F113 HydrophobicContact CG-CE2 4.36Å; F109-F113 WeakPolarHBondContact O-CD2 3.37Å; F109-F113 PolarHBondContact O-N 2.95Å; F109-S160 VanDerWaalsContact C-OG 3.24Å; F109-S160 WeakPolarHBondContact CB-OG 3.22Å; F109-I198 HydrophobicContact CE1-CD1 4.08Å
110I97.8Very high96.5Very high25 Ų2518.8 Ų18.813%0.12810%0.097CC..Hα-helixtrans-60.1-49.8175.9-73.4167.3000109.1F78 G106 F112 F113 S114 W153 V157 S160F78-I110 HydrophobicContact CD2-CG2 4.02Å; F78-I110 HydrophobicContact CE2-CG2 4.48Å; G106-I110 VanDerWaalsContact O-CB 3.26Å; G106-I110 WeakPolarHBondContact O-CB 3.48Å; G106-I110 WeakPolarHBondContact O-CD1 3.5Å; G106-I110 WeakPolarHBondContact O-CG1 3.43Å; G106-I110 PolarHBondContact O-N 2.98Å; I110-F112 VanDerWaalsContact C-N 3.32Å; I110-F112 PolarHBondContact O-N 3.07Å; I110-F113 PolarHBondContact O-N 3.29Å; I110-S114 WeakPolarHBondContact O-CB 3.39Å; I110-S114 PolarHBondContact O-N 3.39Å; I110-S114 PolarHBondContact O-OG 3.21Å; I110-W153 HydrophobicContact CG2-CE3 4.08Å; I110-W153 HydrophobicContact CG2-CZ3 3.59Å; I110-V157 HydrophobicContact CD1-CG2 4.01Å; I110-V157 HydrophobicContact CG1-CG2 4.22Å; I110-S160 WeakPolarHBondContact CG1-OG 3.47Å; I110-S160 PolarHBondContact N-OG 3.19Å; I110-S160 VanDerWaalsContact N-OG 3.17Å
111G97Very high96.6Very high4 Ų417.4 Ų17.44%0.0419%0.091CC..Hα-helixtrans-65.4-31.8177.200000113.6S75 L107 Y108 G115S75-G111 PolarHBondContact OG-O 3.5Å; L107-G111 PolarHBondContact O-N 2.92Å; Y108-G111 PolarHBondContact O-N 3.04Å; G111-G115 PolarHBondContact O-N 3.02Å
112F95.9Very high96.4Very high10 Ų1017.5 Ų17.54%0.0449%0.091CC..Hα-helixtrans-68-53.2173.6173.6-100.9000112Y108 F109 I110 G115 I116 I198 W248Y108-F112 WeakPolarHBondContact O-CB 3.01Å; Y108-F112 PolarHBondContact O-N 3.32Å; F109-F112 PolarHBondContact O-N 3.39Å; I110-F112 VanDerWaalsContact C-N 3.32Å; I110-F112 PolarHBondContact O-N 3.07Å; F112-G115 PolarHBondContact O-N 2.98Å; F112-I116 PolarHBondContact O-N 3.42Å; F112-I198 HydrophobicContact CE1-CG2 4.24Å; F112-I198 HydrophobicContact CZ-CG2 4.3Å; F112-W248 HydrophobicContact CD2-CD2 4.2Å; F112-W248 HydrophobicContact CD2-CE3 4.06Å; F112-W248 AromaticContact CD2-CH2 3.58Å; F112-W248 HydrophobicContact CD2-CH2 3.58Å; F112-W248 AromaticContact CD2-CZ2 3.75Å; F112-W248 HydrophobicContact CD2-CZ2 3.75Å; F112-W248 AromaticContact CD2-CZ3 3.75Å; F112-W248 HydrophobicContact CD2-CZ3 3.75Å; F112-W248 AromaticContact CE2-CD2 3.69Å; F112-W248 HydrophobicContact CE2-CD2 3.69Å; F112-W248 AromaticContact CE2-CE3 3.47Å; F112-W248 HydrophobicContact CE2-CE3 3.47Å; F112-W248 VanDerWaalsContact CE2-CE3 3.47Å; F112-W248 HydrophobicContact CE2-CG 4.4Å; F112-W248 AromaticContact CE2-CH2 3.89Å; F112-W248 HydrophobicContact CE2-CH2 3.89Å; F112-W248 HydrophobicContact CE2-CZ2 4.11Å; F112-W248 AromaticContact CE2-CZ3 3.57Å; F112-W248 HydrophobicContact CE2-CZ3 3.57Å; F112-W248 HydrophobicContact CZ-CE3 4.46Å
113F97.4Very high96.3Very high0 Ų014.9 Ų14.90%08%0.079CC..Hα-helixtrans-70.8-45.2-176.1-73.3-58.2000112.5F109 I110 G115 I116 F117 A156 A159 K197 I198 L201F109-F113 HydrophobicContact CB-CD2 4.22Å; F109-F113 HydrophobicContact CB-CE2 4.14Å; F109-F113 AromaticContact CD1-CE2 3.91Å; F109-F113 HydrophobicContact CD1-CE2 3.91Å; F109-F113 HydrophobicContact CD1-CZ 4.49Å; F109-F113 HydrophobicContact CG-CE2 4.36Å; F109-F113 WeakPolarHBondContact O-CD2 3.37Å; F109-F113 PolarHBondContact O-N 2.95Å; I110-F113 PolarHBondContact O-N 3.29Å; F113-G115 PolarHBondContact O-N 3.13Å; F113-I116 WeakPolarHBondContact O-CG2 3.16Å; F113-I116 PolarHBondContact O-N 3.17Å; F113-F117 HydrophobicContact CB-CE2 4.04Å; F113-F117 HydrophobicContact CB-CZ 4.4Å; F113-F117 WeakPolarHBondContact O-CB 3.39Å; F113-F117 VanDerWaalsContact O-CD2 3.23Å; F113-F117 WeakPolarHBondContact O-CD2 3.37Å; F113-F117 WeakPolarHBondContact O-CG 3.4Å; F113-F117 PolarHBondContact O-N 2.89Å; F113-A156 HydrophobicContact CB-CB 4.04Å; F113-A159 HydrophobicContact CD1-CB 4.41Å; F113-A159 HydrophobicContact CD2-CB 3.81Å; F113-A159 HydrophobicContact CE2-CB 4.09Å; F113-A159 HydrophobicContact CG-CB 4.02Å; F113-K197 HydrophobicContact CZ-CD 4.48Å; F113-I198 HydrophobicContact CZ-CG1 4.25Å; F113-L201 HydrophobicContact CD1-CB 4.26Å; F113-L201 HydrophobicContact CD1-CD1 4.27Å; F113-L201 HydrophobicContact CE1-CB 4.02Å; F113-L201 HydrophobicContact CE1-CD1 4Å
114S97.9Very high96.2Very high0 Ų013 Ų130%07%0.069CC..Hα-helixtrans-65.4-33.8178.166.60000111S75 I110 I116 F117 F118 W153S75-S114 WeakPolarHBondContact CB-OG 3.26Å; S75-S114 PolarHBondContact OG-OG 2.7Å; I110-S114 WeakPolarHBondContact O-CB 3.39Å; I110-S114 PolarHBondContact O-N 3.39Å; I110-S114 PolarHBondContact O-OG 3.21Å; S114-I116 PolarHBondContact O-N 2.84Å; S114-F117 PolarHBondContact O-N 3.47Å; S114-F118 WeakPolarHBondContact O-CD2 3.35Å; S114-F118 PolarHBondContact O-N 2.85Å; S114-W153 WeakPolarHBondContact OG-CH2 3.37Å; S114-W153 WeakPolarHBondContact OG-CZ3 3.35Å
115G96.6Very high95.9Very high7 Ų712.9 Ų12.97%0.0727%0.068CC..Hα-helixtrans-56.2-53.317500000112.3L72 S75 G111 F112 F113 F118 I119L72-G115 WeakPolarHBondContact CD1-O 3.33Å; S75-G115 VanDerWaalsContact OG-CA 3.25Å; S75-G115 WeakPolarHBondContact OG-CA 3.15Å; S75-G115 PolarHBondContact OG-N 3.16Å; G111-G115 PolarHBondContact O-N 3.02Å; F112-G115 PolarHBondContact O-N 2.98Å; F113-G115 PolarHBondContact O-N 3.13Å; G115-F118 PolarHBondContact O-N 2.79Å; G115-I119 WeakPolarHBondContact O-CG1 3.49Å; G115-I119 PolarHBondContact O-N 3.12Å; G115-I119 VanDerWaalsContact O-N 3.1Å
116I96.4Very high95.6Very high0 Ų014.3 Ų14.30%07%0.072CC..Hα-helixtrans-68.1-36.4178.4-170.750.8000112.7F112 F113 S114 F118 I119 I120 P206 Y244F112-I116 PolarHBondContact O-N 3.42Å; F113-I116 WeakPolarHBondContact O-CG2 3.16Å; F113-I116 PolarHBondContact O-N 3.17Å; S114-I116 PolarHBondContact O-N 2.84Å; I116-F118 PolarHBondContact O-N 2.85Å; I116-I119 HydrophobicContact CD1-CB 4.3Å; I116-I119 HydrophobicContact CD1-CG2 4.4Å; I116-I119 PolarHBondContact O-N 3.45Å; I116-I120 HydrophobicContact CG1-CD1 4.18Å; I116-I120 WeakPolarHBondContact O-CG1 3.46Å; I116-I120 PolarHBondContact O-N 3.35Å; I116-P206 HydrophobicContact CD1-CB 3.57Å; I116-P206 HydrophobicContact CD1-CG 3.83Å; I116-P206 HydrophobicContact CG1-CB 4Å; I116-P206 HydrophobicContact CG1-CG 3.87Å; I116-Y244 HydrophobicContact CB-CE2 4.14Å; I116-Y244 HydrophobicContact CD1-CD1 3.71Å; I116-Y244 HydrophobicContact CD1-CD2 4.24Å; I116-Y244 HydrophobicContact CD1-CE1 3.33Å; I116-Y244 HydrophobicContact CD1-CE2 3.91Å; I116-Y244 HydrophobicContact CD1-CG 4.15Å; I116-Y244 VanDerWaalsContact CD1-CZ 3.44Å; I116-Y244 HydrophobicContact CG1-CE1 3.98Å; I116-Y244 HydrophobicContact CG1-CE2 4.36Å
117F97.8Very high95.3Very high22 Ų2216.4 Ų16.410%0.0968%0.079CC..Hα-helixtrans-63.6-40.7175.9-64.4-23.4000112.3F113 S114 I120 L121 V155 A156 L201F113-F117 HydrophobicContact CB-CE2 4.04Å; F113-F117 HydrophobicContact CB-CZ 4.4Å; F113-F117 WeakPolarHBondContact O-CB 3.39Å; F113-F117 VanDerWaalsContact O-CD2 3.23Å; F113-F117 WeakPolarHBondContact O-CD2 3.37Å; F113-F117 WeakPolarHBondContact O-CG 3.4Å; F113-F117 PolarHBondContact O-N 2.89Å; S114-F117 PolarHBondContact O-N 3.47Å; F117-I120 HydrophobicContact CD1-CD1 4.45Å; F117-I120 PolarHBondContact O-N 2.83Å; F117-L121 WeakPolarHBondContact O-CB 3.27Å; F117-L121 VanDerWaalsContact O-CG 3.3Å; F117-L121 WeakPolarHBondContact O-CG 3.35Å; F117-L121 PolarHBondContact O-N 3.26Å; F117-V155 HydrophobicContact CE2-CB 4.36Å; F117-V155 HydrophobicContact CE2-CG1 3.72Å; F117-V155 HydrophobicContact CZ-CG1 4.09Å; F117-A156 HydrophobicContact CD2-CB 4.21Å; F117-A156 HydrophobicContact CE2-CB 4.23Å; F117-L201 HydrophobicContact CZ-CD1 4.41Å
118F97.1Very high94.9Very high0 Ų016.3 Ų16.30%08%0.079CC..Hα-helixtrans-69.2-33175.5-74.7-61.9000112.6Y68 N71 L72 S114 G115 I116 L121 L122 A152 W153Y68-F118 HydrophobicContact CD1-CD1 4.06Å; Y68-F118 HydrophobicContact CD1-CE1 4.23Å; N71-F118 HydrophobicContact CB-CD1 3.74Å; N71-F118 HydrophobicContact CB-CD2 3.76Å; N71-F118 HydrophobicContact CB-CE1 3.41Å; N71-F118 VanDerWaalsContact CB-CE1 3.41Å; N71-F118 HydrophobicContact CB-CE2 3.46Å; N71-F118 VanDerWaalsContact CB-CE2 3.46Å; N71-F118 HydrophobicContact CB-CG 3.94Å; N71-F118 HydrophobicContact CB-CZ 3.29Å; L72-F118 HydrophobicContact CB-CB 4.11Å; L72-F118 HydrophobicContact CD1-CB 4.35Å; S114-F118 WeakPolarHBondContact O-CD2 3.35Å; S114-F118 PolarHBondContact O-N 2.85Å; G115-F118 PolarHBondContact O-N 2.79Å; I116-F118 PolarHBondContact O-N 2.85Å; F118-L121 HydrophobicContact CD1-CD1 4.02Å; F118-L121 HydrophobicContact CE1-CD1 4.17Å; F118-L121 PolarHBondContact O-N 2.99Å; F118-L122 WeakPolarHBondContact O-CB 3.34Å; F118-L122 VanDerWaalsContact O-CG 3.24Å; F118-L122 WeakPolarHBondContact O-CG 3.38Å; F118-L122 PolarHBondContact O-N 3.44Å; F118-A152 HydrophobicContact CE1-CB 4.23Å; F118-A152 HydrophobicContact CZ-CB 4.01Å; F118-W153 HydrophobicContact CE2-CD2 4.41Å; F118-W153 AromaticContact CE2-CE2 3.84Å; F118-W153 HydrophobicContact CE2-CZ2 4.11Å; F118-W153 AromaticContact CE2-NE1 3.77Å; F118-W153 AromaticContact CZ-CD1 3.9Å; F118-W153 AromaticContact CZ-NE1 3.62Å
119I95.1Very high94.4Very high3 Ų317 Ų172%0.0159%0.087CC..Hα-helixtrans-63.4-44.7170.6-69.1171.4000110.8L72 G115 I116 L122 T123 I240 M241 Y244L72-I119 HydrophobicContact CD1-CD1 4.44Å; L72-I119 HydrophobicContact CD1-CG1 4.05Å; L72-I119 HydrophobicContact CD2-CG1 4.1Å; G115-I119 WeakPolarHBondContact O-CG1 3.49Å; G115-I119 PolarHBondContact O-N 3.12Å; G115-I119 VanDerWaalsContact O-N 3.1Å; I116-I119 HydrophobicContact CD1-CB 4.3Å; I116-I119 HydrophobicContact CD1-CG2 4.4Å; I116-I119 PolarHBondContact O-N 3.45Å; I119-L122 WeakPolarHBondContact O-CB 3.22Å; I119-L122 PolarHBondContact O-N 2.99Å; I119-T123 PolarHBondContact O-N 2.98Å; I119-T123 PolarHBondContact O-OG1 3.29Å; I119-I240 HydrophobicContact CD1-CG2 4.15Å; I119-I240 HydrophobicContact CG1-CG2 4.08Å; I119-M241 HydrophobicContact CG2-CE 3.46Å; I119-M241 VanDerWaalsContact CG2-CE 3.46Å; I119-M241 HydrophobicContact CG2-SD 3.66Å; I119-Y244 HydrophobicContact CD1-CD2 3.85Å; I119-Y244 HydrophobicContact CD1-CG 4.17Å
120I96.2Very high93.8Very high14 Ų1416.6 Ų16.67%0.0729%0.086CC..Hα-helixtrans-59.7-48.2174.8-73165.2000110.8I116 F117 L122 T123 I124 L205 P206 V209I116-I120 HydrophobicContact CG1-CD1 4.18Å; I116-I120 WeakPolarHBondContact O-CG1 3.46Å; I116-I120 PolarHBondContact O-N 3.35Å; F117-I120 HydrophobicContact CD1-CD1 4.45Å; F117-I120 PolarHBondContact O-N 2.83Å; I120-L122 VanDerWaalsContact C-N 3.31Å; I120-L122 PolarHBondContact O-N 3.45Å; I120-T123 PolarHBondContact O-N 2.94Å; I120-T123 VanDerWaalsContact O-N 3.11Å; I120-I124 HydrophobicContact CG2-CD1 3.79Å; I120-I124 HydrophobicContact CG2-CG1 4.47Å; I120-I124 WeakPolarHBondContact O-CG1 3.03Å; I120-I124 PolarHBondContact O-N 3.22Å; I120-L205 HydrophobicContact CD1-CD2 3.99Å; I120-L205 HydrophobicContact CD1-CG 4.01Å; I120-P206 HydrophobicContact CD1-CB 4.03Å; I120-P206 HydrophobicContact CG1-CB 4.01Å; I120-V209 HydrophobicContact CG2-CG1 4.24Å; I120-V209 HydrophobicContact CG2-CG2 4.07Å
121L96Very high93.3Very high33 Ų3317.3 Ų17.317%0.1739%0.092CC..Hα-helixtrans-62.5-37.2178.6-72.9173.7000112.2Y68 F117 F118 I124 D125 A152Y68-L121 HydrophobicContact CD2-CB 4.02Å; Y68-L121 HydrophobicContact CE1-CB 4.32Å; Y68-L121 HydrophobicContact CE1-CD1 4.04Å; Y68-L121 HydrophobicContact CE2-CB 3.76Å; Y68-L121 HydrophobicContact CG-CB 4.38Å; F117-L121 WeakPolarHBondContact O-CB 3.27Å; F117-L121 VanDerWaalsContact O-CG 3.3Å; F117-L121 WeakPolarHBondContact O-CG 3.35Å; F117-L121 PolarHBondContact O-N 3.26Å; F118-L121 HydrophobicContact CD1-CD1 4.02Å; F118-L121 HydrophobicContact CE1-CD1 4.17Å; F118-L121 PolarHBondContact O-N 2.99Å; L121-I124 PolarHBondContact O-N 2.96Å; L121-D125 VanDerWaalsContact O-CB 3.24Å; L121-D125 WeakPolarHBondContact O-CB 3.28Å; L121-D125 PolarHBondContact O-N 3.21Å; L121-A152 HydrophobicContact CD1-CB 3.98Å
122L93.2Very high92.7Very high1 Ų121.1 Ų21.11%0.00511%0.108CC..Hα-helixtrans-62.3-43.7171.8-78167.2000111.6T65 Y68 L69 L72 F118 I119 I120 D125 R126 I237T65-L122 HydrophobicContact CG2-CD2 3.68Å; Y68-L122 HydrophobicContact CD2-CD2 4.31Å; L69-L122 HydrophobicContact CD2-CD1 3.9Å; L69-L122 HydrophobicContact CD2-CD2 4.26Å; L69-L122 HydrophobicContact CG-CD2 4.15Å; L72-L122 HydrophobicContact CD2-CD1 3.97Å; F118-L122 WeakPolarHBondContact O-CB 3.34Å; F118-L122 VanDerWaalsContact O-CG 3.24Å; F118-L122 WeakPolarHBondContact O-CG 3.38Å; F118-L122 PolarHBondContact O-N 3.44Å; I119-L122 WeakPolarHBondContact O-CB 3.22Å; I119-L122 PolarHBondContact O-N 2.99Å; I120-L122 VanDerWaalsContact C-N 3.31Å; I120-L122 PolarHBondContact O-N 3.45Å; L122-D125 PolarHBondContact O-N 2.82Å; L122-R126 WeakPolarHBondContact O-CG 3.37Å; L122-R126 PolarHBondContact O-N 3.47Å; L122-I237 HydrophobicContact CB-CD1 4.36Å; L122-I237 HydrophobicContact CB-CG2 4.42Å; L122-I237 HydrophobicContact CD2-CD1 4.45Å
123T92.6Very high92Very high0 Ų023.3 Ų23.30%013%0.128CC..Hα-helixtrans-64.2-43.3177.2-66.70000111.8I119 I120 R126 Y127 V209 C213 Y214 I237 M241I119-T123 PolarHBondContact O-N 2.98Å; I119-T123 PolarHBondContact O-OG1 3.29Å; I120-T123 PolarHBondContact O-N 2.94Å; I120-T123 VanDerWaalsContact O-N 3.11Å; T123-R126 PolarHBondContact O-N 3.44Å; T123-Y127 WeakPolarHBondContact O-CB 3.19Å; T123-Y127 PolarHBondContact O-N 3Å; T123-V209 HydrophobicContact CG2-CG1 4.02Å; T123-C213 HydrophobicContact CG2-CB 3.69Å; T123-Y214 HydrophobicContact CG2-CE2 3.91Å; T123-I237 WeakPolarHBondContact OG1-CG2 3.45Å; T123-M241 HydrophobicContact CG2-CE 4.37Å; T123-M241 WeakPolarHBondContact OG1-CE 3.41Å
124I93.3Very high91.1Very high62 Ų6229.4 Ų29.432%0.31817%0.165SC..Hα-helixtrans-64.7-44.5175.8-65.1168.9000110.8I120 L121 R126 Y127 L128 V209I120-I124 HydrophobicContact CG2-CD1 3.79Å; I120-I124 HydrophobicContact CG2-CG1 4.47Å; I120-I124 WeakPolarHBondContact O-CG1 3.03Å; I120-I124 PolarHBondContact O-N 3.22Å; L121-I124 PolarHBondContact O-N 2.96Å; I124-R126 VanDerWaalsContact C-N 3.29Å; I124-R126 PolarHBondContact O-N 2.9Å; I124-Y127 WeakPolarHBondContact O-CB 3.25Å; I124-Y127 PolarHBondContact O-N 3.43Å; I124-Y127 VanDerWaalsContact O-N 3.16Å; I124-L128 HydrophobicContact CG2-CD1 4.04Å; I124-L128 HydrophobicContact CG2-CG 4.28Å; I124-L128 WeakPolarHBondContact O-CG 3.42Å; I124-L128 PolarHBondContact O-N 3.09Å; I124-V209 HydrophobicContact CG1-CG1 4.2Å
125D91.1Very high90.2Very high3 Ų335.6 Ų35.62%0.01619%0.193CC..Hα-helixtrans-57.2-42.3176168.374.9000111.9T65 Y68 L121 L122 A129 R140T65-D125 PolarHBondContact OG1-OD2 2.93Å; Y68-D125 HydrophobicContact CD2-CB 4.3Å; Y68-D125 HydrophobicContact CE2-CB 4.07Å; L121-D125 VanDerWaalsContact O-CB 3.24Å; L121-D125 WeakPolarHBondContact O-CB 3.28Å; L121-D125 PolarHBondContact O-N 3.21Å; L122-D125 PolarHBondContact O-N 2.82Å; D125-A129 WeakPolarHBondContact O-CB 3.38Å; D125-A129 PolarHBondContact O-N 3.38Å; D125-A129 VanDerWaalsContact O-N 3.14Å; D125-R140 PolarHBondContact O-NE 3.4Å; D125-R140 IonicContact OD1-CZ 3.49Å; D125-R140 IonicContact OD1-NE 3.71Å; D125-R140 PolarHBondContact OD1-NE 3.15Å; D125-R140 IonicContact OD1-NH2 3.53Å; D125-R140 PolarHBondContact OD1-NH2 3.34Å; D125-R140 IonicContact OD2-NH2 2.64Å; D125-R140 PolarHBondContact OD2-NH2 3.46Å
126R89.2Confident89.2Confident39 Ų3935.7 Ų35.715%0.14719%0.192CC..Hα-helixtrans-68.4-42.5174.6-69.8-54.586.9-171.14.9112.7T65 L122 T123 I124 A129 V130 I237T65-R126 PolarHBondContact OG1-NH2 3.41Å; L122-R126 WeakPolarHBondContact O-CG 3.37Å; L122-R126 PolarHBondContact O-N 3.47Å; T123-R126 PolarHBondContact O-N 3.44Å; I124-R126 VanDerWaalsContact C-N 3.29Å; I124-R126 PolarHBondContact O-N 2.9Å; R126-A129 PolarHBondContact O-N 3.48Å; R126-V130 WeakPolarHBondContact O-CG2 3.34Å; R126-V130 PolarHBondContact O-N 3.1Å; R126-V130 VanDerWaalsContact O-N 3.08Å; R126-I237 HydrophobicContact CG-CB 4.09Å; R126-I237 HydrophobicContact CG-CG1 3.48Å; R126-I237 VanDerWaalsContact CG-CG1 3.48Å; R126-I237 HydrophobicContact CG-CG2 4.32Å
127Y89.9Confident88.3Confident47 Ų4743 Ų4318%0.18423%0.23CC..Hα-helixtrans-57.6-51.5177.8173.6-100.3000111.1T123 I124 A129 V130 V131 H132 C213 I217T123-Y127 WeakPolarHBondContact O-CB 3.19Å; T123-Y127 PolarHBondContact O-N 3Å; I124-Y127 WeakPolarHBondContact O-CB 3.25Å; I124-Y127 PolarHBondContact O-N 3.43Å; I124-Y127 VanDerWaalsContact O-N 3.16Å; Y127-A129 VanDerWaalsContact C-N 3.32Å; Y127-A129 PolarHBondContact O-N 3.49Å; Y127-V130 PolarHBondContact O-N 3.38Å; Y127-V130 VanDerWaalsContact O-N 3.15Å; Y127-V131 HydrophobicContact CD2-CB 4.33Å; Y127-V131 HydrophobicContact CD2-CG2 3.71Å; Y127-V131 HydrophobicContact CE2-CB 4.04Å; Y127-V131 HydrophobicContact CE2-CG1 4.23Å; Y127-V131 HydrophobicContact CE2-CG2 3.59Å; Y127-V131 HydrophobicContact CG-CG2 4.47Å; Y127-V131 WeakPolarHBondContact O-CB 3.43Å; Y127-V131 PolarHBondContact O-N 2.87Å; Y127-H132 AromaticContact CE1-CD2 3.66Å; Y127-H132 AromaticContact CE1-NE2 3.74Å; Y127-H132 AromaticContact CZ-NE2 3.93Å; Y127-C213 VanDerWaalsContact CD2-CA 3.46Å; Y127-C213 HydrophobicContact CD2-CB 3.83Å; Y127-C213 VanDerWaalsContact CD2-O 3.29Å; Y127-C213 WeakPolarHBondContact CD2-O 3.23Å; Y127-C213 HydrophobicContact CG-CB 4.06Å; Y127-I217 HydrophobicContact CD2-CG1 4.16Å
128L89.4Confident87.4Confident38 Ų3850.3 Ų50.320%0.19926%0.262CS..Hα-helixtrans-59.6-43.2178-68175.8000111.4I124 V130 H132 F135 A136I124-L128 HydrophobicContact CG2-CD1 4.04Å; I124-L128 HydrophobicContact CG2-CG 4.28Å; I124-L128 WeakPolarHBondContact O-CG 3.42Å; I124-L128 PolarHBondContact O-N 3.09Å; L128-V130 VanDerWaalsContact C-N 3.27Å; L128-V130 PolarHBondContact O-N 3.29Å; L128-H132 HydrophobicContact CD2-CB 4.43Å; L128-H132 CarbonylContact O-C 3.56Å; L128-H132 WeakPolarHBondContact O-CA 3.36Å; L128-H132 PolarHBondContact O-N 3.24Å; L128-F135 HydrophobicContact CD2-CD1 4.32Å; L128-F135 HydrophobicContact CD2-CE1 4.46Å; L128-A136 WeakPolarHBondContact O-CB 3.28Å
129A86.6Confident86.4Confident26 Ų2651.4 Ų51.422%0.21527%0.271CS..Hα-helixtrans-62.5-30.4178.700000114D125 R126 Y127D125-A129 WeakPolarHBondContact O-CB 3.38Å; D125-A129 PolarHBondContact O-N 3.38Å; D125-A129 VanDerWaalsContact O-N 3.14Å; R126-A129 PolarHBondContact O-N 3.48Å; Y127-A129 VanDerWaalsContact C-N 3.32Å; Y127-A129 PolarHBondContact O-N 3.49Å
130V84.1Confident86.1Confident14 Ų1454.4 Ų54.49%0.08528%0.283CS..Hα-helixtrans-94.8-46.5-175.8173.10000112.2R126 Y127 L128 I217 T220 R230 V234R126-V130 WeakPolarHBondContact O-CG2 3.34Å; R126-V130 PolarHBondContact O-N 3.1Å; R126-V130 VanDerWaalsContact O-N 3.08Å; Y127-V130 PolarHBondContact O-N 3.38Å; Y127-V130 VanDerWaalsContact O-N 3.15Å; L128-V130 VanDerWaalsContact C-N 3.27Å; L128-V130 PolarHBondContact O-N 3.29Å; V130-I217 HydrophobicContact CB-CG1 4.38Å; V130-I217 HydrophobicContact CG1-CG1 4.39Å; V130-I217 HydrophobicContact CG1-CG2 4.3Å; V130-T220 HydrophobicContact CG1-CG2 4.24Å; V130-R230 HydrophobicContact CG2-CG 3.9Å; V130-V234 HydrophobicContact CG2-CG2 4.08Å
131V86.6Confident85.7Confident40 Ų4056.2 Ų56.224%0.24229%0.294CS..Hα-helixtrans-90.6-35.1-171.4-176.70000111.5Y127 I217Y127-V131 HydrophobicContact CD2-CB 4.33Å; Y127-V131 HydrophobicContact CD2-CG2 3.71Å; Y127-V131 HydrophobicContact CE2-CB 4.04Å; Y127-V131 HydrophobicContact CE2-CG1 4.23Å; Y127-V131 HydrophobicContact CE2-CG2 3.59Å; Y127-V131 HydrophobicContact CG-CG2 4.47Å; Y127-V131 WeakPolarHBondContact O-CB 3.43Å; Y127-V131 PolarHBondContact O-N 2.87Å; V131-I217 HydrophobicContact CG2-CG1 4.26Å
132H85.1Confident85.4Confident85 Ų8557.9 Ų57.939%0.39431%0.305SS..  trans-12251.3-175.2-60.9-71.4000112Y127 L128 V134 F135 A136Y127-H132 AromaticContact CE1-CD2 3.66Å; Y127-H132 AromaticContact CE1-NE2 3.74Å; Y127-H132 AromaticContact CZ-NE2 3.93Å; L128-H132 HydrophobicContact CD2-CB 4.43Å; L128-H132 CarbonylContact O-C 3.56Å; L128-H132 WeakPolarHBondContact O-CA 3.36Å; L128-H132 PolarHBondContact O-N 3.24Å; H132-V134 VanDerWaalsContact C-N 3.29Å; H132-V134 PolarHBondContact O-N 2.7Å; H132-V134 VanDerWaalsContact O-N 3.14Å; H132-F135 HydrophobicContact CB-CB 4.27Å; H132-F135 PolarHBondContact O-N 2.88Å; H132-F135 VanDerWaalsContact O-N 3.13Å; H132-A136 WeakPolarHBondContact O-CB 3.37Å; H132-A136 PolarHBondContact O-N 3.09Å
133A80.2Confident85.4Confident56 Ų5662.7 Ų62.746%0.46334%0.335SS..Hα-helixtrans-53.9-37.2-171.200000114.8A136 L137A133-A136 WeakPolarHBondContact O-CB 3.36Å; A133-A136 PolarHBondContact O-N 2.83Å; A133-L137 PolarHBondContact O-N 3.42Å
134V78.8Confident85.3Confident128 Ų12868.2 Ų68.278%0.77636%0.359SS*.Hα-helixtrans-69.4-45.8179-179.40000111.5H132 A136 L137H132-V134 VanDerWaalsContact C-N 3.29Å; H132-V134 PolarHBondContact O-N 2.7Å; H132-V134 VanDerWaalsContact O-N 3.14Å; V134-A136 VanDerWaalsContact C-N 3.31Å; V134-A136 PolarHBondContact O-N 3.42Å; V134-L137 PolarHBondContact O-N 2.81Å
135F78.8Confident85.3Confident130 Ų13065.2 Ų65.257%0.5734%0.344SS*.Hα-helixtrans-64.9-38.2175.4178.3-100.9000111.6L128 H132 L137 K138 A139L128-F135 HydrophobicContact CD2-CD1 4.32Å; L128-F135 HydrophobicContact CD2-CE1 4.46Å; H132-F135 HydrophobicContact CB-CB 4.27Å; H132-F135 PolarHBondContact O-N 2.88Å; H132-F135 VanDerWaalsContact O-N 3.13Å; F135-L137 VanDerWaalsContact C-N 3.25Å; F135-L137 PolarHBondContact O-N 3.43Å; F135-K138 PolarHBondContact O-N 3.41Å; F135-K138 VanDerWaalsContact O-N 3.09Å; F135-A139 HydrophobicContact CD1-CB 4.04Å; F135-A139 HydrophobicContact CE1-CB 3.6Å; F135-A139 HydrophobicContact CZ-CB 3.9Å; F135-A139 PolarHBondContact O-N 2.86Å
136A76.7Confident85.6Confident8 Ų868.6 Ų68.67%0.06637%0.365CS..Hα-helixtrans-59.1-31.717900000113.6L128 H132 A133 V134 K138 R140L128-A136 WeakPolarHBondContact O-CB 3.28Å; H132-A136 WeakPolarHBondContact O-CB 3.37Å; H132-A136 PolarHBondContact O-N 3.09Å; A133-A136 WeakPolarHBondContact O-CB 3.36Å; A133-A136 PolarHBondContact O-N 2.83Å; V134-A136 VanDerWaalsContact C-N 3.31Å; V134-A136 PolarHBondContact O-N 3.42Å; A136-K138 VanDerWaalsContact C-N 3.27Å; A136-K138 PolarHBondContact O-N 2.92Å; A136-R140 HydrophobicContact CB-CG 4.21Å; A136-R140 VanDerWaalsContact O-CB 3.23Å; A136-R140 WeakPolarHBondContact O-CB 3.35Å; A136-R140 VanDerWaalsContact O-CG 3.3Å; A136-R140 WeakPolarHBondContact O-CG 3.27Å; A136-R140 PolarHBondContact O-N 3.27Å
137L77.4Confident85.9Confident153 Ų15370.4 Ų70.480%0.80138%0.38SS*.Hα-helixtrans-62.2-34.8176-73.3164.8000112.5A133 V134 F135A133-L137 PolarHBondContact O-N 3.42Å; V134-L137 PolarHBondContact O-N 2.81Å; F135-L137 VanDerWaalsContact C-N 3.25Å; F135-L137 PolarHBondContact O-N 3.43Å
138K78.3Confident86.2Confident176 Ų17670.1 Ų70.177%0.76538%0.383SS*.Hα-helixtrans-88.2-36.2-179.7-169.5176.6-179.6178.80112.7F135 A136F135-K138 PolarHBondContact O-N 3.41Å; F135-K138 VanDerWaalsContact O-N 3.09Å; A136-K138 VanDerWaalsContact C-N 3.27Å; A136-K138 PolarHBondContact O-N 2.92Å
139A77Confident86.6Confident23 Ų2368.5 Ų68.519%0.1938%0.375CS..Hα-helixtrans-89.3-23.6-171.600000114.5F135 T141F135-A139 HydrophobicContact CD1-CB 4.04Å; F135-A139 HydrophobicContact CE1-CB 3.6Å; F135-A139 HydrophobicContact CZ-CB 3.9Å; F135-A139 PolarHBondContact O-N 2.86Å; A139-T141 VanDerWaalsContact C-N 3.29Å; A139-T141 PolarHBondContact O-N 3.38Å; A139-T141 VanDerWaalsContact O-N 3.17Å
140R87Confident87.2Confident67 Ų6771.2 Ų71.225%0.25339%0.389SS..  trans-93.147.7-172.7-60.1176.166.9-122.3-22.5113.3M64 T65 D125 A136M64-R140 HydrophobicContact SD-CB 4Å; M64-R140 HydrophobicContact SD-CG 4.18Å; T65-R140 PolarHBondContact OG1-NH2 3.12Å; D125-R140 PolarHBondContact O-NE 3.4Å; D125-R140 IonicContact OD1-CZ 3.49Å; D125-R140 IonicContact OD1-NE 3.71Å; D125-R140 PolarHBondContact OD1-NE 3.15Å; D125-R140 IonicContact OD1-NH2 3.53Å; D125-R140 PolarHBondContact OD1-NH2 3.34Å; D125-R140 IonicContact OD2-NH2 2.64Å; D125-R140 PolarHBondContact OD2-NH2 3.46Å; A136-R140 HydrophobicContact CB-CG 4.21Å; A136-R140 VanDerWaalsContact O-CB 3.23Å; A136-R140 WeakPolarHBondContact O-CB 3.35Å; A136-R140 VanDerWaalsContact O-CG 3.3Å; A136-R140 WeakPolarHBondContact O-CG 3.27Å; A136-R140 PolarHBondContact O-N 3.27Å
141T88.6Confident87.8Confident52 Ų5275.2 Ų75.232%0.31941%0.409SS..  trans-83.9157.2176.172.70000111.2A139 T143 F144 G145A139-T141 VanDerWaalsContact C-N 3.29Å; A139-T141 PolarHBondContact O-N 3.38Å; A139-T141 VanDerWaalsContact O-N 3.17Å; T141-T143 VanDerWaalsContact C-N 3.26Å; T141-T143 PolarHBondContact O-N 3.19Å; T141-F144 HydrophobicContact CG2-CD2 4.4Å; T141-F144 PolarHBondContact O-N 2.79Å; T141-F144 WeakPolarHBondContact OG1-CD2 3.3Å; T141-F144 PolarHBondContact OG1-N 3.1Å; T141-G145 PolarHBondContact O-N 3.36Å; T141-G145 VanDerWaalsContact O-N 3.08Å
142V90.3Very high88.4Confident67 Ų6773.8 Ų73.841%0.40640%0.401SS..Hα-helixtrans-58.8-41.1174.9169.60000110.6I67 F144 G145 V146I67-V142 HydrophobicContact CD1-CB 4.12Å; I67-V142 HydrophobicContact CD1-CG1 3.65Å; I67-V142 HydrophobicContact CD1-CG2 4.41Å; I67-V142 WeakPolarHBondContact CD1-O 3.39Å; V142-F144 PolarHBondContact O-N 2.9Å; V142-G145 WeakPolarHBondContact O-CA 3.44Å; V142-G145 PolarHBondContact O-N 3.38Å; V142-G145 VanDerWaalsContact O-N 3.13Å; V142-V146 WeakPolarHBondContact O-CG2 3.49Å; V142-V146 PolarHBondContact O-N 3.02Å
143T91.8Very high89Confident103 Ų10371.9 Ų71.963%0.63239%0.39SS*.Hα-helixtrans-58.7-48.4178.5-46.30000112T141 G145 V146 V147T141-T143 VanDerWaalsContact C-N 3.26Å; T141-T143 PolarHBondContact O-N 3.19Å; T143-G145 VanDerWaalsContact C-N 3.3Å; T143-G145 PolarHBondContact O-N 3.12Å; T143-V146 PolarHBondContact O-N 2.93Å; T143-V147 WeakPolarHBondContact O-CG2 3.46Å; T143-V147 PolarHBondContact O-N 3.48Å
144F92.1Very high89.9Confident115 Ų11572.5 Ų72.550%0.50439%0.388SS..Hα-helixtrans-62-40.4175.6-80.5-62.6000111.5T141 V142 V146 V147 T148T141-F144 HydrophobicContact CG2-CD2 4.4Å; T141-F144 PolarHBondContact O-N 2.79Å; T141-F144 WeakPolarHBondContact OG1-CD2 3.3Å; T141-F144 PolarHBondContact OG1-N 3.1Å; V142-F144 PolarHBondContact O-N 2.9Å; F144-V146 VanDerWaalsContact C-N 3.33Å; F144-V146 PolarHBondContact O-N 3.18Å; F144-V147 PolarHBondContact O-N 3.07Å; F144-T148 WeakPolarHBondContact O-CG2 3.22Å; F144-T148 PolarHBondContact O-N 3.43Å; F144-T148 PolarHBondContact O-OG1 2.94Å
145G93.2Very high90.8Very high0 Ų069.8 Ų69.80%037%0.371CS..Hα-helixtrans-59.4-37.9174.600000114.2T141 V142 T143 T148 S149T141-G145 PolarHBondContact O-N 3.36Å; T141-G145 VanDerWaalsContact O-N 3.08Å; V142-G145 WeakPolarHBondContact O-CA 3.44Å; V142-G145 PolarHBondContact O-N 3.38Å; V142-G145 VanDerWaalsContact O-N 3.13Å; T143-G145 VanDerWaalsContact C-N 3.3Å; T143-G145 PolarHBondContact O-N 3.12Å; G145-T148 PolarHBondContact O-OG1 3.42Å; G145-T148 VanDerWaalsContact O-OG1 3.12Å; G145-S149 WeakPolarHBondContact O-CB 3.17Å; G145-S149 PolarHBondContact O-N 3.27Å; G145-S149 VanDerWaalsContact O-N 3.15Å; G145-S149 PolarHBondContact O-OG 2.99Å
146V95.7Very high91.7Very high74 Ų7463.6 Ų63.645%0.44834%0.344SS..Hα-helixtrans-68.6-48.5175.1174.60000110.6I67 V142 T143 F144 T148 S149 V150I67-V146 HydrophobicContact CD1-CG2 4.12Å; V142-V146 WeakPolarHBondContact O-CG2 3.49Å; V142-V146 PolarHBondContact O-N 3.02Å; T143-V146 PolarHBondContact O-N 2.93Å; F144-V146 VanDerWaalsContact C-N 3.33Å; F144-V146 PolarHBondContact O-N 3.18Å; V146-T148 PolarHBondContact O-N 3.4Å; V146-S149 WeakPolarHBondContact O-CB 3.35Å; V146-S149 PolarHBondContact O-N 3.37Å; V146-S149 VanDerWaalsContact O-N 3.16Å; V146-V150 WeakPolarHBondContact O-CG2 3.26Å; V146-V150 PolarHBondContact O-N 3.35Å
147V96.5Very high92.7Very high76 Ų7666 Ų6646%0.46136%0.358SS..Hα-helixtrans-60.1-47.7-179172.90000111.3T143 F144 S149 V150 I151T143-V147 WeakPolarHBondContact O-CG2 3.46Å; T143-V147 PolarHBondContact O-N 3.48Å; F144-V147 PolarHBondContact O-N 3.07Å; V147-S149 VanDerWaalsContact C-N 3.28Å; V147-S149 PolarHBondContact O-N 3.15Å; V147-V150 PolarHBondContact O-N 3.43Å; V147-I151 HydrophobicContact CG1-CD1 4.02Å; V147-I151 WeakPolarHBondContact O-CG1 3.35Å; V147-I151 PolarHBondContact O-N 3.49Å
148T96.5Very high93.6Very high41 Ų4165.3 Ų65.325%0.25235%0.349SS..Hα-helixtrans-64.3-33.5177.5540000112.3Y68 F144 G145 V146 I151 A152Y68-T148 WeakPolarHBondContact CE1-OG1 3.19Å; Y68-T148 WeakPolarHBondContact OH-CB 3.46Å; Y68-T148 PolarHBondContact OH-OG1 3.4Å; F144-T148 WeakPolarHBondContact O-CG2 3.22Å; F144-T148 PolarHBondContact O-N 3.43Å; F144-T148 PolarHBondContact O-OG1 2.94Å; G145-T148 PolarHBondContact O-OG1 3.42Å; G145-T148 VanDerWaalsContact O-OG1 3.12Å; V146-T148 PolarHBondContact O-N 3.4Å; T148-I151 PolarHBondContact O-N 3.1Å; T148-A152 WeakPolarHBondContact O-CB 3.46Å; T148-A152 PolarHBondContact O-N 2.94Å
149S97.7Very high94.4Very high4 Ų457.6 Ų57.63%0.02832%0.318CS..Hα-helixtrans-66.6-43.7175-58.90000111.8N71 G145 V146 V147 I151 A152 W153N71-S149 PolarHBondContact ND2-OG 3.43Å; G145-S149 WeakPolarHBondContact O-CB 3.17Å; G145-S149 PolarHBondContact O-N 3.27Å; G145-S149 VanDerWaalsContact O-N 3.15Å; G145-S149 PolarHBondContact O-OG 2.99Å; V146-S149 WeakPolarHBondContact O-CB 3.35Å; V146-S149 PolarHBondContact O-N 3.37Å; V146-S149 VanDerWaalsContact O-N 3.16Å; V147-S149 VanDerWaalsContact C-N 3.28Å; V147-S149 PolarHBondContact O-N 3.15Å; S149-I151 VanDerWaalsContact C-N 3.33Å; S149-I151 PolarHBondContact O-N 3.37Å; S149-A152 PolarHBondContact O-N 3.44Å; S149-W153 PolarHBondContact O-N 2.88Å
150V98.1Very high95.3Very high84 Ų8456.5 Ų56.551%0.50931%0.309SS..Hα-helixtrans-59.9-45.1175.6172.50000110.6V146 V147 A152 W153 V154V146-V150 WeakPolarHBondContact O-CG2 3.26Å; V146-V150 PolarHBondContact O-N 3.35Å; V147-V150 PolarHBondContact O-N 3.43Å; V150-A152 PolarHBondContact O-N 2.64Å; V150-W153 PolarHBondContact O-N 2.95Å; V150-V154 WeakPolarHBondContact O-CG2 3.25Å; V150-V154 PolarHBondContact O-N 3.01Å
151I98Very high95.7Very high98 Ų9856.5 Ų56.550%0.50331%0.314SS..Hα-helixtrans-60-46.3175.9-65.6166.5000110.5V147 T148 S149 W153 V154 V155V147-I151 HydrophobicContact CG1-CD1 4.02Å; V147-I151 WeakPolarHBondContact O-CG1 3.35Å; V147-I151 PolarHBondContact O-N 3.49Å; T148-I151 PolarHBondContact O-N 3.1Å; S149-I151 VanDerWaalsContact C-N 3.33Å; S149-I151 PolarHBondContact O-N 3.37Å; I151-W153 VanDerWaalsContact C-N 3.31Å; I151-W153 PolarHBondContact O-N 3.43Å; I151-V154 PolarHBondContact O-N 3.36Å; I151-V155 HydrophobicContact CG2-CG2 4.24Å; I151-V155 VanDerWaalsContact O-CG2 3.28Å; I151-V155 WeakPolarHBondContact O-CG2 3.24Å; I151-V155 PolarHBondContact O-N 3.16Å
152A97.9Very high95.8Very high9 Ų955.1 Ų55.17%0.07431%0.306CS..Hα-helixtrans-60.1-40.2179.100000112.5F118 L121 T148 S149 V150 V155 A156F118-A152 HydrophobicContact CE1-CB 4.23Å; F118-A152 HydrophobicContact CZ-CB 4.01Å; L121-A152 HydrophobicContact CD1-CB 3.98Å; T148-A152 WeakPolarHBondContact O-CB 3.46Å; T148-A152 PolarHBondContact O-N 2.94Å; S149-A152 PolarHBondContact O-N 3.44Å; V150-A152 PolarHBondContact O-N 2.64Å; A152-V155 PolarHBondContact O-N 3.38Å; A152-A156 WeakPolarHBondContact O-CB 3.45Å; A152-A156 PolarHBondContact O-N 3.22Å
153W98.3Very high95.8Very high45 Ų4552 Ų5217%0.1729%0.287CS..Hα-helixtrans-63.5-47.1174.4-81.5113.6000112.4N71 I74 F78 I110 S114 F118 S149 V150 I151 V155 A156 V157N71-W153 PolarHBondContact OD1-NE1 3.38Å; I74-W153 HydrophobicContact CB-CZ2 4.28Å; I74-W153 HydrophobicContact CG2-CH2 4.01Å; I74-W153 HydrophobicContact CG2-CZ2 3.8Å; F78-W153 AromaticContact CD2-CH2 3.56Å; F78-W153 HydrophobicContact CD2-CH2 3.56Å; F78-W153 AromaticContact CD2-CZ3 3.57Å; F78-W153 HydrophobicContact CD2-CZ3 3.57Å; F78-W153 HydrophobicContact CE2-CE3 4.38Å; F78-W153 AromaticContact CE2-CH2 3.46Å; F78-W153 HydrophobicContact CE2-CH2 3.46Å; F78-W153 VanDerWaalsContact CE2-CH2 3.46Å; F78-W153 HydrophobicContact CE2-CZ2 4.42Å; F78-W153 AromaticContact CE2-CZ3 3.44Å; F78-W153 HydrophobicContact CE2-CZ3 3.44Å; F78-W153 VanDerWaalsContact CE2-CZ3 3.44Å; I110-W153 HydrophobicContact CG2-CE3 4.08Å; I110-W153 HydrophobicContact CG2-CZ3 3.59Å; S114-W153 WeakPolarHBondContact OG-CH2 3.37Å; S114-W153 WeakPolarHBondContact OG-CZ3 3.35Å; F118-W153 HydrophobicContact CE2-CD2 4.41Å; F118-W153 AromaticContact CE2-CE2 3.84Å; F118-W153 HydrophobicContact CE2-CZ2 4.11Å; F118-W153 AromaticContact CE2-NE1 3.77Å; F118-W153 AromaticContact CZ-CD1 3.9Å; F118-W153 AromaticContact CZ-NE1 3.62Å; S149-W153 PolarHBondContact O-N 2.88Å; V150-W153 PolarHBondContact O-N 2.95Å; I151-W153 VanDerWaalsContact C-N 3.31Å; I151-W153 PolarHBondContact O-N 3.43Å; W153-V155 VanDerWaalsContact C-N 3.32Å; W153-V155 PolarHBondContact O-N 3.39Å; W153-A156 PolarHBondContact O-N 2.78Å; W153-V157 WeakPolarHBondContact O-CG2 3.42Å; W153-V157 PolarHBondContact O-N 2.63Å
154V98.3Very high95.9Very high70 Ų7049 Ų4942%0.42427%0.266SS..Hα-helixtrans-58.6-47.3177.21710000110.2V150 I151 A156 V157 F158V150-V154 WeakPolarHBondContact O-CG2 3.25Å; V150-V154 PolarHBondContact O-N 3.01Å; I151-V154 PolarHBondContact O-N 3.36Å; V154-A156 VanDerWaalsContact C-N 3.35Å; V154-A156 PolarHBondContact O-N 3.22Å; V154-V157 PolarHBondContact O-N 3.02Å; V154-F158 HydrophobicContact CG1-CD2 3.64Å; V154-F158 HydrophobicContact CG1-CE2 3.51Å; V154-F158 WeakPolarHBondContact O-CD2 3.35Å; V154-F158 PolarHBondContact O-N 3.45Å
155V97.9Very high95.9Very high70 Ų7048.4 Ų48.442%0.42427%0.268SS..Hα-helixtrans-62-40.9177.2176.10000111.6F117 I151 A152 W153 V157 F158 A159F117-V155 HydrophobicContact CE2-CB 4.36Å; F117-V155 HydrophobicContact CE2-CG1 3.72Å; F117-V155 HydrophobicContact CZ-CG1 4.09Å; I151-V155 HydrophobicContact CG2-CG2 4.24Å; I151-V155 VanDerWaalsContact O-CG2 3.28Å; I151-V155 WeakPolarHBondContact O-CG2 3.24Å; I151-V155 PolarHBondContact O-N 3.16Å; A152-V155 PolarHBondContact O-N 3.38Å; W153-V155 VanDerWaalsContact C-N 3.32Å; W153-V155 PolarHBondContact O-N 3.39Å; V155-V157 PolarHBondContact O-N 3.47Å; V155-F158 PolarHBondContact O-N 2.91Å; V155-A159 WeakPolarHBondContact O-CB 2.99Å; V155-A159 PolarHBondContact O-N 2.9Å
156A97.9Very high95.9Very high0 Ų049.5 Ų49.50%027%0.273CS..Hα-helixtrans-63.6-40176.800000112.4F113 F117 A152 W153 V154 A159 S160F113-A156 HydrophobicContact CB-CB 4.04Å; F117-A156 HydrophobicContact CD2-CB 4.21Å; F117-A156 HydrophobicContact CE2-CB 4.23Å; A152-A156 WeakPolarHBondContact O-CB 3.45Å; A152-A156 PolarHBondContact O-N 3.22Å; W153-A156 PolarHBondContact O-N 2.78Å; V154-A156 VanDerWaalsContact C-N 3.35Å; V154-A156 PolarHBondContact O-N 3.22Å; A156-A159 PolarHBondContact O-N 3.4Å; A156-S160 WeakPolarHBondContact O-CB 3.24Å; A156-S160 PolarHBondContact O-N 2.98Å; A156-S160 VanDerWaalsContact O-N 3.12Å; A156-S160 PolarHBondContact O-OG 3.02Å
157V97.7Very high95.7Very high60 Ų6046.2 Ų46.236%0.36425%0.252SS..Hα-helixtrans-62.5-50.1174.1172.30000110.3I110 W153 V154 V155 A159 S160 L161I110-V157 HydrophobicContact CD1-CG2 4.01Å; I110-V157 HydrophobicContact CG1-CG2 4.22Å; W153-V157 WeakPolarHBondContact O-CG2 3.42Å; W153-V157 PolarHBondContact O-N 2.63Å; V154-V157 PolarHBondContact O-N 3.02Å; V155-V157 PolarHBondContact O-N 3.47Å; V157-A159 VanDerWaalsContact C-N 3.34Å; V157-A159 PolarHBondContact O-N 2.87Å; V157-S160 WeakPolarHBondContact O-CA 3.35Å; V157-S160 WeakPolarHBondContact O-CB 3.49Å; V157-S160 PolarHBondContact O-N 3.12Å; V157-L161 PolarHBondContact O-N 3.23Å; V157-L161 VanDerWaalsContact O-N 3.13Å
158F97.1Very high95.5Very high137 Ų13749.7 Ų49.760%0.60126%0.257SS*.Hα-helixtrans-59.2-42177.6-82.9-69.3000112.8V154 V155 S160 L161V154-F158 HydrophobicContact CG1-CD2 3.64Å; V154-F158 HydrophobicContact CG1-CE2 3.51Å; V154-F158 WeakPolarHBondContact O-CD2 3.35Å; V154-F158 PolarHBondContact O-N 3.45Å; V155-F158 PolarHBondContact O-N 2.91Å; F158-S160 PolarHBondContact O-N 2.83Å; F158-L161 HydrophobicContact CD1-CD1 3.64Å; F158-L161 HydrophobicContact CE1-CD1 4.12Å; F158-L161 HydrophobicContact CG-CD1 4.48Å; F158-L161 PolarHBondContact O-N 3.31Å
159A95.8Very high95.3Very high14 Ų1448.9 Ų48.912%0.11625%0.254CS..Hα-helixtrans-63.1-26.8176.200000113F113 V155 A156 V157 K197 L201F113-A159 HydrophobicContact CD1-CB 4.41Å; F113-A159 HydrophobicContact CD2-CB 3.81Å; F113-A159 HydrophobicContact CE2-CB 4.09Å; F113-A159 HydrophobicContact CG-CB 4.02Å; V155-A159 WeakPolarHBondContact O-CB 2.99Å; V155-A159 PolarHBondContact O-N 2.9Å; A156-A159 PolarHBondContact O-N 3.4Å; V157-A159 VanDerWaalsContact C-N 3.34Å; V157-A159 PolarHBondContact O-N 2.87Å; A159-K197 PolarHBondContact O-NZ 3.25Å; A159-L201 HydrophobicContact CB-CD1 4.28Å
160S95.8Very high94.9Very high0 Ų052.5 Ų52.50%027%0.27CS..Hα-helixtrans-84.3-25-179.4-56.20000113.3F109 I110 A156 V157 F158 G163 I164F109-S160 VanDerWaalsContact C-OG 3.24Å; F109-S160 WeakPolarHBondContact CB-OG 3.22Å; I110-S160 WeakPolarHBondContact CG1-OG 3.47Å; I110-S160 PolarHBondContact N-OG 3.19Å; I110-S160 VanDerWaalsContact N-OG 3.17Å; A156-S160 WeakPolarHBondContact O-CB 3.24Å; A156-S160 PolarHBondContact O-N 2.98Å; A156-S160 VanDerWaalsContact O-N 3.12Å; A156-S160 PolarHBondContact O-OG 3.02Å; V157-S160 WeakPolarHBondContact O-CA 3.35Å; V157-S160 WeakPolarHBondContact O-CB 3.49Å; V157-S160 PolarHBondContact O-N 3.12Å; F158-S160 PolarHBondContact O-N 2.83Å; S160-G163 WeakPolarHBondContact O-CA 3.18Å; S160-G163 PolarHBondContact O-N 3.4Å; S160-I164 PolarHBondContact O-N 3.39Å; S160-I164 VanDerWaalsContact O-N 3.16Å
161L94.4Very high94.4Very high67 Ų6754.7 Ų54.735%0.35127%0.273SS..Hα-helixtrans-51.7-46.8-174.8-71.3176.2000114.5V157 F158 G163 I164 I165V157-L161 PolarHBondContact O-N 3.23Å; V157-L161 VanDerWaalsContact O-N 3.13Å; F158-L161 HydrophobicContact CD1-CD1 3.64Å; F158-L161 HydrophobicContact CE1-CD1 4.12Å; F158-L161 HydrophobicContact CG-CD1 4.48Å; F158-L161 PolarHBondContact O-N 3.31Å; L161-G163 VanDerWaalsContact C-N 3.25Å; L161-G163 PolarHBondContact O-N 3.45Å; L161-I164 PolarHBondContact O-N 3.45Å; L161-I164 VanDerWaalsContact O-N 3.07Å; L161-I165 VanDerWaalsContact O-CG1 3.31Å; L161-I165 WeakPolarHBondContact O-CG1 3.41Å; L161-I165 PolarHBondContact O-N 3.23Å
162P91.6Very high93.7Very high24 Ų2454 Ų5416%0.15627%0.267CS..Hα-helixtrans-59.3-39.1178.3-23.834.6000112.2I164 I165 F166 F193P162-I164 VanDerWaalsContact C-N 3.31Å; P162-I164 PolarHBondContact O-N 2.93Å; P162-I165 PolarHBondContact O-N 3.28Å; P162-F166 HydrophobicContact CB-CD2 4.38Å; P162-F166 HydrophobicContact CB-CE2 4.28Å; P162-F166 WeakPolarHBondContact O-CD2 3.22Å; P162-F166 PolarHBondContact O-N 2.96Å; P162-F166 VanDerWaalsContact O-N 3.1Å; P162-F193 HydrophobicContact CG-CE1 4.24Å
163G89.6Confident92.9Very high1 Ų157 Ų571%0.0130%0.299CS..Hα-helixtrans-63.5-37176.900000112.4S160 L161 T167S160-G163 WeakPolarHBondContact O-CA 3.18Å; S160-G163 PolarHBondContact O-N 3.4Å; L161-G163 VanDerWaalsContact C-N 3.25Å; L161-G163 PolarHBondContact O-N 3.45Å; G163-T167 WeakPolarHBondContact O-CB 3.47Å; G163-T167 PolarHBondContact O-N 3.4Å; G163-T167 PolarHBondContact O-OG1 2.94Å
164I92.8Very high92.1Very high39 Ų3962 Ų6220%0.233%0.328CS..Hα-helixtrans-70-43.3177.9-60167.4000110.9Q102 S160 L161 P162Q102-I164 HydrophobicContact CB-CG2 4.22Å; S160-I164 PolarHBondContact O-N 3.39Å; S160-I164 VanDerWaalsContact O-N 3.16Å; L161-I164 PolarHBondContact O-N 3.45Å; L161-I164 VanDerWaalsContact O-N 3.07Å; P162-I164 VanDerWaalsContact C-N 3.31Å; P162-I164 PolarHBondContact O-N 2.93Å
165I93.2Very high91.5Very high103 Ų10362.5 Ų62.553%0.52833%0.326SS..Hα-helixtrans-66.9-43-175.9-66.8164.2000111.6L161 P162L161-I165 VanDerWaalsContact O-CG1 3.31Å; L161-I165 WeakPolarHBondContact O-CG1 3.41Å; L161-I165 PolarHBondContact O-N 3.23Å; P162-I165 PolarHBondContact O-N 3.28Å
166F92.5Very high91.1Very high24 Ų2464.4 Ų64.411%0.10533%0.326CS..Hα-helixtrans-83.4-15.4-177.5-64.6-58.3000113.5P162 H181 F182 P183 W190P162-F166 HydrophobicContact CB-CD2 4.38Å; P162-F166 HydrophobicContact CB-CE2 4.28Å; P162-F166 WeakPolarHBondContact O-CD2 3.22Å; P162-F166 PolarHBondContact O-N 2.96Å; P162-F166 VanDerWaalsContact O-N 3.1Å; F166-H181 PolarHBondContact O-N 3.44Å; F166-F182 HydrophobicContact CB-CD1 3.89Å; F166-F182 HydrophobicContact CB-CE1 3.82Å; F166-F182 AromaticContact CD1-CD1 3.96Å; F166-F182 HydrophobicContact CD1-CD1 3.96Å; F166-F182 AromaticContact CD2-CD1 3.88Å; F166-F182 HydrophobicContact CD2-CD1 3.88Å; F166-F182 AromaticContact CD2-CE1 3.78Å; F166-F182 HydrophobicContact CD2-CE1 3.78Å; F166-F182 HydrophobicContact CE2-CD1 4.47Å; F166-F182 AromaticContact CG-CD1 3.63Å; F166-F182 HydrophobicContact CG-CD1 3.63Å; F166-F182 AromaticContact CG-CE1 3.81Å; F166-F182 HydrophobicContact CG-CE1 3.81Å; F166-P183 HydrophobicContact CE1-CG 4.1Å; F166-W190 HydrophobicContact CD2-CE3 4.37Å; F166-W190 HydrophobicContact CE1-CD2 4.31Å; F166-W190 AromaticContact CE2-CD2 3.71Å; F166-W190 HydrophobicContact CE2-CD2 3.71Å; F166-W190 AromaticContact CE2-CE3 3.27Å; F166-W190 HydrophobicContact CE2-CE3 3.27Å; F166-W190 HydrophobicContact CE2-CG 4.38Å; F166-W190 HydrophobicContact CE2-CH2 4.14Å; F166-W190 AromaticContact CE2-CZ3 3.51Å; F166-W190 HydrophobicContact CE2-CZ3 3.51Å; F166-W190 AromaticContact CZ-CD2 3.41Å; F166-W190 HydrophobicContact CZ-CD2 3.41Å; F166-W190 VanDerWaalsContact CZ-CD2 3.41Å; F166-W190 AromaticContact CZ-CE2 3.62Å; F166-W190 AromaticContact CZ-CE3 3.46Å; F166-W190 HydrophobicContact CZ-CE3 3.46Å; F166-W190 VanDerWaalsContact CZ-CE3 3.46Å; F166-W190 HydrophobicContact CZ-CG 4.03Å; F166-W190 AromaticContact CZ-CH2 3.86Å; F166-W190 HydrophobicContact CZ-CH2 3.86Å; F166-W190 AromaticContact CZ-CZ2 3.85Å; F166-W190 HydrophobicContact CZ-CZ2 3.85Å; F166-W190 AromaticContact CZ-CZ3 3.69Å; F166-W190 HydrophobicContact CZ-CZ3 3.69Å
167T92.4Very high90.8Very high4 Ų465.3 Ų65.33%0.02533%0.331CS..EExtended strand (participates in β ladder)trans-84.7128.6179.3-58.90000111.2C101 Q102 T105 G163 S179 S180C101-T167 WeakPolarHBondContact SG-CG2 3.37Å; Q102-T167 WeakPolarHBondContact CG-O 3.49Å; Q102-T167 PolarHBondContact NE2-O 3.31Å; T105-T167 HydrophobicContact CG2-CG2 4.12Å; T105-T167 WeakPolarHBondContact OG1-CG2 3.43Å; G163-T167 WeakPolarHBondContact O-CB 3.47Å; G163-T167 PolarHBondContact O-N 3.4Å; G163-T167 PolarHBondContact O-OG1 2.94Å; T167-S179 WeakPolarHBondContact CA-O 3.42Å; T167-S180 PolarHBondContact OG1-OG 3.42Å
168R92.2Very high90.6Very high149 Ų14963 Ų6356%0.56232%0.318SS*.EExtended strand (participates in β ladder)trans-140.1155.5178.8-62.9-171.1179.5-163.7-0.7110.7N98 S179N98-R168 VanDerWaalsContact OD1-CA 3.27Å; N98-R168 WeakPolarHBondContact OD1-CA 3.26Å; R168-S179 PolarHBondContact N-O 3.3Å; R168-S179 PolarHBondContact O-N 2.98Å; R168-S179 VanDerWaalsContact O-N 3.14Å
169S92.6Very high90.2Very high25 Ų2558.1 Ų58.118%0.17530%0.301CS..EExtended strand (participates in β ladder)trans-94.3125.2167.1-175.50000110.2N98 T177N98-S169 PolarHBondContact OD1-N 2.99Å; S169-T177 WeakPolarHBondContact CA-O 3.25Å; S169-T177 PolarHBondContact OG-O 3.18Å; S169-T177 VanDerWaalsContact OG-O 3.08Å
170Q89.3Confident89.9Confident80 Ų8060.1 Ų60.137%0.37431%0.314SS..EExtended strand (participates in β ladder)trans-141.5160.2176.860.6170.431.200111.3E172 T177 H181Q170-E172 HydrophobicContact CG-CG 4.16Å; Q170-E172 PolarHBondContact NE2-OE1 2.96Å; Q170-T177 PolarHBondContact N-O 3.09Å; Q170-T177 PolarHBondContact O-N 2.88Å; Q170-T177 PolarHBondContact O-OG1 2.94Å; Q170-H181 WeakPolarHBondContact CG-NE2 3.49Å; Q170-H181 PolarHBondContact NE2-CE1 2.85Å; Q170-H181 PolarHBondContact NE2-NE2 3.26Å
171K88Confident89.6Confident129 Ų12962.8 Ų62.856%0.56133%0.326SS*.EExtended strand (participates in β ladder)trans-85.8112.5176.3-170.3178.3179.2-177.10109.1G173 Y176K171-G173 WeakPolarHBondContact CE-O 3.49Å; K171-Y176 HydrophobicContact CB-CD1 4.1Å; K171-Y176 HydrophobicContact CB-CE1 3.88Å; K171-Y176 HydrophobicContact CG-CE1 4.49Å
172E82.1Confident89.4Confident84 Ų8461 Ų6139%0.39332%0.316SS..EExtended strand (participates in β ladder)trans-108.8102.9176.4-73.2176171.300109Q170 L174 H175 T177 H181Q170-E172 HydrophobicContact CG-CG 4.16Å; Q170-E172 PolarHBondContact NE2-OE1 2.96Å; E172-L174 PolarHBondContact O-N 3.42Å; E172-H175 PolarHBondContact N-O 3.2Å; E172-H175 PolarHBondContact O-N 2.77Å; E172-T177 HydrophobicContact CB-CG2 4.26Å; E172-T177 WeakPolarHBondContact OE2-CG2 3.25Å; E172-T177 PolarHBondContact OE2-OG1 3.02Å; E172-H181 IonicContact OE1-CE1 2.72Å; E172-H181 PolarHBondContact OE1-CE1 3.03Å; E172-H181 IonicContact OE1-NE2 2.83Å
173G81Confident89.2Confident71 Ų7162.3 Ų62.373%0.73233%0.325SS*.THydrogen-bonded Turntrans66.6-118.3-172.300000111.9K171K171-G173 WeakPolarHBondContact CE-O 3.49Å
174L82.2Confident89.1Confident152 Ų15272.9 Ų72.980%0.79637%0.366SS*.THydrogen-bonded Turntrans-89.1-12.4-178.7-76.5151.8000113.7E172E172-L174 PolarHBondContact O-N 3.42Å
175H85.4Confident89.1Confident80 Ų8076.3 Ų76.337%0.3739%0.393SS..EExtended strand (participates in β ladder)trans-122.3150.9-169.6-63.6-66.8000112.8Q93 E172Q93-H175 HydrophobicContact CB-CB 4.28Å; Q93-H175 PolarHBondContact OE1-ND1 3.37Å; E172-H175 PolarHBondContact N-O 3.2Å; E172-H175 PolarHBondContact O-N 2.77Å
176Y89.8Confident89Confident110 Ų11076.2 Ų76.243%0.43139%0.391SS..EExtended strand (participates in β ladder)trans-82.7131.4167.3-73.7-86.5000110.3W94 K171W94-Y176 WeakPolarHBondContact CB-O 3.3Å; W94-Y176 PolarHBondContact N-O 3.48Å; W94-Y176 WeakPolarHBondContact O-CB 3.44Å; K171-Y176 HydrophobicContact CB-CD1 4.1Å; K171-Y176 HydrophobicContact CB-CE1 3.88Å; K171-Y176 HydrophobicContact CG-CE1 4.49Å
177T90.8Very high88.8Confident18 Ų1880.1 Ų80.111%0.1141%0.405CS..EExtended strand (participates in β ladder)trans-117.4159.7176.458.30000110.5Y89 S169 Q170 E172Y89-T177 WeakPolarHBondContact OH-CB 3.18Å; S169-T177 WeakPolarHBondContact CA-O 3.25Å; S169-T177 PolarHBondContact OG-O 3.18Å; S169-T177 VanDerWaalsContact OG-O 3.08Å; Q170-T177 PolarHBondContact N-O 3.09Å; Q170-T177 PolarHBondContact O-N 2.88Å; Q170-T177 PolarHBondContact O-OG1 2.94Å; E172-T177 HydrophobicContact CB-CG2 4.26Å; E172-T177 WeakPolarHBondContact OE2-CG2 3.25Å; E172-T177 PolarHBondContact OE2-OG1 3.02Å
178C93.4Very high88.7Confident12 Ų1284 Ų848%0.08142%0.423CS..EExtended strand (participates in β ladder)trans-122.5100.8170.2173.50000106.8W94 C101W94-C178 HydrophobicContact CB-CB 4.42Å; W94-C178 HydrophobicContact CD2-CB 3.48Å; W94-C178 VanDerWaalsContact CD2-CB 3.48Å; W94-C178 HydrophobicContact CE3-CB 3.61Å; W94-C178 HydrophobicContact CG-CB 3.82Å; W94-C178 HydrophobicContact CH2-CB 4.42Å; W94-C178 HydrophobicContact CZ2-CB 4.39Å; W94-C178 HydrophobicContact CZ3-CB 4.07Å; C101-C178 HydrophobicContact CB-CB 3.97Å; C101-C178 WeakPolarHBondContact CB-SG 3.25Å; C101-C178 VanDerWaalsContact SG-CA 3.6Å; C101-C178 WeakPolarHBondContact SG-CB 3.31Å; C101-C178 CovalentContact SG-SG 2.03Å; C101-C178 PolarHBondContact SG-SG 2.88Å
179S89.4Confident88.7Confident34 Ų3482.9 Ų82.924%0.23842%0.423CS..EExtended strand (participates in β ladder)trans-142.1160.1-169.345.20000111.5T167 R168 H181T167-S179 WeakPolarHBondContact CA-O 3.42Å; R168-S179 PolarHBondContact N-O 3.3Å; R168-S179 PolarHBondContact O-N 2.98Å; R168-S179 VanDerWaalsContact O-N 3.14Å; S179-H181 PolarHBondContact O-CD2 2.68Å; S179-H181 VanDerWaalsContact O-CD2 3.27Å; S179-H181 PolarHBondContact OG-NE2 3.32Å
180S89.1Confident88.8Confident57 Ų5784.5 Ų84.540%0.39943%0.425SS..EExtended strand (participates in β ladder)trans-81.8122.5177.9-63.20000111T167T167-S180 PolarHBondContact OG1-OG 3.42Å
181H88.9Confident88.9Confident55 Ų5582.7 Ų82.726%0.25542%0.416SS..  trans-113.9110.4176.8-64.3-71.5000110.4F166 Q170 E172 S179F166-H181 PolarHBondContact O-N 3.44Å; Q170-H181 WeakPolarHBondContact CG-NE2 3.49Å; Q170-H181 PolarHBondContact NE2-CE1 2.85Å; Q170-H181 PolarHBondContact NE2-NE2 3.26Å; E172-H181 IonicContact OE1-CE1 2.72Å; E172-H181 PolarHBondContact OE1-CE1 3.03Å; E172-H181 IonicContact OE1-NE2 2.83Å; S179-H181 PolarHBondContact O-CD2 2.68Å; S179-H181 VanDerWaalsContact O-CD2 3.27Å; S179-H181 PolarHBondContact OG-NE2 3.32Å
182F90.2Very high89.1Confident29 Ų2978.4 Ų78.413%0.12740%0.399CS..  trans-91.4148.5175.9-55.7-59.1000111.3F166 Y184 Y187 W190 K191 Q194F166-F182 HydrophobicContact CB-CD1 3.89Å; F166-F182 HydrophobicContact CB-CE1 3.82Å; F166-F182 AromaticContact CD1-CD1 3.96Å; F166-F182 HydrophobicContact CD1-CD1 3.96Å; F166-F182 AromaticContact CD2-CD1 3.88Å; F166-F182 HydrophobicContact CD2-CD1 3.88Å; F166-F182 AromaticContact CD2-CE1 3.78Å; F166-F182 HydrophobicContact CD2-CE1 3.78Å; F166-F182 HydrophobicContact CE2-CD1 4.47Å; F166-F182 AromaticContact CG-CD1 3.63Å; F166-F182 HydrophobicContact CG-CD1 3.63Å; F166-F182 AromaticContact CG-CE1 3.81Å; F166-F182 HydrophobicContact CG-CE1 3.81Å; F182-Y184 PolarHBondContact O-N 3.07Å; F182-Y187 HydrophobicContact CB-CD2 3.91Å; F182-Y187 HydrophobicContact CB-CE2 4.39Å; F182-Y187 HydrophobicContact CD2-CD2 4.4Å; F182-Y187 HydrophobicContact CD2-CE2 4.14Å; F182-W190 HydrophobicContact CB-CB 4Å; F182-W190 HydrophobicContact CD1-CB 3.55Å; F182-W190 HydrophobicContact CD1-CG 4.43Å; F182-W190 HydrophobicContact CE1-CB 4.18Å; F182-W190 HydrophobicContact CG-CB 3.81Å; F182-K191 HydrophobicContact CD2-CB 4.23Å; F182-K191 HydrophobicContact CE2-CB 4.19Å; F182-Q194 HydrophobicContact CZ-CB 4.19Å; F182-Q194 HydrophobicContact CZ-CG 4.41Å
183P89.1Confident89.7Confident53 Ų5378.6 Ų78.634%0.34440%0.399SS..  trans-59.2130.6176-20.731.3000111.6F166 S185 Q186 Y187F166-P183 HydrophobicContact CE1-CG 4.1Å; P183-S185 VanDerWaalsContact C-N 3.26Å; P183-S185 PolarHBondContact O-N 2.92Å; P183-Q186 CarbonylContact O-C 3.09Å; P183-Q186 PolarHBondContact O-N 3.21Å; P183-Y187 WeakPolarHBondContact O-CA 3.25Å; P183-Y187 PolarHBondContact O-N 3.32Å
184Y87.8Confident90.3Very high222 Ų22275.9 Ų75.987%0.87137%0.367SS*.G310 helixtrans-56-38.2-177.2-66.8-74.7000113.5F182 Q186F182-Y184 PolarHBondContact O-N 3.07Å; Y184-Q186 PolarHBondContact O-N 3.39Å
185S91.2Very high90.9Very high112 Ų11269 Ų6978%0.78333%0.331SS*.G310 helixtrans-63.3-24.2179.655.90000114P183P183-S185 VanDerWaalsContact C-N 3.26Å; P183-S185 PolarHBondContact O-N 2.92Å
186Q91.6Very high91.4Very high101 Ų10168.6 Ų68.647%0.47233%0.332SS..G310 helixtrans-133.527.1-175.7-65.8-179.6-16.200111.5P183 Y184 Q188 F189 W190P183-Q186 CarbonylContact O-C 3.09Å; P183-Q186 PolarHBondContact O-N 3.21Å; Y184-Q186 PolarHBondContact O-N 3.39Å; Q186-Q188 PolarHBondContact O-N 2.94Å; Q186-F189 HydrophobicContact CB-CB 4.47Å; Q186-F189 PolarHBondContact O-N 3.13Å; Q186-F189 VanDerWaalsContact O-N 3.15Å; Q186-W190 PolarHBondContact O-N 3.49Å; Q186-W190 VanDerWaalsContact O-N 3.09Å; Q186-W190 VanDerWaalsContact OE1-NE1 3.11Å
187Y89.4Confident91.6Very high106 Ų10664.5 Ų64.542%0.41632%0.316SS..Hα-helixtrans-56.1-50.4-170.3177.7-94.3000112F182 P183 F189 W190 K191F182-Y187 HydrophobicContact CB-CD2 3.91Å; F182-Y187 HydrophobicContact CB-CE2 4.39Å; F182-Y187 HydrophobicContact CD2-CD2 4.4Å; F182-Y187 HydrophobicContact CD2-CE2 4.14Å; P183-Y187 WeakPolarHBondContact O-CA 3.25Å; P183-Y187 PolarHBondContact O-N 3.32Å; Y187-F189 VanDerWaalsContact C-N 3.33Å; Y187-F189 PolarHBondContact O-N 3.1Å; Y187-W190 PolarHBondContact O-N 3.17Å; Y187-K191 HydrophobicContact CE1-CD 3.87Å; Y187-K191 VanDerWaalsContact O-CB 3.28Å; Y187-K191 WeakPolarHBondContact O-CB 3.47Å; Y187-K191 PolarHBondContact O-N 3.39Å
188Q89.8Confident91.9Very high84 Ų8464.1 Ų64.139%0.39331%0.313SS..Hα-helixtrans-64.6-37.2-178.9-167.26339.300112.4Q186 N192Q186-Q188 PolarHBondContact O-N 2.94Å; Q188-N192 PolarHBondContact NE2-OD1 3.26Å; Q188-N192 VanDerWaalsContact O-CB 3.23Å; Q188-N192 WeakPolarHBondContact O-CB 3.21Å; Q188-N192 PolarHBondContact O-N 3.36Å; Q188-N192 PolarHBondContact O-ND2 3.1Å; Q188-N192 PolarHBondContact O-OD1 3.44Å
189F92.8Very high92Very high127 Ų12764.2 Ų64.256%0.55731%0.313SS*.Hα-helixtrans-62.7-51.6178.6175.2-93.5000111Q186 Y187 N192 F193Q186-F189 HydrophobicContact CB-CB 4.47Å; Q186-F189 PolarHBondContact O-N 3.13Å; Q186-F189 VanDerWaalsContact O-N 3.15Å; Y187-F189 VanDerWaalsContact C-N 3.33Å; Y187-F189 PolarHBondContact O-N 3.1Å; F189-N192 PolarHBondContact O-N 3.16Å; F189-F193 VanDerWaalsContact O-CB 3.26Å; F189-F193 WeakPolarHBondContact O-CB 3.5Å; F189-F193 PolarHBondContact O-N 3.02Å
190W93.1Very high92.3Very high59 Ų5966.7 Ų66.722%0.22332%0.323CS..Hα-helixtrans-68.9-37.7-178.5-73.5108.2000112.7F166 F182 Q186 Y187 F193 Q194F166-W190 HydrophobicContact CD2-CE3 4.37Å; F166-W190 HydrophobicContact CE1-CD2 4.31Å; F166-W190 AromaticContact CE2-CD2 3.71Å; F166-W190 HydrophobicContact CE2-CD2 3.71Å; F166-W190 AromaticContact CE2-CE3 3.27Å; F166-W190 HydrophobicContact CE2-CE3 3.27Å; F166-W190 HydrophobicContact CE2-CG 4.38Å; F166-W190 HydrophobicContact CE2-CH2 4.14Å; F166-W190 AromaticContact CE2-CZ3 3.51Å; F166-W190 HydrophobicContact CE2-CZ3 3.51Å; F166-W190 AromaticContact CZ-CD2 3.41Å; F166-W190 HydrophobicContact CZ-CD2 3.41Å; F166-W190 VanDerWaalsContact CZ-CD2 3.41Å; F166-W190 AromaticContact CZ-CE2 3.62Å; F166-W190 AromaticContact CZ-CE3 3.46Å; F166-W190 HydrophobicContact CZ-CE3 3.46Å; F166-W190 VanDerWaalsContact CZ-CE3 3.46Å; F166-W190 HydrophobicContact CZ-CG 4.03Å; F166-W190 AromaticContact CZ-CH2 3.86Å; F166-W190 HydrophobicContact CZ-CH2 3.86Å; F166-W190 AromaticContact CZ-CZ2 3.85Å; F166-W190 HydrophobicContact CZ-CZ2 3.85Å; F166-W190 AromaticContact CZ-CZ3 3.69Å; F166-W190 HydrophobicContact CZ-CZ3 3.69Å; F182-W190 HydrophobicContact CB-CB 4Å; F182-W190 HydrophobicContact CD1-CB 3.55Å; F182-W190 HydrophobicContact CD1-CG 4.43Å; F182-W190 HydrophobicContact CE1-CB 4.18Å; F182-W190 HydrophobicContact CG-CB 3.81Å; Q186-W190 PolarHBondContact O-N 3.49Å; Q186-W190 VanDerWaalsContact O-N 3.09Å; Q186-W190 VanDerWaalsContact OE1-NE1 3.11Å; Y187-W190 PolarHBondContact O-N 3.17Å; W190-F193 HydrophobicContact CE3-CD1 4.13Å; W190-F193 HydrophobicContact CZ3-CD1 4.14Å; W190-F193 HydrophobicContact CZ3-CE1 4.39Å; W190-F193 PolarHBondContact O-N 3.02Å; W190-Q194 WeakPolarHBondContact O-CB 3Å; W190-Q194 PolarHBondContact O-N 2.8Å
191K91.1Very high92.7Very high41 Ų4166 Ų6618%0.17832%0.315CS..Hα-helixtrans-59.4-50.3172.7-171.2-176.2176.8-173.60110.9F182 Y187 Q194 T195 T259F182-K191 HydrophobicContact CD2-CB 4.23Å; F182-K191 HydrophobicContact CE2-CB 4.19Å; Y187-K191 HydrophobicContact CE1-CD 3.87Å; Y187-K191 VanDerWaalsContact O-CB 3.28Å; Y187-K191 WeakPolarHBondContact O-CB 3.47Å; Y187-K191 PolarHBondContact O-N 3.39Å; K191-Q194 PolarHBondContact O-N 3Å; K191-T195 PolarHBondContact O-N 2.81Å; K191-T195 VanDerWaalsContact O-N 3.12Å; K191-T195 PolarHBondContact O-OG1 3.45Å; K191-T259 HydrophobicContact CG-CG2 4.17Å
192N93.4Very high92.9Very high39 Ų3963.4 Ų63.421%0.20930%0.302CS..Hα-helixtrans-62.5-46.1177.5-71.8-7000111.8Q188 F189 Q194 T195 L196 T259Q188-N192 PolarHBondContact NE2-OD1 3.26Å; Q188-N192 VanDerWaalsContact O-CB 3.23Å; Q188-N192 WeakPolarHBondContact O-CB 3.21Å; Q188-N192 PolarHBondContact O-N 3.36Å; Q188-N192 PolarHBondContact O-ND2 3.1Å; Q188-N192 PolarHBondContact O-OD1 3.44Å; F189-N192 PolarHBondContact O-N 3.16Å; N192-Q194 PolarHBondContact O-N 3.27Å; N192-T195 PolarHBondContact O-N 3.28Å; N192-L196 WeakPolarHBondContact O-CB 3.27Å; N192-L196 VanDerWaalsContact O-CG 3.26Å; N192-L196 WeakPolarHBondContact O-CG 3.07Å; N192-L196 PolarHBondContact O-N 2.99Å; N192-T259 WeakPolarHBondContact OD1-CG2 3.4Å
193F94.8Very high93.1Very high88 Ų8863.4 Ų63.439%0.38630%0.304SS..Hα-helixtrans-58.8-47.3179.7176.8-97.7000111.5P162 F189 W190 K197P162-F193 HydrophobicContact CG-CE1 4.24Å; F189-F193 VanDerWaalsContact O-CB 3.26Å; F189-F193 WeakPolarHBondContact O-CB 3.5Å; F189-F193 PolarHBondContact O-N 3.02Å; W190-F193 HydrophobicContact CE3-CD1 4.13Å; W190-F193 HydrophobicContact CZ3-CD1 4.14Å; W190-F193 HydrophobicContact CZ3-CE1 4.39Å; W190-F193 PolarHBondContact O-N 3.02Å; F193-K197 WeakPolarHBondContact O-CB 3.49Å; F193-K197 PolarHBondContact O-N 3.47Å
194Q93.3Very high93.4Very high14 Ų1464.5 Ų64.57%0.06531%0.309CS..Hα-helixtrans-63.8-44.4-179.5-173.270.7-9.500111.6F182 W190 K191 N192 I198F182-Q194 HydrophobicContact CZ-CB 4.19Å; F182-Q194 HydrophobicContact CZ-CG 4.41Å; W190-Q194 WeakPolarHBondContact O-CB 3Å; W190-Q194 PolarHBondContact O-N 2.8Å; K191-Q194 PolarHBondContact O-N 3Å; N192-Q194 PolarHBondContact O-N 3.27Å; Q194-I198 HydrophobicContact CG-CD1 4.23Å; Q194-I198 WeakPolarHBondContact O-CG1 3.31Å; Q194-I198 PolarHBondContact O-N 3.09Å; Q194-I198 VanDerWaalsContact O-N 3.12Å
195T93.9Very high93.8Very high7 Ų756.9 Ų56.94%0.04328%0.283CS..Hα-helixtrans-64-50.5177.2-66.90000111.9K191 N192 K197 I198 V199 L255 L256 T259K191-T195 PolarHBondContact O-N 2.81Å; K191-T195 VanDerWaalsContact O-N 3.12Å; K191-T195 PolarHBondContact O-OG1 3.45Å; N192-T195 PolarHBondContact O-N 3.28Å; T195-K197 VanDerWaalsContact C-N 3.29Å; T195-K197 PolarHBondContact O-N 3.22Å; T195-I198 PolarHBondContact O-N 3.34Å; T195-V199 HydrophobicContact CG2-CG2 4.28Å; T195-V199 WeakPolarHBondContact O-CG2 3.39Å; T195-V199 PolarHBondContact O-N 3.37Å; T195-L255 HydrophobicContact CG2-CD2 4.4Å; T195-L255 HydrophobicContact CG2-CG 4.03Å; T195-L256 HydrophobicContact CG2-CD1 4.35Å; T195-T259 WeakPolarHBondContact CB-OG1 3.38Å; T195-T259 HydrophobicContact CG2-CG2 4.15Å; T195-T259 WeakPolarHBondContact CG2-OG1 3.49Å; T195-T259 PolarHBondContact OG1-OG1 3.2Å
196L95.8Very high93.9Very high73 Ų7351.6 Ų51.638%0.38225%0.246SC..Hα-helixtrans-61.3-40179.7-71.1175.1000111.2N192 I198 V199 I200 F260N192-L196 WeakPolarHBondContact O-CB 3.27Å; N192-L196 VanDerWaalsContact O-CG 3.26Å; N192-L196 WeakPolarHBondContact O-CG 3.07Å; N192-L196 PolarHBondContact O-N 2.99Å; L196-I198 PolarHBondContact O-N 2.94Å; L196-V199 PolarHBondContact O-N 3.4Å; L196-I200 HydrophobicContact CB-CD1 4.22Å; L196-I200 WeakPolarHBondContact O-CB 3.39Å; L196-I200 WeakPolarHBondContact O-CD1 3.31Å; L196-I200 WeakPolarHBondContact O-CG1 3.28Å; L196-I200 PolarHBondContact O-N 2.78Å; L196-F260 HydrophobicContact CD2-CE2 4.41Å; L196-F260 HydrophobicContact CD2-CZ 4.44Å
197K95.9Very high94Very high24 Ų2450.7 Ų50.710%0.10424%0.244CC..Hα-helixtrans-58-49.1174.7-178.2-158.774179.60111.6F113 A159 F193 T195 L201F113-K197 HydrophobicContact CZ-CD 4.48Å; A159-K197 PolarHBondContact O-NZ 3.25Å; F193-K197 WeakPolarHBondContact O-CB 3.49Å; F193-K197 PolarHBondContact O-N 3.47Å; T195-K197 VanDerWaalsContact C-N 3.29Å; T195-K197 PolarHBondContact O-N 3.22Å; K197-L201 HydrophobicContact CG-CD1 3.93Å; K197-L201 WeakPolarHBondContact O-CB 3.45Å; K197-L201 WeakPolarHBondContact O-CG 3.3Å; K197-L201 PolarHBondContact O-N 3.42Å
198I95.2Very high94.3Very high9 Ų950.4 Ų50.45%0.04625%0.249CC..Hα-helixtrans-62.6-47.5179.5-67.8165.6000110.3F109 F112 F113 Q194 T195 L196 G202 N252 L255F109-I198 HydrophobicContact CE1-CD1 4.08Å; F112-I198 HydrophobicContact CE1-CG2 4.24Å; F112-I198 HydrophobicContact CZ-CG2 4.3Å; F113-I198 HydrophobicContact CZ-CG1 4.25Å; Q194-I198 HydrophobicContact CG-CD1 4.23Å; Q194-I198 WeakPolarHBondContact O-CG1 3.31Å; Q194-I198 PolarHBondContact O-N 3.09Å; Q194-I198 VanDerWaalsContact O-N 3.12Å; T195-I198 PolarHBondContact O-N 3.34Å; L196-I198 PolarHBondContact O-N 2.94Å; I198-G202 VanDerWaalsContact O-CA 3.28Å; I198-G202 WeakPolarHBondContact O-CA 3.09Å; I198-G202 PolarHBondContact O-N 3.12Å; I198-N252 PolarHBondContact O-OD1 3.31Å; I198-L255 HydrophobicContact CB-CD2 4.04Å; I198-L255 HydrophobicContact CD1-CD2 3.97Å; I198-L255 HydrophobicContact CG2-CD2 3.8Å
199V96.1Very high94.6Very high14 Ų1447.3 Ų47.39%0.08524%0.236CC..Hα-helixtrans-67.3-43.1-178.7173.80000112T195 L196 L203 V204 N252 L256T195-V199 HydrophobicContact CG2-CG2 4.28Å; T195-V199 WeakPolarHBondContact O-CG2 3.39Å; T195-V199 PolarHBondContact O-N 3.37Å; L196-V199 PolarHBondContact O-N 3.4Å; V199-L203 WeakPolarHBondContact O-CA 3.3Å; V199-L203 VanDerWaalsContact O-CB 3.27Å; V199-L203 WeakPolarHBondContact O-CB 3.41Å; V199-L203 PolarHBondContact O-N 2.9Å; V199-V204 HydrophobicContact CG1-CG2 4.28Å; V199-V204 PolarHBondContact O-N 3.25Å; V199-N252 HydrophobicContact CG2-CB 4.42Å; V199-L256 HydrophobicContact CG2-CB 4.5Å; V199-L256 HydrophobicContact CG2-CD1 4.39Å
200I96.8Very high94.4Very high86 Ų8642.7 Ų42.744%0.44122%0.217SC..Iπ-helixtrans-65.9-50.2-179.2-69.8166.6000110.1L196 V204 L205L196-I200 HydrophobicContact CB-CD1 4.22Å; L196-I200 WeakPolarHBondContact O-CB 3.39Å; L196-I200 WeakPolarHBondContact O-CD1 3.31Å; L196-I200 WeakPolarHBondContact O-CG1 3.28Å; L196-I200 PolarHBondContact O-N 2.78Å; I200-V204 PolarHBondContact O-N 3.27Å; I200-L205 VanDerWaalsContact O-CB 3.25Å; I200-L205 WeakPolarHBondContact O-CB 3.25Å; I200-L205 PolarHBondContact O-N 2.87Å
201L96.4Very high94.4Very high43 Ų4344 Ų4423%0.22523%0.231CC..Iπ-helixtrans-77.3-34.4-176-61.9179000112.9F113 F117 A159 K197 L205 P206F113-L201 HydrophobicContact CD1-CB 4.26Å; F113-L201 HydrophobicContact CD1-CD1 4.27Å; F113-L201 HydrophobicContact CE1-CB 4.02Å; F113-L201 HydrophobicContact CE1-CD1 4Å; F117-L201 HydrophobicContact CZ-CD1 4.41Å; A159-L201 HydrophobicContact CB-CD1 4.28Å; K197-L201 HydrophobicContact CG-CD1 3.93Å; K197-L201 WeakPolarHBondContact O-CB 3.45Å; K197-L201 WeakPolarHBondContact O-CG 3.3Å; K197-L201 PolarHBondContact O-N 3.42Å; L201-L205 HydrophobicContact CD2-CD2 4.25Å; L201-P206 WeakPolarHBondContact O-CD 3.39Å
202G92.7Very high94.5Very high0 Ų046.7 Ų46.70%025%0.246CC..Iπ-helixtrans-91.9-18.7-175.900000115I198 P206 Y244I198-G202 VanDerWaalsContact O-CA 3.28Å; I198-G202 WeakPolarHBondContact O-CA 3.09Å; I198-G202 PolarHBondContact O-N 3.12Å; G202-P206 WeakPolarHBondContact O-CG 3.36Å; G202-Y244 VanDerWaalsContact O-CE1 3.3Å; G202-Y244 WeakPolarHBondContact O-CE1 3.5Å; G202-Y244 PolarHBondContact O-OH 2.85Å; G202-Y244 VanDerWaalsContact O-OH 3.1Å
203L94.4Very high94.4Very high30 Ų3045.2 Ų45.216%0.15724%0.239CC..Iπ-helixtrans-129.1-56.2-178.3-176.364.1000112.7V199 P206 L207 F245 A249 N252V199-L203 WeakPolarHBondContact O-CA 3.3Å; V199-L203 VanDerWaalsContact O-CB 3.27Å; V199-L203 WeakPolarHBondContact O-CB 3.41Å; V199-L203 PolarHBondContact O-N 2.9Å; L203-P206 WeakPolarHBondContact O-CD 3.19Å; L203-P206 WeakPolarHBondContact O-CG 3.2Å; L203-L207 WeakPolarHBondContact O-CB 3.35Å; L203-L207 PolarHBondContact O-N 3.46Å; L203-L207 VanDerWaalsContact O-N 3.1Å; L203-F245 HydrophobicContact CD1-CD1 3.77Å; L203-F245 HydrophobicContact CD1-CE1 3.87Å; L203-A249 HydrophobicContact CD1-CB 3.76Å; L203-N252 HydrophobicContact CB-CB 4.23Å; L203-N252 HydrophobicContact CD2-CB 3.96Å
204V96.2Very high94.1Very high75 Ų7542.3 Ų42.346%0.45523%0.226SC..Iπ-helixtrans-68.1-49.2-171.8-179.10000111.7V199 I200 L207 L208V199-V204 HydrophobicContact CG1-CG2 4.28Å; V199-V204 PolarHBondContact O-N 3.25Å; I200-V204 PolarHBondContact O-N 3.27Å; V204-L207 PolarHBondContact O-N 3.39Å; V204-L208 WeakPolarHBondContact O-CB 3.25Å; V204-L208 PolarHBondContact O-N 3.13Å
205L95.8Very high93.9Very high63 Ų6345.1 Ų45.133%0.3325%0.246SC..Hα-helixtrans-59.3-53.7179.2179.266.5000112.8I120 I200 L201 L207 L208 V209I120-L205 HydrophobicContact CD1-CD2 3.99Å; I120-L205 HydrophobicContact CD1-CG 4.01Å; I200-L205 VanDerWaalsContact O-CB 3.25Å; I200-L205 WeakPolarHBondContact O-CB 3.25Å; I200-L205 PolarHBondContact O-N 2.87Å; L201-L205 HydrophobicContact CD2-CD2 4.25Å; L205-L207 VanDerWaalsContact C-N 3.27Å; L205-L207 PolarHBondContact O-N 2.97Å; L205-L208 PolarHBondContact O-N 3.27Å; L205-V209 WeakPolarHBondContact O-CG2 3.29Å; L205-V209 PolarHBondContact O-N 3.45Å
206P93.6Very high93.5Very high0 Ų045.4 Ų45.40%025%0.251CS..Hα-helixtrans-63.9-32.6178.224.2-33.9000112.5I116 I120 L201 G202 L203 V209 M210 M241 F245I116-P206 HydrophobicContact CD1-CB 3.57Å; I116-P206 HydrophobicContact CD1-CG 3.83Å; I116-P206 HydrophobicContact CG1-CB 4Å; I116-P206 HydrophobicContact CG1-CG 3.87Å; I120-P206 HydrophobicContact CD1-CB 4.03Å; I120-P206 HydrophobicContact CG1-CB 4.01Å; L201-P206 WeakPolarHBondContact O-CD 3.39Å; G202-P206 WeakPolarHBondContact O-CG 3.36Å; L203-P206 WeakPolarHBondContact O-CD 3.19Å; L203-P206 WeakPolarHBondContact O-CG 3.2Å; P206-V209 PolarHBondContact O-N 2.96Å; P206-M210 VanDerWaalsContact O-CB 3.3Å; P206-M210 WeakPolarHBondContact O-CB 3.48Å; P206-M210 PolarHBondContact O-N 3.25Å; P206-M241 HydrophobicContact CB-SD 4.37Å; P206-F245 HydrophobicContact CB-CE1 4.28Å; P206-F245 HydrophobicContact CB-CZ 3.87Å; P206-F245 HydrophobicContact CG-CE1 4.03Å; P206-F245 HydrophobicContact CG-CZ 4.11Å
207L94.3Very high93.1Very high82 Ų8242.1 Ų42.143%0.42923%0.234SC..Hα-helixtrans-67.2-43.4176.9-173.969.5000111.2L203 V204 L205 M210 V211 F245L203-L207 WeakPolarHBondContact O-CB 3.35Å; L203-L207 PolarHBondContact O-N 3.46Å; L203-L207 VanDerWaalsContact O-N 3.1Å; V204-L207 PolarHBondContact O-N 3.39Å; L205-L207 VanDerWaalsContact C-N 3.27Å; L205-L207 PolarHBondContact O-N 2.97Å; L207-M210 WeakPolarHBondContact O-CB 3.5Å; L207-M210 PolarHBondContact O-N 3.44Å; L207-V211 WeakPolarHBondContact O-CG2 3.25Å; L207-V211 PolarHBondContact O-N 3.15Å; L207-F245 HydrophobicContact CB-CE1 4.32Å; L207-F245 HydrophobicContact CB-CZ 4.06Å; L207-F245 HydrophobicContact CD1-CE2 4.47Å; L207-F245 HydrophobicContact CD1-CZ 4.28Å
208L95.8Very high92.5Very high100 Ų10045.8 Ų45.852%0.52425%0.254SS..Hα-helixtrans-60-47.7175-18063.9000111.3V204 L205 M210 V211 I212V204-L208 WeakPolarHBondContact O-CB 3.25Å; V204-L208 PolarHBondContact O-N 3.13Å; L205-L208 PolarHBondContact O-N 3.27Å; L208-M210 VanDerWaalsContact C-N 3.29Å; L208-M210 PolarHBondContact O-N 3.05Å; L208-V211 PolarHBondContact O-N 3.48Å; L208-I212 HydrophobicContact CD1-CD1 3.84Å; L208-I212 HydrophobicContact CD1-CG1 4.37Å; L208-I212 HydrophobicContact CG-CD1 3.9Å; L208-I212 WeakPolarHBondContact O-CG1 3.45Å; L208-I212 PolarHBondContact O-N 2.82Å
209V94.5Very high92.1Very high19 Ų1953.2 Ų53.212%0.11529%0.286CS..Hα-helixtrans-59.2-43.1175.6172.10000110.6I120 T123 I124 L205 P206 I212 C213I120-V209 HydrophobicContact CG2-CG1 4.24Å; I120-V209 HydrophobicContact CG2-CG2 4.07Å; T123-V209 HydrophobicContact CG2-CG1 4.02Å; I124-V209 HydrophobicContact CG1-CG1 4.2Å; L205-V209 WeakPolarHBondContact O-CG2 3.29Å; L205-V209 PolarHBondContact O-N 3.45Å; P206-V209 PolarHBondContact O-N 2.96Å; V209-I212 PolarHBondContact O-N 3.37Å; V209-C213 WeakPolarHBondContact O-CB 3.46Å; V209-C213 PolarHBondContact O-N 2.82Å; V209-C213 PolarHBondContact O-SG 3.45Å; V209-C213 VanDerWaalsContact O-SG 3.4Å
210M90.2Very high91.4Very high31 Ų3154 Ų5415%0.15329%0.291CS..Hα-helixtrans-59-51.7177.9-174.5-174.9-175.200111.2P206 L207 L208 I212 Y214 F238 M241 I242 F245P206-M210 VanDerWaalsContact O-CB 3.3Å; P206-M210 WeakPolarHBondContact O-CB 3.48Å; P206-M210 PolarHBondContact O-N 3.25Å; L207-M210 WeakPolarHBondContact O-CB 3.5Å; L207-M210 PolarHBondContact O-N 3.44Å; L208-M210 VanDerWaalsContact C-N 3.29Å; L208-M210 PolarHBondContact O-N 3.05Å; M210-I212 PolarHBondContact O-N 2.9Å; M210-Y214 HydrophobicContact CB-CD2 4.35Å; M210-Y214 HydrophobicContact CG-CD2 3.59Å; M210-Y214 HydrophobicContact CG-CE2 4.03Å; M210-Y214 VanDerWaalsContact O-CB 3.31Å; M210-Y214 WeakPolarHBondContact O-CB 3.31Å; M210-Y214 VanDerWaalsContact O-CD2 3.32Å; M210-Y214 WeakPolarHBondContact O-CD2 3.46Å; M210-Y214 PolarHBondContact O-N 3.32Å; M210-F238 HydrophobicContact CE-CD2 4.07Å; M210-F238 HydrophobicContact CE-CE2 3.57Å; M210-F238 HydrophobicContact CE-CZ 4.41Å; M210-M241 HydrophobicContact CB-CG 4.46Å; M210-M241 HydrophobicContact CG-CG 4.19Å; M210-M241 HydrophobicContact SD-CG 3.96Å; M210-I242 HydrophobicContact CE-CG1 3.93Å; M210-F245 HydrophobicContact SD-CD2 4.07Å; M210-F245 HydrophobicContact SD-CE2 3.57Å; M210-F245 VanDerWaalsContact SD-CE2 3.57Å
211V92.6Very high90.4Very high87 Ų8751 Ų5153%0.52728%0.276SS..Hα-helixtrans-59.5-47.2-178.7172.10000111L207 L208 S215L207-V211 WeakPolarHBondContact O-CG2 3.25Å; L207-V211 PolarHBondContact O-N 3.15Å; L208-V211 PolarHBondContact O-N 3.48Å; V211-S215 WeakPolarHBondContact O-CB 3.24Å; V211-S215 PolarHBondContact O-N 3.1Å; V211-S215 VanDerWaalsContact O-N 3.16Å; V211-S215 PolarHBondContact O-OG 3.27Å
212I93.6Very high89.6Confident96 Ų9655.6 Ų55.649%0.49230%0.3SS..Hα-helixtrans-66-52.7-178.6-64.7168.8000110.7L208 V209 M210 G216L208-I212 HydrophobicContact CD1-CD1 3.84Å; L208-I212 HydrophobicContact CD1-CG1 4.37Å; L208-I212 HydrophobicContact CG-CD1 3.9Å; L208-I212 WeakPolarHBondContact O-CG1 3.45Å; L208-I212 PolarHBondContact O-N 2.82Å; V209-I212 PolarHBondContact O-N 3.37Å; M210-I212 PolarHBondContact O-N 2.9Å; I212-G216 PolarHBondContact O-N 3.14Å
213C91.7Very high88.9Confident8 Ų866.3 Ų66.35%0.05434%0.34CS..Hα-helixtrans-67.6-46.2-173.9-71.10000112T123 Y127 V209 G216 I217T123-C213 HydrophobicContact CG2-CB 3.69Å; Y127-C213 VanDerWaalsContact CD2-CA 3.46Å; Y127-C213 HydrophobicContact CD2-CB 3.83Å; Y127-C213 VanDerWaalsContact CD2-O 3.29Å; Y127-C213 WeakPolarHBondContact CD2-O 3.23Å; Y127-C213 HydrophobicContact CG-CB 4.06Å; V209-C213 WeakPolarHBondContact O-CB 3.46Å; V209-C213 PolarHBondContact O-N 2.82Å; V209-C213 PolarHBondContact O-SG 3.45Å; V209-C213 VanDerWaalsContact O-SG 3.4Å; C213-G216 PolarHBondContact O-N 3Å; C213-I217 VanDerWaalsContact O-CG1 3.25Å; C213-I217 WeakPolarHBondContact O-CG1 3.42Å; C213-I217 PolarHBondContact O-N 3.05Å
214Y87.2Confident87.6Confident28 Ų2867.9 Ų67.911%0.1135%0.353CS..Hα-helixtrans-72.3-31.3-177.5-77-78.9000112.8T123 M210 G216 I217 L218 V234 I237 F238T123-Y214 HydrophobicContact CG2-CE2 3.91Å; M210-Y214 HydrophobicContact CB-CD2 4.35Å; M210-Y214 HydrophobicContact CG-CD2 3.59Å; M210-Y214 HydrophobicContact CG-CE2 4.03Å; M210-Y214 VanDerWaalsContact O-CB 3.31Å; M210-Y214 WeakPolarHBondContact O-CB 3.31Å; M210-Y214 VanDerWaalsContact O-CD2 3.32Å; M210-Y214 WeakPolarHBondContact O-CD2 3.46Å; M210-Y214 PolarHBondContact O-N 3.32Å; Y214-G216 PolarHBondContact O-N 3.5Å; Y214-I217 HydrophobicContact CD1-CD1 4.26Å; Y214-I217 HydrophobicContact CE1-CD1 4.34Å; Y214-I217 PolarHBondContact O-N 3.23Å; Y214-L218 VanDerWaalsContact O-CB 3.24Å; Y214-L218 WeakPolarHBondContact O-CB 3.44Å; Y214-L218 PolarHBondContact O-N 3.48Å; Y214-V234 HydrophobicContact CE1-CG1 4.1Å; Y214-I237 VanDerWaalsContact OH-C 3.23Å; Y214-F238 AromaticContact CD1-CD2 3.7Å; Y214-F238 HydrophobicContact CD1-CD2 3.7Å; Y214-F238 HydrophobicContact CD1-CE2 4.27Å; Y214-F238 HydrophobicContact CD2-CD2 4.29Å; Y214-F238 HydrophobicContact CE1-CB 3.68Å; Y214-F238 AromaticContact CE1-CD2 3.44Å; Y214-F238 HydrophobicContact CE1-CD2 3.44Å; Y214-F238 VanDerWaalsContact CE1-CD2 3.44Å; Y214-F238 HydrophobicContact CE1-CE2 4.42Å; Y214-F238 AromaticContact CE1-CG 3.96Å; Y214-F238 HydrophobicContact CE1-CG 3.96Å; Y214-F238 HydrophobicContact CE2-CD2 4.06Å; Y214-F238 HydrophobicContact CG-CD2 4.13Å; Y214-F238 HydrophobicContact CG-CE2 4.43Å; Y214-F238 AromaticContact CZ-CD2 3.64Å; Y214-F238 WeakPolarHBondContact OH-CA 3.44Å; Y214-F238 PolarHBondContact OH-N 3.05Å
215S88.4Confident85.9Confident72 Ų7275 Ų7550%0.50337%0.372SS..Hα-helixtrans-58.6-47.4170.6-64.70000111.7V211 L218 K219V211-S215 WeakPolarHBondContact O-CB 3.24Å; V211-S215 PolarHBondContact O-N 3.1Å; V211-S215 VanDerWaalsContact O-N 3.16Å; V211-S215 PolarHBondContact O-OG 3.27Å; S215-L218 PolarHBondContact O-N 3.45Å; S215-K219 WeakPolarHBondContact O-CB 3.25Å; S215-K219 PolarHBondContact O-N 2.87Å
216G87.5Confident84.1Confident14 Ų1478.8 Ų78.814%0.14439%0.392CS..Hα-helixtrans-69.1-38178.100000113.6I212 C213 Y214 T220I212-G216 PolarHBondContact O-N 3.14Å; C213-G216 PolarHBondContact O-N 3Å; Y214-G216 PolarHBondContact O-N 3.5Å; G216-T220 WeakPolarHBondContact O-CB 3.4Å; G216-T220 PolarHBondContact O-N 2.03Å; G216-T220 VanDerWaalsContact O-N 3.11Å; G216-T220 PolarHBondContact O-OG1 2.86Å
217I85.9Confident82.7Confident3 Ų384.3 Ų84.32%0.01542%0.418CS..Hα-helixtrans-61.5-49.5173.9-70.8164.4000109.9Y127 V130 V131 C213 Y214 K219 T220 L221 V234Y127-I217 HydrophobicContact CD2-CG1 4.16Å; V130-I217 HydrophobicContact CB-CG1 4.38Å; V130-I217 HydrophobicContact CG1-CG1 4.39Å; V130-I217 HydrophobicContact CG1-CG2 4.3Å; V131-I217 HydrophobicContact CG2-CG1 4.26Å; C213-I217 VanDerWaalsContact O-CG1 3.25Å; C213-I217 WeakPolarHBondContact O-CG1 3.42Å; C213-I217 PolarHBondContact O-N 3.05Å; Y214-I217 HydrophobicContact CD1-CD1 4.26Å; Y214-I217 HydrophobicContact CE1-CD1 4.34Å; Y214-I217 PolarHBondContact O-N 3.23Å; I217-K219 PolarHBondContact O-N 2.95Å; I217-T220 PolarHBondContact O-N 3.49Å; I217-T220 VanDerWaalsContact O-N 3.14Å; I217-L221 HydrophobicContact CG2-CD1 3.69Å; I217-L221 HydrophobicContact CG2-CG 4.03Å; I217-L221 WeakPolarHBondContact O-CB 3.46Å; I217-L221 VanDerWaalsContact O-CG 3.29Å; I217-L221 WeakPolarHBondContact O-CG 3.21Å; I217-L221 PolarHBondContact O-N 2.87Å; I217-V234 HydrophobicContact CG2-CG1 3.77Å; I217-V234 HydrophobicContact CG2-CG2 3.96Å
218L84.6Confident81.2Confident102 Ų10288.6 Ų88.653%0.53443%0.433SS..Hα-helixtrans-61.3-45.5-178.2-173.962000111.2Y214 S215 T220 L221 L222Y214-L218 VanDerWaalsContact O-CB 3.24Å; Y214-L218 WeakPolarHBondContact O-CB 3.44Å; Y214-L218 PolarHBondContact O-N 3.48Å; S215-L218 PolarHBondContact O-N 3.45Å; L218-T220 VanDerWaalsContact C-N 3.26Å; L218-T220 PolarHBondContact O-N 3.33Å; L218-L221 PolarHBondContact O-N 3.46Å; L218-L222 HydrophobicContact CD1-CD1 4.44Å; L218-L222 HydrophobicContact CD1-CG 4.36Å; L218-L222 HydrophobicContact CG-CD1 4.09Å; L218-L222 HydrophobicContact CG-CG 4.45Å; L218-L222 WeakPolarHBondContact O-CB 3.48Å; L218-L222 VanDerWaalsContact O-CG 3.28Å; L218-L222 WeakPolarHBondContact O-CG 3.32Å; L218-L222 PolarHBondContact O-N 3.35Å
219K86.3Confident79.5Confident165 Ų16591.1 Ų91.172%0.71744%0.44SS*.Hα-helixtrans-55.5-41.9174.6-173.4176-178.5176.20112.3S215 I217 R223S215-K219 WeakPolarHBondContact O-CB 3.25Å; S215-K219 PolarHBondContact O-N 2.87Å; I217-K219 PolarHBondContact O-N 2.95Å; K219-R223 PolarHBondContact O-N 2.95Å
220T80.8Confident78.1Confident31 Ų3193 Ų9319%0.1945%0.445CS..Hα-helixtrans-76.5-31.7-179.4-52.10000112.7V130 G216 I217 L218 C224 R230V130-T220 HydrophobicContact CG1-CG2 4.24Å; G216-T220 WeakPolarHBondContact O-CB 3.4Å; G216-T220 PolarHBondContact O-N 2.03Å; G216-T220 VanDerWaalsContact O-N 3.11Å; G216-T220 PolarHBondContact O-OG1 2.86Å; I217-T220 PolarHBondContact O-N 3.49Å; I217-T220 VanDerWaalsContact O-N 3.14Å; L218-T220 VanDerWaalsContact C-N 3.26Å; L218-T220 PolarHBondContact O-N 3.33Å; T220-C224 PolarHBondContact O-N 3.32Å; T220-R230 PolarHBondContact O-NH2 3.34Å
221L76.8Confident77.1Confident23 Ų2395.1 Ų95.112%0.1245%0.454CS..Hα-helixtrans-70.3-41.9174.4-72.8-179.8000111.5I217 L218 R223 C224 R230 V234I217-L221 HydrophobicContact CG2-CD1 3.69Å; I217-L221 HydrophobicContact CG2-CG 4.03Å; I217-L221 WeakPolarHBondContact O-CB 3.46Å; I217-L221 VanDerWaalsContact O-CG 3.29Å; I217-L221 WeakPolarHBondContact O-CG 3.21Å; I217-L221 PolarHBondContact O-N 2.87Å; L218-L221 PolarHBondContact O-N 3.46Å; L221-R223 VanDerWaalsContact C-N 3.28Å; L221-R223 PolarHBondContact O-N 2.99Å; L221-C224 CarbonylContact O-C 3.56Å; L221-C224 PolarHBondContact O-N 3.27Å; L221-R230 HydrophobicContact CD2-CG 4.26Å; L221-V234 HydrophobicContact CD1-CG1 4.44Å
222L78.8Confident76.1Confident139 Ų13996.9 Ų96.973%0.72845%0.452SS*.Hα-helixtrans-64-34.5176.4-69.3171.3000111.9L218L218-L222 HydrophobicContact CD1-CD1 4.44Å; L218-L222 HydrophobicContact CD1-CG 4.36Å; L218-L222 HydrophobicContact CG-CD1 4.09Å; L218-L222 HydrophobicContact CG-CG 4.45Å; L218-L222 WeakPolarHBondContact O-CB 3.48Å; L218-L222 VanDerWaalsContact O-CG 3.28Å; L218-L222 WeakPolarHBondContact O-CG 3.32Å; L218-L222 PolarHBondContact O-N 3.35Å
223R78.6Confident74.8Confident225 Ų22594 Ų9485%0.84944%0.442SS*.Hα-helixtrans-76.9-28.4179-165.1173.1-177.7-177.31.2113.9K219 L221K219-R223 PolarHBondContact O-N 2.95Å; L221-R223 VanDerWaalsContact C-N 3.28Å; L221-R223 PolarHBondContact O-N 2.99Å
224C66.2Low74.1Confident62 Ų6294.3 Ų94.342%0.41944%0.444SS..  trans-124.994.3-176.3-55.80000110.8T220 L221 N226 R230T220-C224 PolarHBondContact O-N 3.32Å; L221-C224 CarbonylContact O-C 3.56Å; L221-C224 PolarHBondContact O-N 3.27Å; C224-N226 PolarHBondContact O-N 3.18Å; C224-R230 PolarHBondContact O-NH2 2.9Å; C224-R230 VanDerWaalsContact O-NH2 3.1Å
225R61.8Low73.8Confident226 Ų22699 Ų9985%0.85346%0.461SS*.THydrogen-bonded Turntrans-75.3-9.6-168.4-161.9163.9103.91653.6116.1
226N56Low73.4Confident142 Ų14297 Ų9776%0.75945%0.445SS*.THydrogen-bonded Turntrans-106.86.8-157.3-72.5-5.2000118C224C224-N226 PolarHBondContact O-N 3.18Å
227E65Low73.1Confident115 Ų11596.6 Ų96.654%0.53744%0.439SS..  trans-116.882.9-173.3-75-65.9161.100114.3K229 R230 H231E227-K229 PolarHBondContact O-N 2.71Å; E227-K229 VanDerWaalsContact O-N 3.1Å; E227-R230 HydrophobicContact CB-CB 4.09Å; E227-R230 WeakPolarHBondContact O-CB 3.18Å; E227-R230 PolarHBondContact O-N 3.15Å; E227-H231 PolarHBondContact O-CD2 3.06Å
228K63.2Low73.1Confident172 Ų172100.3 Ų100.375%0.74846%0.455SS*.Hα-helixtrans-52-33.6179.1-69.3-177.6-178.6177.10113.7
229K60.1Low73.3Confident154 Ų15497.4 Ų97.467%0.6744%0.442SS*.Hα-helixtrans-69.4-31.5-179-167.5176.5-179.8-179.70112.7E227E227-K229 PolarHBondContact O-N 2.71Å; E227-K229 VanDerWaalsContact O-N 3.1Å
230R65.8Low73.4Confident57 Ų5789.6 Ų89.622%0.21541%0.408CS..Hα-helixtrans-69.4-40.5178.7-167.8169.567.2159.74111.5V130 T220 L221 C224 E227 R232 A233 V234V130-R230 HydrophobicContact CG2-CG 3.9Å; T220-R230 PolarHBondContact O-NH2 3.34Å; L221-R230 HydrophobicContact CD2-CG 4.26Å; C224-R230 PolarHBondContact O-NH2 2.9Å; C224-R230 VanDerWaalsContact O-NH2 3.1Å; E227-R230 HydrophobicContact CB-CB 4.09Å; E227-R230 WeakPolarHBondContact O-CB 3.18Å; E227-R230 PolarHBondContact O-N 3.15Å; R230-R232 VanDerWaalsContact C-N 3.34Å; R230-R232 PolarHBondContact O-N 2.85Å; R230-A233 PolarHBondContact O-N 2.96Å; R230-V234 WeakPolarHBondContact O-CG2 3.3Å; R230-V234 PolarHBondContact O-N 3.45Å
231H69.3Low73.7Confident76 Ų7688.1 Ų88.135%0.35240%0.399SS..Hα-helixtrans-61.6-37.5177.3-66.7-78.4000113.1E227 R235E227-H231 PolarHBondContact O-CD2 3.06Å; H231-R235 WeakPolarHBondContact O-CB 3.48Å; H231-R235 PolarHBondContact O-N 3.21Å
232R70.3Confident74.4Confident125 Ų12590 Ų9047%0.47241%0.408SS..Hα-helixtrans-65.5-43.2-178.3-67.5-177.1-174.5171.92.4113R230 R235 L236 E302R230-R232 VanDerWaalsContact C-N 3.34Å; R230-R232 PolarHBondContact O-N 2.85Å; R232-R235 PolarHBondContact O-N 3.39Å; R232-L236 PolarHBondContact O-N 3.29Å; R232-L236 VanDerWaalsContact O-N 3.15Å; R232-E302 WeakPolarHBondContact CD-OE2 3.42Å; R232-E302 IonicContact CZ-OE1 3.17Å; R232-E302 IonicContact CZ-OE2 3.22Å; R232-E302 VanDerWaalsContact CZ-OE2 3.25Å; R232-E302 IonicContact NE-OE1 3.31Å; R232-E302 PolarHBondContact NE-OE1 3.36Å; R232-E302 IonicContact NE-OE2 3.85Å; R232-E302 IonicContact NH1-OE1 2.76Å; R232-E302 IonicContact NH1-OE2 2.62Å; R232-E302 PolarHBondContact NH1-OE2 3.43Å
233A67.6Low75.2Confident35 Ų3584.4 Ų84.429%0.28938%0.38SS..Hα-helixtrans-70.7-37.8179.900000112.2R230 R235 L236 I237R230-A233 PolarHBondContact O-N 2.96Å; A233-R235 VanDerWaalsContact C-N 3.35Å; A233-L236 PolarHBondContact O-N 3.24Å; A233-I237 PolarHBondContact O-N 3.46Å
234V76.2Confident75.9Confident15 Ų1573.9 Ų73.99%0.09134%0.34CS..Hα-helixtrans-62.7-43.4173.31730000110.6V130 Y214 I217 L221 R230 L236 I237 F238V130-V234 HydrophobicContact CG2-CG2 4.08Å; Y214-V234 HydrophobicContact CE1-CG1 4.1Å; I217-V234 HydrophobicContact CG2-CG1 3.77Å; I217-V234 HydrophobicContact CG2-CG2 3.96Å; L221-V234 HydrophobicContact CD1-CG1 4.44Å; R230-V234 WeakPolarHBondContact O-CG2 3.3Å; R230-V234 PolarHBondContact O-N 3.45Å; V234-L236 PolarHBondContact O-N 3.47Å; V234-I237 PolarHBondContact O-N 2.9Å; V234-F238 VanDerWaalsContact O-CB 3.25Å; V234-F238 WeakPolarHBondContact O-CB 3.09Å; V234-F238 PolarHBondContact O-N 3.48Å
235R80.9Confident77.2Confident125 Ų12572.2 Ų72.247%0.47233%0.326SS..Hα-helixtrans-57.9-45.7177.1-172.4177.970.4-173.82.8112H231 R232 A233 F238 T239H231-R235 WeakPolarHBondContact O-CB 3.48Å; H231-R235 PolarHBondContact O-N 3.21Å; R232-R235 PolarHBondContact O-N 3.39Å; A233-R235 VanDerWaalsContact C-N 3.35Å; R235-F238 PolarHBondContact O-N 2.93Å; R235-T239 PolarHBondContact O-N 3.47Å; R235-T239 PolarHBondContact O-OG1 2.99Å
236L80.3Confident78.8Confident31 Ų3166.8 Ų66.816%0.16231%0.313CS..Hα-helixtrans-59.1-52.5179.5179.864.8000112R232 A233 V234 F238 T239 I240 I296 Y297 V300R232-L236 PolarHBondContact O-N 3.29Å; R232-L236 VanDerWaalsContact O-N 3.15Å; A233-L236 PolarHBondContact O-N 3.24Å; V234-L236 PolarHBondContact O-N 3.47Å; L236-F238 VanDerWaalsContact C-N 3.3Å; L236-F238 PolarHBondContact O-N 3.47Å; L236-T239 PolarHBondContact O-N 3.32Å; L236-I240 HydrophobicContact CD1-CD1 4.43Å; L236-I240 HydrophobicContact CG-CD1 4.17Å; L236-I240 WeakPolarHBondContact O-CG1 3.44Å; L236-I240 PolarHBondContact O-N 3.13Å; L236-I240 VanDerWaalsContact O-N 3.07Å; L236-I296 HydrophobicContact CD1-CG2 3.89Å; L236-Y297 HydrophobicContact CD1-CD1 4.26Å; L236-V300 HydrophobicContact CB-CG1 4.36Å; L236-V300 HydrophobicContact CD1-CB 3.84Å; L236-V300 HydrophobicContact CD1-CG1 3.85Å
237I80.5Confident80.7Confident6 Ų661.9 Ų61.93%0.03129%0.285CS..Hα-helixtrans-68.1-33.9-177.4-58-48.3000111.4L122 T123 R126 Y214 A233 V234 I240 M241L122-I237 HydrophobicContact CB-CD1 4.36Å; L122-I237 HydrophobicContact CB-CG2 4.42Å; L122-I237 HydrophobicContact CD2-CD1 4.45Å; T123-I237 WeakPolarHBondContact OG1-CG2 3.45Å; R126-I237 HydrophobicContact CG-CB 4.09Å; R126-I237 HydrophobicContact CG-CG1 3.48Å; R126-I237 VanDerWaalsContact CG-CG1 3.48Å; R126-I237 HydrophobicContact CG-CG2 4.32Å; Y214-I237 VanDerWaalsContact OH-C 3.23Å; A233-I237 PolarHBondContact O-N 3.46Å; V234-I237 PolarHBondContact O-N 2.9Å; I237-I240 HydrophobicContact CD1-CD1 3.87Å; I237-I240 PolarHBondContact O-N 3.1Å; I237-M241 PolarHBondContact O-N 2.97Å
238F85.4Confident82.2Confident81 Ų8156.8 Ų56.836%0.35526%0.261SS..Hα-helixtrans-63.7-42.8174.5-174.4-113.1000112M210 Y214 V234 R235 L236 M241 I242M210-F238 HydrophobicContact CE-CD2 4.07Å; M210-F238 HydrophobicContact CE-CE2 3.57Å; M210-F238 HydrophobicContact CE-CZ 4.41Å; Y214-F238 AromaticContact CD1-CD2 3.7Å; Y214-F238 HydrophobicContact CD1-CD2 3.7Å; Y214-F238 HydrophobicContact CD1-CE2 4.27Å; Y214-F238 HydrophobicContact CD2-CD2 4.29Å; Y214-F238 HydrophobicContact CE1-CB 3.68Å; Y214-F238 AromaticContact CE1-CD2 3.44Å; Y214-F238 HydrophobicContact CE1-CD2 3.44Å; Y214-F238 VanDerWaalsContact CE1-CD2 3.44Å; Y214-F238 HydrophobicContact CE1-CE2 4.42Å; Y214-F238 AromaticContact CE1-CG 3.96Å; Y214-F238 HydrophobicContact CE1-CG 3.96Å; Y214-F238 HydrophobicContact CE2-CD2 4.06Å; Y214-F238 HydrophobicContact CG-CD2 4.13Å; Y214-F238 HydrophobicContact CG-CE2 4.43Å; Y214-F238 AromaticContact CZ-CD2 3.64Å; Y214-F238 WeakPolarHBondContact OH-CA 3.44Å; Y214-F238 PolarHBondContact OH-N 3.05Å; V234-F238 VanDerWaalsContact O-CB 3.25Å; V234-F238 WeakPolarHBondContact O-CB 3.09Å; V234-F238 PolarHBondContact O-N 3.48Å; R235-F238 PolarHBondContact O-N 2.93Å; L236-F238 VanDerWaalsContact C-N 3.3Å; L236-F238 PolarHBondContact O-N 3.47Å; F238-M241 PolarHBondContact O-N 2.89Å; F238-I242 HydrophobicContact CD1-CD1 3.64Å; F238-I242 HydrophobicContact CD2-CD1 4.26Å; F238-I242 HydrophobicContact CE1-CD1 3.19Å; F238-I242 HydrophobicContact CE1-CG1 4.4Å; F238-I242 HydrophobicContact CE2-CD1 3.89Å; F238-I242 HydrophobicContact CE2-CG1 4.42Å; F238-I242 HydrophobicContact CG-CD1 4.18Å; F238-I242 HydrophobicContact CZ-CD1 3.35Å; F238-I242 HydrophobicContact CZ-CG1 4.32Å; F238-I242 WeakPolarHBondContact O-CG1 3.37Å; F238-I242 PolarHBondContact O-N 3.22Å
239T88.9Confident83.7Confident40 Ų4049.5 Ų49.525%0.24523%0.233CC..Hα-helixtrans-61.6-45.7174.7-58.80000111.6R235 L236 M241 I242 V243 I296 V300R235-T239 PolarHBondContact O-N 3.47Å; R235-T239 PolarHBondContact O-OG1 2.99Å; L236-T239 PolarHBondContact O-N 3.32Å; T239-M241 VanDerWaalsContact C-N 3.31Å; T239-M241 PolarHBondContact O-N 2.91Å; T239-I242 PolarHBondContact O-N 3.47Å; T239-V243 HydrophobicContact CG2-CG2 4.19Å; T239-V243 WeakPolarHBondContact O-CB 3.29Å; T239-V243 VanDerWaalsContact O-CG2 3.25Å; T239-V243 WeakPolarHBondContact O-CG2 3.29Å; T239-V243 PolarHBondContact O-N 3.3Å; T239-I296 HydrophobicContact CG2-CG2 4.06Å; T239-V300 HydrophobicContact CG2-CG2 4.25Å
240I88.1Confident85.4Confident2 Ų244.1 Ų44.11%0.0121%0.213CC..Hα-helixtrans-57.8-46.3177.7-63.6164.4000110.6I119 L236 I237 V243 Y244 I296 Y297I119-I240 HydrophobicContact CD1-CG2 4.15Å; I119-I240 HydrophobicContact CG1-CG2 4.08Å; L236-I240 HydrophobicContact CD1-CD1 4.43Å; L236-I240 HydrophobicContact CG-CD1 4.17Å; L236-I240 WeakPolarHBondContact O-CG1 3.44Å; L236-I240 PolarHBondContact O-N 3.13Å; L236-I240 VanDerWaalsContact O-N 3.07Å; I237-I240 HydrophobicContact CD1-CD1 3.87Å; I237-I240 PolarHBondContact O-N 3.1Å; I240-V243 PolarHBondContact O-N 2.81Å; I240-Y244 PolarHBondContact O-N 2.83Å; I240-I296 HydrophobicContact CG1-CD1 4.31Å; I240-I296 HydrophobicContact CG1-CG2 3.89Å; I240-Y297 HydrophobicContact CD1-CE1 3.63Å; I240-Y297 HydrophobicContact CG1-CE1 4.39Å
241M88Confident86.8Confident0 Ų042.6 Ų42.60%021%0.208CC..Hα-helixtrans-64.8-44.8-179.4-173.16877.800112.7I119 T123 P206 M210 I237 F238 T239 Y244 F245I119-M241 HydrophobicContact CG2-CE 3.46Å; I119-M241 VanDerWaalsContact CG2-CE 3.46Å; I119-M241 HydrophobicContact CG2-SD 3.66Å; T123-M241 HydrophobicContact CG2-CE 4.37Å; T123-M241 WeakPolarHBondContact OG1-CE 3.41Å; P206-M241 HydrophobicContact CB-SD 4.37Å; M210-M241 HydrophobicContact CB-CG 4.46Å; M210-M241 HydrophobicContact CG-CG 4.19Å; M210-M241 HydrophobicContact SD-CG 3.96Å; I237-M241 PolarHBondContact O-N 2.97Å; F238-M241 PolarHBondContact O-N 2.89Å; T239-M241 VanDerWaalsContact C-N 3.31Å; T239-M241 PolarHBondContact O-N 2.91Å; M241-Y244 WeakPolarHBondContact O-CB 3.31Å; M241-Y244 PolarHBondContact O-N 3.01Å; M241-F245 HydrophobicContact CG-CD2 4.13Å; M241-F245 HydrophobicContact CG-CE2 3.62Å; M241-F245 WeakPolarHBondContact O-CD2 3.46Å; M241-F245 PolarHBondContact O-N 2.85Å; M241-F245 HydrophobicContact SD-CD2 4.48Å; M241-F245 HydrophobicContact SD-CE2 3.69Å; M241-F245 HydrophobicContact SD-CZ 4.1Å
242I92.3Very high88.1Confident61 Ų6139 Ų3931%0.31319%0.191SC..Hα-helixtrans-63.9-45.1177.9-71.3172000110.8M210 F238 T239 Y244 F245 L246M210-I242 HydrophobicContact CE-CG1 3.93Å; F238-I242 HydrophobicContact CD1-CD1 3.64Å; F238-I242 HydrophobicContact CD2-CD1 4.26Å; F238-I242 HydrophobicContact CE1-CD1 3.19Å; F238-I242 HydrophobicContact CE1-CG1 4.4Å; F238-I242 HydrophobicContact CE2-CD1 3.89Å; F238-I242 HydrophobicContact CE2-CG1 4.42Å; F238-I242 HydrophobicContact CG-CD1 4.18Å; F238-I242 HydrophobicContact CZ-CD1 3.35Å; F238-I242 HydrophobicContact CZ-CG1 4.32Å; F238-I242 WeakPolarHBondContact O-CG1 3.37Å; F238-I242 PolarHBondContact O-N 3.22Å; T239-I242 PolarHBondContact O-N 3.47Å; I242-Y244 VanDerWaalsContact C-N 3.27Å; I242-Y244 PolarHBondContact O-N 3.39Å; I242-F245 PolarHBondContact O-N 2.81Å; I242-F245 VanDerWaalsContact O-N 3.12Å; I242-L246 HydrophobicContact CG2-CD1 3.91Å; I242-L246 HydrophobicContact CG2-CG 4.14Å; I242-L246 WeakPolarHBondContact O-CG 3.35Å; I242-L246 PolarHBondContact O-N 3.33Å
243V94.4Very high89.2Confident22 Ų2237.4 Ų37.413%0.13319%0.191CC..Hα-helixtrans-61.7-39.1179.4172.40000110.7T239 I240 F245 L246 F247 I292 I296T239-V243 HydrophobicContact CG2-CG2 4.19Å; T239-V243 WeakPolarHBondContact O-CB 3.29Å; T239-V243 VanDerWaalsContact O-CG2 3.25Å; T239-V243 WeakPolarHBondContact O-CG2 3.29Å; T239-V243 PolarHBondContact O-N 3.3Å; I240-V243 PolarHBondContact O-N 2.81Å; V243-F245 PolarHBondContact O-N 3.27Å; V243-L246 PolarHBondContact O-N 3.35Å; V243-F247 HydrophobicContact CG1-CD2 3.87Å; V243-F247 HydrophobicContact CG1-CE2 3.83Å; V243-F247 WeakPolarHBondContact O-CD2 3.46Å; V243-F247 PolarHBondContact O-N 3.43Å; V243-F247 VanDerWaalsContact O-N 3.13Å; V243-I292 HydrophobicContact CG1-CB 4.49Å; V243-I292 HydrophobicContact CG1-CG2 3.71Å; V243-I296 HydrophobicContact CB-CD1 3.94Å; V243-I296 HydrophobicContact CG1-CD1 3.99Å; V243-I296 HydrophobicContact CG2-CD1 4Å
244Y93Very high90.5Very high5 Ų536.6 Ų36.62%0.0218%0.182CC..Hα-helixtrans-55.1-50.1171.9176.4-92.1000111.9I116 I119 G202 I240 M241 I242 L246 F247 W248 H289I116-Y244 HydrophobicContact CB-CE2 4.14Å; I116-Y244 HydrophobicContact CD1-CD1 3.71Å; I116-Y244 HydrophobicContact CD1-CD2 4.24Å; I116-Y244 HydrophobicContact CD1-CE1 3.33Å; I116-Y244 HydrophobicContact CD1-CE2 3.91Å; I116-Y244 HydrophobicContact CD1-CG 4.15Å; I116-Y244 VanDerWaalsContact CD1-CZ 3.44Å; I116-Y244 HydrophobicContact CG1-CE1 3.98Å; I116-Y244 HydrophobicContact CG1-CE2 4.36Å; I119-Y244 HydrophobicContact CD1-CD2 3.85Å; I119-Y244 HydrophobicContact CD1-CG 4.17Å; G202-Y244 VanDerWaalsContact O-CE1 3.3Å; G202-Y244 WeakPolarHBondContact O-CE1 3.5Å; G202-Y244 PolarHBondContact O-OH 2.85Å; G202-Y244 VanDerWaalsContact O-OH 3.1Å; I240-Y244 PolarHBondContact O-N 2.83Å; M241-Y244 WeakPolarHBondContact O-CB 3.31Å; M241-Y244 PolarHBondContact O-N 3.01Å; I242-Y244 VanDerWaalsContact C-N 3.27Å; I242-Y244 PolarHBondContact O-N 3.39Å; Y244-L246 PolarHBondContact O-N 2.87Å; Y244-F247 PolarHBondContact O-N 2.9Å; Y244-W248 AromaticContact CD2-CD1 3.51Å; Y244-W248 HydrophobicContact CD2-CG 4.33Å; Y244-W248 HydrophobicContact CE1-CB 4.23Å; Y244-W248 HydrophobicContact CE2-CB 4.22Å; Y244-W248 AromaticContact CE2-CD1 3.33Å; Y244-W248 AromaticContact CE2-CG 3.85Å; Y244-W248 HydrophobicContact CE2-CG 3.85Å; Y244-W248 AromaticContact CE2-NE1 3.93Å; Y244-W248 AromaticContact CZ-CD1 3.98Å; Y244-W248 WeakPolarHBondContact O-CB 3.26Å; Y244-W248 PolarHBondContact O-N 2.93Å; Y244-H289 AromaticContact CD2-CE1 3.81Å; Y244-H289 AromaticContact CD2-NE2 3.88Å
245F94.4Very high91.3Very high27 Ų2736.7 Ų36.712%0.11818%0.182CC..Hα-helixtrans-64.5-38.9178.6-71.1-58.1000113.2L203 P206 L207 M210 M241 I242 V243 F247 A249L203-F245 HydrophobicContact CD1-CD1 3.77Å; L203-F245 HydrophobicContact CD1-CE1 3.87Å; P206-F245 HydrophobicContact CB-CE1 4.28Å; P206-F245 HydrophobicContact CB-CZ 3.87Å; P206-F245 HydrophobicContact CG-CE1 4.03Å; P206-F245 HydrophobicContact CG-CZ 4.11Å; L207-F245 HydrophobicContact CB-CE1 4.32Å; L207-F245 HydrophobicContact CB-CZ 4.06Å; L207-F245 HydrophobicContact CD1-CE2 4.47Å; L207-F245 HydrophobicContact CD1-CZ 4.28Å; M210-F245 HydrophobicContact SD-CD2 4.07Å; M210-F245 HydrophobicContact SD-CE2 3.57Å; M210-F245 VanDerWaalsContact SD-CE2 3.57Å; M241-F245 HydrophobicContact CG-CD2 4.13Å; M241-F245 HydrophobicContact CG-CE2 3.62Å; M241-F245 WeakPolarHBondContact O-CD2 3.46Å; M241-F245 PolarHBondContact O-N 2.85Å; M241-F245 HydrophobicContact SD-CD2 4.48Å; M241-F245 HydrophobicContact SD-CE2 3.69Å; M241-F245 HydrophobicContact SD-CZ 4.1Å; I242-F245 PolarHBondContact O-N 2.81Å; I242-F245 VanDerWaalsContact O-N 3.12Å; V243-F245 PolarHBondContact O-N 3.27Å; F245-F247 PolarHBondContact O-N 3.13Å; F245-A249 WeakPolarHBondContact O-CA 3.3Å; F245-A249 WeakPolarHBondContact O-CB 3.49Å; F245-A249 PolarHBondContact O-N 3.17Å
246L95.9Very high92Very high112 Ų11233.3 Ų33.359%0.58617%0.173SC*.Hα-helixtrans-60.1-34.2177.3-71.3174.4000112.3I242 V243 Y244 P250I242-L246 HydrophobicContact CG2-CD1 3.91Å; I242-L246 HydrophobicContact CG2-CG 4.14Å; I242-L246 WeakPolarHBondContact O-CG 3.35Å; I242-L246 PolarHBondContact O-N 3.33Å; V243-L246 PolarHBondContact O-N 3.35Å; Y244-L246 PolarHBondContact O-N 2.87Å; L246-P250 WeakPolarHBondContact O-CD 3.45Å; L246-P250 WeakPolarHBondContact O-CG 3.25Å
247F95.6Very high92.5Very high38 Ų3834.2 Ų34.217%0.16718%0.178CC..Hα-helixtrans-90.5-38.5-177.1-77.7-116.1000112.6V243 Y244 F245 L285 T288 H289 I292V243-F247 HydrophobicContact CG1-CD2 3.87Å; V243-F247 HydrophobicContact CG1-CE2 3.83Å; V243-F247 WeakPolarHBondContact O-CD2 3.46Å; V243-F247 PolarHBondContact O-N 3.43Å; V243-F247 VanDerWaalsContact O-N 3.13Å; Y244-F247 PolarHBondContact O-N 2.9Å; F245-F247 PolarHBondContact O-N 3.13Å; F247-L285 HydrophobicContact CD1-CD1 3.84Å; F247-L285 HydrophobicContact CD1-CG 4.25Å; F247-L285 VanDerWaalsContact CD1-O 3.3Å; F247-L285 WeakPolarHBondContact CD1-O 3.2Å; F247-L285 HydrophobicContact CE1-CD1 3.95Å; F247-L285 HydrophobicContact CG-CD1 4.33Å; F247-L285 HydrophobicContact CG-CG 4.48Å; F247-T288 WeakPolarHBondContact CD1-OG1 3.46Å; F247-T288 VanDerWaalsContact CE1-OG1 3.23Å; F247-T288 WeakPolarHBondContact CE1-OG1 3.38Å; F247-H289 HydrophobicContact CB-CB 3.93Å; F247-H289 HydrophobicContact CD1-CB 3.95Å; F247-H289 HydrophobicContact CG-CB 4.17Å; F247-I292 HydrophobicContact CE1-CD1 4.23Å; F247-I292 HydrophobicContact CE1-CG1 3.8Å; F247-I292 HydrophobicContact CZ-CD1 4.13Å; F247-I292 HydrophobicContact CZ-CG1 3.86Å
248W95.8Very high93Very high9 Ų935.2 Ų35.23%0.03418%0.183CC..Hα-helixtrans-101.7-27.9-172.8-75.9104.1000115.1F79 F112 Y244 P250 Y251 N252 G286 H289F79-W248 HydrophobicContact CE2-CH2 4.11Å; F79-W248 HydrophobicContact CE2-CZ2 4.22Å; F79-W248 AromaticContact CZ-CH2 3.99Å; F79-W248 HydrophobicContact CZ-CH2 3.99Å; F79-W248 HydrophobicContact CZ-CZ2 4.07Å; F112-W248 HydrophobicContact CD2-CD2 4.2Å; F112-W248 HydrophobicContact CD2-CE3 4.06Å; F112-W248 AromaticContact CD2-CH2 3.58Å; F112-W248 HydrophobicContact CD2-CH2 3.58Å; F112-W248 AromaticContact CD2-CZ2 3.75Å; F112-W248 HydrophobicContact CD2-CZ2 3.75Å; F112-W248 AromaticContact CD2-CZ3 3.75Å; F112-W248 HydrophobicContact CD2-CZ3 3.75Å; F112-W248 AromaticContact CE2-CD2 3.69Å; F112-W248 HydrophobicContact CE2-CD2 3.69Å; F112-W248 AromaticContact CE2-CE3 3.47Å; F112-W248 HydrophobicContact CE2-CE3 3.47Å; F112-W248 VanDerWaalsContact CE2-CE3 3.47Å; F112-W248 HydrophobicContact CE2-CG 4.4Å; F112-W248 AromaticContact CE2-CH2 3.89Å; F112-W248 HydrophobicContact CE2-CH2 3.89Å; F112-W248 HydrophobicContact CE2-CZ2 4.11Å; F112-W248 AromaticContact CE2-CZ3 3.57Å; F112-W248 HydrophobicContact CE2-CZ3 3.57Å; F112-W248 HydrophobicContact CZ-CE3 4.46Å; Y244-W248 AromaticContact CD2-CD1 3.51Å; Y244-W248 HydrophobicContact CD2-CG 4.33Å; Y244-W248 HydrophobicContact CE1-CB 4.23Å; Y244-W248 HydrophobicContact CE2-CB 4.22Å; Y244-W248 AromaticContact CE2-CD1 3.33Å; Y244-W248 AromaticContact CE2-CG 3.85Å; Y244-W248 HydrophobicContact CE2-CG 3.85Å; Y244-W248 AromaticContact CE2-NE1 3.93Å; Y244-W248 AromaticContact CZ-CD1 3.98Å; Y244-W248 WeakPolarHBondContact O-CB 3.26Å; Y244-W248 PolarHBondContact O-N 2.93Å; W248-P250 VanDerWaalsContact C-CD 3.48Å; W248-Y251 HydrophobicContact CE3-CD1 4.1Å; W248-Y251 HydrophobicContact CZ3-CD1 4.1Å; W248-Y251 PolarHBondContact O-N 3.42Å; W248-N252 PolarHBondContact O-N 3.07Å; W248-N252 VanDerWaalsContact O-N 3.09Å; W248-N252 PolarHBondContact O-ND2 3.29Å; W248-G286 VanDerWaalsContact CZ2-O 3.24Å; W248-G286 WeakPolarHBondContact CZ2-O 3.32Å; W248-H289 AromaticContact CD1-CG 3.87Å; W248-H289 AromaticContact NE1-CG 3.53Å; W248-H289 AromaticContact NE1-ND1 3.59Å
249A94.9Very high93.1Very high18 Ų1831.7 Ų31.715%0.14917%0.169CC..Hα-helixtrans-60.5-40.2178.700000112.9L203 F245 Y251 N252 I253L203-A249 HydrophobicContact CD1-CB 3.76Å; F245-A249 WeakPolarHBondContact O-CA 3.3Å; F245-A249 WeakPolarHBondContact O-CB 3.49Å; F245-A249 PolarHBondContact O-N 3.17Å; A249-Y251 VanDerWaalsContact C-N 3.31Å; A249-Y251 PolarHBondContact O-N 3.25Å; A249-N252 PolarHBondContact O-N 3.11Å; A249-I253 WeakPolarHBondContact O-CD1 3.46Å; A249-I253 VanDerWaalsContact O-CG1 3.25Å; A249-I253 WeakPolarHBondContact O-CG1 3.22Å; A249-I253 PolarHBondContact O-N 2.67Å
250P96.7Very high93.2Very high41 Ų4132.4 Ų32.427%0.26617%0.169SC..Hα-helixtrans-55.4-45.8176-26.736000112.5L246 W248 I253 V254 T282 L285L246-P250 WeakPolarHBondContact O-CD 3.45Å; L246-P250 WeakPolarHBondContact O-CG 3.25Å; W248-P250 VanDerWaalsContact C-CD 3.48Å; P250-I253 PolarHBondContact O-N 3.08Å; P250-V254 VanDerWaalsContact O-CG2 3.3Å; P250-V254 WeakPolarHBondContact O-CG2 3.48Å; P250-V254 PolarHBondContact O-N 3.09Å; P250-T282 HydrophobicContact CB-CG2 3.59Å; P250-L285 HydrophobicContact CG-CD2 4.26Å
251Y95.3Very high93Very high25 Ų2533.8 Ų33.810%0.09818%0.175CC..Hα-helixtrans-63.6-46.1178174.2-103.8000112W248 A249 I253 V254 L255 M279 E283W248-Y251 HydrophobicContact CE3-CD1 4.1Å; W248-Y251 HydrophobicContact CZ3-CD1 4.1Å; W248-Y251 PolarHBondContact O-N 3.42Å; A249-Y251 VanDerWaalsContact C-N 3.31Å; A249-Y251 PolarHBondContact O-N 3.25Å; Y251-I253 VanDerWaalsContact C-N 3.31Å; Y251-I253 PolarHBondContact O-N 2.95Å; Y251-V254 PolarHBondContact O-N 2.9Å; Y251-L255 HydrophobicContact CE1-CD2 4.2Å; Y251-L255 VanDerWaalsContact O-CB 3.26Å; Y251-L255 WeakPolarHBondContact O-CB 3.18Å; Y251-L255 PolarHBondContact O-N 3.05Å; Y251-M279 HydrophobicContact CE2-CG 4.29Å; Y251-E283 HydrophobicContact CD2-CB 3.68Å; Y251-E283 HydrophobicContact CD2-CG 4.36Å; Y251-E283 HydrophobicContact CE2-CB 3.71Å; Y251-E283 HydrophobicContact CE2-CG 4.04Å
252N95Very high92.8Very high1 Ų141.5 Ų41.51%0.00521%0.211CC..Hα-helixtrans-61.5-38.9179.2-77.7-85.7000112.3I198 V199 L203 W248 A249 L256I198-N252 PolarHBondContact O-OD1 3.31Å; V199-N252 HydrophobicContact CG2-CB 4.42Å; L203-N252 HydrophobicContact CB-CB 4.23Å; L203-N252 HydrophobicContact CD2-CB 3.96Å; W248-N252 PolarHBondContact O-N 3.07Å; W248-N252 VanDerWaalsContact O-N 3.09Å; W248-N252 PolarHBondContact O-ND2 3.29Å; A249-N252 PolarHBondContact O-N 3.11Å; N252-L256 PolarHBondContact O-N 3.14Å; N252-L256 VanDerWaalsContact O-N 3.1Å
253I94.9Very high92.5Very high92 Ų9246.9 Ų46.947%0.47223%0.233SC..Hα-helixtrans-66.8-47.2176.7-66.6163.8000110.3A249 P250 Y251 L255 L256 L257A249-I253 WeakPolarHBondContact O-CD1 3.46Å; A249-I253 VanDerWaalsContact O-CG1 3.25Å; A249-I253 WeakPolarHBondContact O-CG1 3.22Å; A249-I253 PolarHBondContact O-N 2.67Å; P250-I253 PolarHBondContact O-N 3.08Å; Y251-I253 VanDerWaalsContact C-N 3.31Å; Y251-I253 PolarHBondContact O-N 2.95Å; I253-L255 VanDerWaalsContact C-N 3.34Å; I253-L255 PolarHBondContact O-N 2.97Å; I253-L256 WeakPolarHBondContact O-CB 3.46Å; I253-L256 PolarHBondContact O-N 3.45Å; I253-L257 HydrophobicContact CG2-CD1 4.19Å; I253-L257 WeakPolarHBondContact O-CG 3.16Å; I253-L257 PolarHBondContact O-N 2.69Å
254V94.6Very high92Very high17 Ų1750.6 Ų50.610%0.10325%0.247CC..Hα-helixtrans-65.3-38.1179175.50000111.4P250 Y251 L256 L257 N258 L275 A278 M279 T282P250-V254 VanDerWaalsContact O-CG2 3.3Å; P250-V254 WeakPolarHBondContact O-CG2 3.48Å; P250-V254 PolarHBondContact O-N 3.09Å; Y251-V254 PolarHBondContact O-N 2.9Å; V254-L256 VanDerWaalsContact C-N 3.32Å; V254-L256 PolarHBondContact O-N 3.04Å; V254-L257 PolarHBondContact O-N 3.41Å; V254-N258 VanDerWaalsContact O-CB 3.29Å; V254-N258 WeakPolarHBondContact O-CB 3.47Å; V254-N258 PolarHBondContact O-N 3.28Å; V254-L275 HydrophobicContact CG1-CD2 4.04Å; V254-A278 HydrophobicContact CG1-CB 4.04Å; V254-A278 HydrophobicContact CG2-CB 4.17Å; V254-M279 HydrophobicContact CG1-CB 3.9Å; V254-T282 HydrophobicContact CG2-CG2 4.08Å
255L93.4Very high91.3Very high17 Ų1752.6 Ų52.69%0.08927%0.27CS..Hα-helixtrans-61.5-40.4175.1-177.966.3000111.9T195 I198 Y251 I253 N258 T259T195-L255 HydrophobicContact CG2-CD2 4.4Å; T195-L255 HydrophobicContact CG2-CG 4.03Å; I198-L255 HydrophobicContact CB-CD2 4.04Å; I198-L255 HydrophobicContact CD1-CD2 3.97Å; I198-L255 HydrophobicContact CG2-CD2 3.8Å; Y251-L255 HydrophobicContact CE1-CD2 4.2Å; Y251-L255 VanDerWaalsContact O-CB 3.26Å; Y251-L255 WeakPolarHBondContact O-CB 3.18Å; Y251-L255 PolarHBondContact O-N 3.05Å; I253-L255 VanDerWaalsContact C-N 3.34Å; I253-L255 PolarHBondContact O-N 2.97Å; L255-N258 PolarHBondContact O-N 3.04Å; L255-T259 WeakPolarHBondContact O-CB 3.49Å; L255-T259 PolarHBondContact O-N 3.46Å; L255-T259 PolarHBondContact O-OG1 3.08Å
256L93.8Very high90.7Very high54 Ų5453.6 Ų53.628%0.28328%0.276SS..Hα-helixtrans-63.3-49.3174.4-168.977.3000110.8T195 V199 N252 I253 V254 N258 T259 F260T195-L256 HydrophobicContact CG2-CD1 4.35Å; V199-L256 HydrophobicContact CG2-CB 4.5Å; V199-L256 HydrophobicContact CG2-CD1 4.39Å; N252-L256 PolarHBondContact O-N 3.14Å; N252-L256 VanDerWaalsContact O-N 3.1Å; I253-L256 WeakPolarHBondContact O-CB 3.46Å; I253-L256 PolarHBondContact O-N 3.45Å; V254-L256 VanDerWaalsContact C-N 3.32Å; V254-L256 PolarHBondContact O-N 3.04Å; L256-N258 VanDerWaalsContact C-N 3.3Å; L256-N258 PolarHBondContact O-N 3.27Å; L256-T259 PolarHBondContact O-N 2.84Å; L256-F260 HydrophobicContact CD1-CD2 3.77Å; L256-F260 HydrophobicContact CD1-CE2 3.62Å; L256-F260 HydrophobicContact CG-CD2 4.06Å; L256-F260 HydrophobicContact CG-CE2 4.42Å; L256-F260 WeakPolarHBondContact O-CD2 3.41Å; L256-F260 PolarHBondContact O-N 2.93Å
257L92.1Very high89.7Confident51 Ų5153.3 Ų53.327%0.26728%0.275SS..Hα-helixtrans-59.9-39.8177-69.8172.1000112I253 V254 T259 F260 Q261 F264 L275I253-L257 HydrophobicContact CG2-CD1 4.19Å; I253-L257 WeakPolarHBondContact O-CG 3.16Å; I253-L257 PolarHBondContact O-N 2.69Å; V254-L257 PolarHBondContact O-N 3.41Å; L257-T259 VanDerWaalsContact C-N 3.33Å; L257-T259 PolarHBondContact O-N 3.22Å; L257-F260 CarbonylContact O-C 3.57Å; L257-Q261 WeakPolarHBondContact O-CA 3.47Å; L257-Q261 VanDerWaalsContact O-CG 3.22Å; L257-Q261 WeakPolarHBondContact O-CG 3.44Å; L257-Q261 PolarHBondContact O-N 3.46Å; L257-Q261 VanDerWaalsContact O-N 3.16Å; L257-F264 HydrophobicContact CD2-CD1 4.49Å; L257-F264 HydrophobicContact CD2-CD2 3.76Å; L257-F264 HydrophobicContact CD2-CE2 3.87Å; L257-F264 HydrophobicContact CD2-CG 4.1Å; L257-F264 HydrophobicContact CD2-CZ 4.28Å; L257-L275 HydrophobicContact CB-CD2 3.9Å
258N89.5Confident89.1Confident26 Ų2656 Ų5614%0.13929%0.291CS..Hα-helixtrans-68.3-31.1178-170.553.3000112.9V254 L255 L256 Q261 L275V254-N258 VanDerWaalsContact O-CB 3.29Å; V254-N258 WeakPolarHBondContact O-CB 3.47Å; V254-N258 PolarHBondContact O-N 3.28Å; L255-N258 PolarHBondContact O-N 3.04Å; L256-N258 VanDerWaalsContact C-N 3.3Å; L256-N258 PolarHBondContact O-N 3.27Å; N258-Q261 WeakPolarHBondContact O-CG 3.49Å; N258-Q261 PolarHBondContact OD1-NE2 2.83Å; N258-L275 HydrophobicContact CB-CD2 3.79Å
259T89.3Confident88.3Confident8 Ų859 Ų595%0.04931%0.313CS..Hα-helixtrans-79.3-38.5179.4-58.80000111.8K191 N192 T195 L255 L256 L257K191-T259 HydrophobicContact CG-CG2 4.17Å; N192-T259 WeakPolarHBondContact OD1-CG2 3.4Å; T195-T259 WeakPolarHBondContact CB-OG1 3.38Å; T195-T259 HydrophobicContact CG2-CG2 4.15Å; T195-T259 WeakPolarHBondContact CG2-OG1 3.49Å; T195-T259 PolarHBondContact OG1-OG1 3.2Å; L255-T259 WeakPolarHBondContact O-CB 3.49Å; L255-T259 PolarHBondContact O-N 3.46Å; L255-T259 PolarHBondContact O-OG1 3.08Å; L256-T259 PolarHBondContact O-N 2.84Å; L257-T259 VanDerWaalsContact C-N 3.33Å; L257-T259 PolarHBondContact O-N 3.22Å
260F89.3Confident87.6Confident55 Ų5561.6 Ų61.624%0.24133%0.33CS..SBendtrans-105.935.2-176.5-61.2-71.2000112.5L196 L256 L257 E262 F263 F264L196-F260 HydrophobicContact CD2-CE2 4.41Å; L196-F260 HydrophobicContact CD2-CZ 4.44Å; L256-F260 HydrophobicContact CD1-CD2 3.77Å; L256-F260 HydrophobicContact CD1-CE2 3.62Å; L256-F260 HydrophobicContact CG-CD2 4.06Å; L256-F260 HydrophobicContact CG-CE2 4.42Å; L256-F260 WeakPolarHBondContact O-CD2 3.41Å; L256-F260 PolarHBondContact O-N 2.93Å; L257-F260 CarbonylContact O-C 3.57Å; F260-E262 VanDerWaalsContact C-N 3.28Å; F260-E262 PolarHBondContact O-N 3.24Å; F260-F263 HydrophobicContact CB-CB 4.23Å; F260-F263 WeakPolarHBondContact O-CB 3.31Å; F260-F263 PolarHBondContact O-N 3.07Å; F260-F263 VanDerWaalsContact O-N 3.1Å; F260-F264 HydrophobicContact CB-CD2 4.05Å; F260-F264 HydrophobicContact CB-CE2 3.91Å; F260-F264 WeakPolarHBondContact O-CD2 3.29Å; F260-F264 PolarHBondContact O-N 3.09Å; F260-F264 VanDerWaalsContact O-N 3.15Å
261Q85.8Confident87Confident31 Ų3161.1 Ų61.115%0.14533%0.327CS..THydrogen-bonded Turntrans-55.4-41.3-178.5-74.4175.3-26.500112.8L257 N258 F263 F264 G265 L266 L275L257-Q261 WeakPolarHBondContact O-CA 3.47Å; L257-Q261 VanDerWaalsContact O-CG 3.22Å; L257-Q261 WeakPolarHBondContact O-CG 3.44Å; L257-Q261 PolarHBondContact O-N 3.46Å; L257-Q261 VanDerWaalsContact O-N 3.16Å; N258-Q261 WeakPolarHBondContact O-CG 3.49Å; N258-Q261 PolarHBondContact OD1-NE2 2.83Å; Q261-F263 VanDerWaalsContact C-N 3.34Å; Q261-F263 PolarHBondContact O-N 2.9Å; Q261-F264 CarbonylContact O-C 3.5Å; Q261-F264 PolarHBondContact O-N 2.82Å; Q261-G265 PolarHBondContact O-N 3.11Å; Q261-L266 HydrophobicContact CB-CB 4.29Å; Q261-L266 HydrophobicContact CG-CB 4.4Å; Q261-L266 PolarHBondContact O-N 2.82Å; Q261-L275 HydrophobicContact CG-CD1 4.11Å
262E82.3Confident86.3Confident162 Ų16261 Ų6176%0.75733%0.33SS*.THydrogen-bonded Turntrans-62.1-42178.1-67.6177-17400111.9F260 F264 G265F260-E262 VanDerWaalsContact C-N 3.28Å; F260-E262 PolarHBondContact O-N 3.24Å; E262-F264 VanDerWaalsContact C-N 3.32Å; E262-F264 PolarHBondContact O-N 3.22Å; E262-G265 PolarHBondContact O-N 3.3Å
263F85.8Confident85.7Confident174 Ų17462.9 Ų62.976%0.76334%0.34SS*.THydrogen-bonded Turntrans-65.7-35.6178.9-175.3-95.9000112.3F260 Q261F260-F263 HydrophobicContact CB-CB 4.23Å; F260-F263 WeakPolarHBondContact O-CB 3.31Å; F260-F263 PolarHBondContact O-N 3.07Å; F260-F263 VanDerWaalsContact O-N 3.1Å; Q261-F263 VanDerWaalsContact C-N 3.34Å; Q261-F263 PolarHBondContact O-N 2.9Å
264F84.2Confident85.3Confident99 Ų9967 Ų6743%0.43435%0.35SS..THydrogen-bonded Turntrans-89.32.1178.2-67.2-66.4000114.1L257 F260 Q261 E262 L266L257-F264 HydrophobicContact CD2-CD1 4.49Å; L257-F264 HydrophobicContact CD2-CD2 3.76Å; L257-F264 HydrophobicContact CD2-CE2 3.87Å; L257-F264 HydrophobicContact CD2-CG 4.1Å; L257-F264 HydrophobicContact CD2-CZ 4.28Å; F260-F264 HydrophobicContact CB-CD2 4.05Å; F260-F264 HydrophobicContact CB-CE2 3.91Å; F260-F264 WeakPolarHBondContact O-CD2 3.29Å; F260-F264 PolarHBondContact O-N 3.09Å; F260-F264 VanDerWaalsContact O-N 3.15Å; Q261-F264 CarbonylContact O-C 3.5Å; Q261-F264 PolarHBondContact O-N 2.82Å; E262-F264 VanDerWaalsContact C-N 3.32Å; E262-F264 PolarHBondContact O-N 3.22Å; F264-L266 VanDerWaalsContact C-N 3.32Å; F264-L266 HydrophobicContact CB-CD1 3.93Å; F264-L266 HydrophobicContact CB-CG 4.02Å; F264-L266 PolarHBondContact O-N 2.92Å
265G79.8Confident84.9Confident48 Ų4866.9 Ų66.950%0.49535%0.349SS..THydrogen-bonded Turntrans66.729.4-177.700000114.2Q261 E262Q261-G265 PolarHBondContact O-N 3.11Å; E262-G265 PolarHBondContact O-N 3.3Å
266L80Confident84.4Confident47 Ų4767.3 Ų67.325%0.24635%0.351CS..  trans-10317.9-176.9-61.7175.1000113.4Q261 F264 N268 S271 L275Q261-L266 HydrophobicContact CB-CB 4.29Å; Q261-L266 HydrophobicContact CG-CB 4.4Å; Q261-L266 PolarHBondContact O-N 2.82Å; F264-L266 VanDerWaalsContact C-N 3.32Å; F264-L266 HydrophobicContact CB-CD1 3.93Å; F264-L266 HydrophobicContact CB-CG 4.02Å; F264-L266 PolarHBondContact O-N 2.92Å; L266-N268 PolarHBondContact O-N 2.82Å; L266-S271 WeakPolarHBondContact O-CB 3.35Å; L266-L275 HydrophobicContact CB-CD1 3.97Å; L266-L275 HydrophobicContact CD1-CD1 3.65Å; L266-L275 HydrophobicContact CG-CD1 4.37Å
267N75.8Confident83.9Confident107 Ų10768.7 Ų68.757%0.57236%0.356SS*.  trans-75.9-0.6-175.962.9-24.6000115
268N82.3Confident83.8Confident94 Ų9468 Ų6850%0.50336%0.358SS..SBendtrans-73.5142.1175.2-63.4-18.9000111.1L266 S270 S271 S272L266-N268 PolarHBondContact O-N 2.82Å; N268-S270 VanDerWaalsContact C-N 3.26Å; N268-S270 PolarHBondContact O-N 3.34Å; N268-S271 PolarHBondContact O-N 3.25Å; N268-S272 PolarHBondContact O-N 3.3Å
269C79.3Confident83.8Confident73 Ų7368.9 Ų68.949%0.49336%0.361SS..Hα-helixtrans-57.3-35.2-178.5166.10000113C20 N273C20-C269 HydrophobicContact CB-CB 4.1Å; C20-C269 WeakPolarHBondContact CB-SG 3.3Å; C20-C269 WeakPolarHBondContact SG-CB 3.07Å; C20-C269 CovalentContact SG-SG 2.07Å; C20-C269 PolarHBondContact SG-SG 3.31Å; C269-N273 VanDerWaalsContact O-CB 3.29Å; C269-N273 WeakPolarHBondContact O-CB 3.45Å; C269-N273 PolarHBondContact O-N 3.36Å
270S81.4Confident83.8Confident72 Ų7271.5 Ų71.550%0.50337%0.373SS..Hα-helixtrans-65.5-40.7174.9610000112.9N268 R274N268-S270 VanDerWaalsContact C-N 3.26Å; N268-S270 PolarHBondContact O-N 3.34Å; S270-R274 WeakPolarHBondContact O-CG 3.32Å; S270-R274 PolarHBondContact O-N 3.02Å
271S82.6Confident83.8Confident30 Ų3073.7 Ų73.721%0.2139%0.391CS..Hα-helixtrans-70.2-45.3176.2-63.80000111.5L266 N268 N273 R274 L275L266-S271 WeakPolarHBondContact O-CB 3.35Å; N268-S271 PolarHBondContact O-N 3.25Å; S271-N273 VanDerWaalsContact C-N 3.33Å; S271-N273 PolarHBondContact O-N 2.8Å; S271-R274 PolarHBondContact O-N 2.89Å; S271-L275 WeakPolarHBondContact O-CB 3.35Å; S271-L275 PolarHBondContact O-N 3.22Å
272S81.4Confident84.2Confident24 Ų2473 Ų7317%0.16839%0.389CS..Hα-helixtrans-57.4-45.6175.1-1770000111.4N268 R274 L275 D276N268-S272 PolarHBondContact O-N 3.3Å; S272-R274 VanDerWaalsContact C-N 3.35Å; S272-R274 PolarHBondContact O-N 2.83Å; S272-L275 CarbonylContact O-C 3.58Å; S272-L275 WeakPolarHBondContact O-CA 3.28Å; S272-L275 VanDerWaalsContact O-CB 3.29Å; S272-L275 WeakPolarHBondContact O-CB 3.32Å; S272-L275 PolarHBondContact O-N 3.47Å; S272-D276 PolarHBondContact O-N 2.62Å
273N82.3Confident84.7Confident40 Ų4067.5 Ų67.521%0.21436%0.363CS..Hα-helixtrans-63.2-39.1-179.8-167.820.1000112.2C269 S271 L275 D276 Q277C269-N273 VanDerWaalsContact O-CB 3.29Å; C269-N273 WeakPolarHBondContact O-CB 3.45Å; C269-N273 PolarHBondContact O-N 3.36Å; S271-N273 VanDerWaalsContact C-N 3.33Å; S271-N273 PolarHBondContact O-N 2.8Å; N273-L275 VanDerWaalsContact C-N 3.31Å; N273-D276 PolarHBondContact O-N 2.68Å; N273-Q277 WeakPolarHBondContact O-CG 3.23Å; N273-Q277 PolarHBondContact O-N 3.44Å; N273-Q277 VanDerWaalsContact O-N 3.08Å
274R85.5Confident85Confident179 Ų17959.8 Ų59.868%0.67533%0.33SS*.Hα-helixtrans-64.8-37.5172.6-68179-153.8-159.35.1111.8S270 S271 S272 Q277 A278S270-R274 WeakPolarHBondContact O-CG 3.32Å; S270-R274 PolarHBondContact O-N 3.02Å; S271-R274 PolarHBondContact O-N 2.89Å; S272-R274 VanDerWaalsContact C-N 3.35Å; S272-R274 PolarHBondContact O-N 2.83Å; R274-Q277 PolarHBondContact O-N 3.44Å; R274-A278 WeakPolarHBondContact O-CB 3.02Å; R274-A278 PolarHBondContact O-N 3.13Å
275L85.9Confident85.5Confident14 Ų1458.1 Ų58.17%0.07333%0.326CS..Hα-helixtrans-65.9-41.6177.4-114.7147.3000112V254 L257 N258 Q261 L266 S271 S272 N273 A278 M279V254-L275 HydrophobicContact CG1-CD2 4.04Å; L257-L275 HydrophobicContact CB-CD2 3.9Å; N258-L275 HydrophobicContact CB-CD2 3.79Å; Q261-L275 HydrophobicContact CG-CD1 4.11Å; L266-L275 HydrophobicContact CB-CD1 3.97Å; L266-L275 HydrophobicContact CD1-CD1 3.65Å; L266-L275 HydrophobicContact CG-CD1 4.37Å; S271-L275 WeakPolarHBondContact O-CB 3.35Å; S271-L275 PolarHBondContact O-N 3.22Å; S272-L275 CarbonylContact O-C 3.58Å; S272-L275 WeakPolarHBondContact O-CA 3.28Å; S272-L275 VanDerWaalsContact O-CB 3.29Å; S272-L275 WeakPolarHBondContact O-CB 3.32Å; S272-L275 PolarHBondContact O-N 3.47Å; N273-L275 VanDerWaalsContact C-N 3.31Å; L275-A278 PolarHBondContact O-N 3.35Å; L275-M279 WeakPolarHBondContact O-CB 3.19Å; L275-M279 PolarHBondContact O-N 2.86Å
276D83.3Confident86.2Confident26 Ų2655.9 Ų55.914%0.13930%0.302CS..Hα-helixtrans-64-41.4174.4-66.6-62.6000112K22 S272 N273 M279 Q280K22-D276 HydrophobicContact CD-CB 4.41Å; K22-D276 WeakPolarHBondContact CE-OD2 3.41Å; K22-D276 IonicContact NZ-OD1 3.84Å; K22-D276 PolarHBondContact NZ-OD1 3.02Å; K22-D276 IonicContact NZ-OD2 3.57Å; K22-D276 PolarHBondContact NZ-OD2 3.21Å; S272-D276 PolarHBondContact O-N 2.62Å; N273-D276 PolarHBondContact O-N 2.68Å; D276-M279 WeakPolarHBondContact O-CB 3.29Å; D276-M279 PolarHBondContact O-N 3.45Å; D276-Q280 PolarHBondContact O-N 3.34Å
277Q84.8Confident86.7Confident82 Ų8253.9 Ų53.938%0.38329%0.292SS..Hα-helixtrans-60.8-47.5173.3-72173.414.500111.3V25 N273 R274 M279 Q280 V281V25-Q277 HydrophobicContact CB-CG 4.27Å; V25-Q277 HydrophobicContact CG1-CG 3.81Å; V25-Q277 HydrophobicContact CG2-CG 3.41Å; V25-Q277 VanDerWaalsContact CG2-CG 3.41Å; N273-Q277 WeakPolarHBondContact O-CG 3.23Å; N273-Q277 PolarHBondContact O-N 3.44Å; N273-Q277 VanDerWaalsContact O-N 3.08Å; R274-Q277 PolarHBondContact O-N 3.44Å; Q277-M279 VanDerWaalsContact C-N 3.27Å; Q277-M279 PolarHBondContact O-N 3.42Å; Q277-Q280 PolarHBondContact O-N 2.95Å; Q277-V281 WeakPolarHBondContact O-CG2 3.33Å; Q277-V281 PolarHBondContact O-N 3.21Å
278A89.6Confident87.6Confident37 Ų3749.9 Ų49.931%0.30627%0.271SS..Hα-helixtrans-60.5-39.5176.400000111.2V254 R274 L275 V281 T282V254-A278 HydrophobicContact CG1-CB 4.04Å; V254-A278 HydrophobicContact CG2-CB 4.17Å; R274-A278 WeakPolarHBondContact O-CB 3.02Å; R274-A278 PolarHBondContact O-N 3.13Å; L275-A278 PolarHBondContact O-N 3.35Å; A278-V281 PolarHBondContact O-N 3.26Å; A278-T282 VanDerWaalsContact O-CB 3.32Å; A278-T282 WeakPolarHBondContact O-CB 3.47Å; A278-T282 VanDerWaalsContact O-CG2 3.26Å; A278-T282 WeakPolarHBondContact O-CG2 3.44Å; A278-T282 PolarHBondContact O-N 2.81Å; A278-T282 PolarHBondContact O-OG1 2.92Å
279M89.8Confident88.1Confident44 Ų4445.8 Ų45.822%0.21725%0.249CC..Hα-helixtrans-63.3-47.8178.5-171.1169.365.200110.6Y251 V254 L275 D276 Q277 V281 T282 E283Y251-M279 HydrophobicContact CE2-CG 4.29Å; V254-M279 HydrophobicContact CG1-CB 3.9Å; L275-M279 WeakPolarHBondContact O-CB 3.19Å; L275-M279 PolarHBondContact O-N 2.86Å; D276-M279 WeakPolarHBondContact O-CB 3.29Å; D276-M279 PolarHBondContact O-N 3.45Å; Q277-M279 VanDerWaalsContact C-N 3.27Å; Q277-M279 PolarHBondContact O-N 3.42Å; M279-V281 PolarHBondContact O-N 2.95Å; M279-T282 PolarHBondContact O-N 3.07Å; M279-T282 PolarHBondContact O-OG1 3.41Å; M279-E283 WeakPolarHBondContact O-CB 3.45Å; M279-E283 PolarHBondContact O-N 3.02Å
280Q87.9Confident88.7Confident63 Ų6342.5 Ų42.529%0.29423%0.227SC..Hα-helixtrans-60.7-45.1177.6-17265.557.500112.3L33 D276 Q277 T284L33-Q280 HydrophobicContact CD1-CG 4.4Å; L33-Q280 VanDerWaalsContact CD1-NE2 3.3Å; D276-Q280 PolarHBondContact O-N 3.34Å; Q277-Q280 PolarHBondContact O-N 2.95Å; Q280-T284 VanDerWaalsContact O-CB 3.29Å; Q280-T284 WeakPolarHBondContact O-CB 3.28Å; Q280-T284 PolarHBondContact O-N 3.4Å; Q280-T284 PolarHBondContact O-OG1 3.45Å
281V90.7Very high89.2Confident101 Ų10139.7 Ų39.761%0.61221%0.207SC*.Hα-helixtrans-66.8-45.8-179.3171.70000111.1Q277 A278 M279 T284 L285Q277-V281 WeakPolarHBondContact O-CG2 3.33Å; Q277-V281 PolarHBondContact O-N 3.21Å; A278-V281 PolarHBondContact O-N 3.26Å; M279-V281 PolarHBondContact O-N 2.95Å; V281-T284 WeakPolarHBondContact O-CB 3.35Å; V281-T284 PolarHBondContact O-N 3.08Å; V281-L285 PolarHBondContact O-N 2.93Å
282T94.1Very high89.7Confident18 Ų1839.8 Ų39.811%0.1121%0.205CC..Hα-helixtrans-71.7-34.2-178.6550000112.6P250 V254 A278 M279 L285 G286P250-T282 HydrophobicContact CB-CG2 3.59Å; V254-T282 HydrophobicContact CG2-CG2 4.08Å; A278-T282 VanDerWaalsContact O-CB 3.32Å; A278-T282 WeakPolarHBondContact O-CB 3.47Å; A278-T282 VanDerWaalsContact O-CG2 3.26Å; A278-T282 WeakPolarHBondContact O-CG2 3.44Å; A278-T282 PolarHBondContact O-N 2.81Å; A278-T282 PolarHBondContact O-OG1 2.92Å; M279-T282 PolarHBondContact O-N 3.07Å; M279-T282 PolarHBondContact O-OG1 3.41Å; T282-L285 WeakPolarHBondContact O-CB 3.23Å; T282-L285 PolarHBondContact O-N 3.32Å; T282-G286 PolarHBondContact O-N 3.18Å
283E92.4Very high90.1Very high45 Ų4538.7 Ų38.721%0.2120%0.197CC..Hα-helixtrans-63.3-45170.8-177.1172.7-160.900111Y251 M279 L285 G286 M287Y251-E283 HydrophobicContact CD2-CB 3.68Å; Y251-E283 HydrophobicContact CD2-CG 4.36Å; Y251-E283 HydrophobicContact CE2-CB 3.71Å; Y251-E283 HydrophobicContact CE2-CG 4.04Å; M279-E283 WeakPolarHBondContact O-CB 3.45Å; M279-E283 PolarHBondContact O-N 3.02Å; E283-L285 VanDerWaalsContact C-N 3.32Å; E283-L285 PolarHBondContact O-N 3.42Å; E283-G286 CarbonylContact O-C 3.54Å; E283-G286 WeakPolarHBondContact O-CA 3.36Å; E283-G286 PolarHBondContact O-N 2.96Å; E283-G286 VanDerWaalsContact O-N 3.13Å; E283-M287 HydrophobicContact CG-CE 4.16Å; E283-M287 WeakPolarHBondContact O-CG 3.49Å; E283-M287 PolarHBondContact O-N 3.28Å
284T91.8Very high90.4Very high13 Ų1337.4 Ų37.48%0.0819%0.191CC..Hα-helixtrans-59.7-43.5176.2-60.90000111.3L33 L36 Y37 Q280 V281 M287 T288L33-T284 HydrophobicContact CD2-CG2 3.53Å; L33-T284 WeakPolarHBondContact CD2-OG1 3.41Å; L36-T284 HydrophobicContact CD2-CG2 3.47Å; L36-T284 VanDerWaalsContact CD2-CG2 3.47Å; Y37-T284 HydrophobicContact CE1-CG2 3.92Å; Y37-T284 PolarHBondContact OH-OG1 3.47Å; Q280-T284 VanDerWaalsContact O-CB 3.29Å; Q280-T284 WeakPolarHBondContact O-CB 3.28Å; Q280-T284 PolarHBondContact O-N 3.4Å; Q280-T284 PolarHBondContact O-OG1 3.45Å; V281-T284 WeakPolarHBondContact O-CB 3.35Å; V281-T284 PolarHBondContact O-N 3.08Å; T284-M287 PolarHBondContact O-N 3.28Å; T284-T288 VanDerWaalsContact O-CG2 3.28Å; T284-T288 WeakPolarHBondContact O-CG2 3.39Å; T284-T288 PolarHBondContact O-N 2.89Å; T284-T288 VanDerWaalsContact O-N 3.13Å
285L94.4Very high90.5Very high64 Ų6432.6 Ų32.634%0.33518%0.178SC..Hα-helixtrans-57.7-50.8172.5178.963.4000110.5F247 P250 V281 T282 E283 M287 T288F247-L285 HydrophobicContact CD1-CD1 3.84Å; F247-L285 HydrophobicContact CD1-CG 4.25Å; F247-L285 VanDerWaalsContact CD1-O 3.3Å; F247-L285 WeakPolarHBondContact CD1-O 3.2Å; F247-L285 HydrophobicContact CE1-CD1 3.95Å; F247-L285 HydrophobicContact CG-CD1 4.33Å; F247-L285 HydrophobicContact CG-CG 4.48Å; P250-L285 HydrophobicContact CG-CD2 4.26Å; V281-L285 PolarHBondContact O-N 2.93Å; T282-L285 WeakPolarHBondContact O-CB 3.23Å; T282-L285 PolarHBondContact O-N 3.32Å; E283-L285 VanDerWaalsContact C-N 3.32Å; E283-L285 PolarHBondContact O-N 3.42Å; L285-M287 VanDerWaalsContact C-N 3.3Å; L285-M287 PolarHBondContact O-N 2.92Å; L285-T288 PolarHBondContact O-N 2.86Å; L285-T288 VanDerWaalsContact O-N 3.08Å; L285-T288 PolarHBondContact O-OG1 3Å
286G94.1Very high90.6Very high0 Ų032.4 Ų32.40%018%0.176CC..Hα-helixtrans-54.8-43.3175.200000112.9W248 T282 E283 T288 H289W248-G286 VanDerWaalsContact CZ2-O 3.24Å; W248-G286 WeakPolarHBondContact CZ2-O 3.32Å; T282-G286 PolarHBondContact O-N 3.18Å; E283-G286 CarbonylContact O-C 3.54Å; E283-G286 WeakPolarHBondContact O-CA 3.36Å; E283-G286 PolarHBondContact O-N 2.96Å; E283-G286 VanDerWaalsContact O-N 3.13Å; G286-T288 VanDerWaalsContact C-N 3.28Å; G286-T288 PolarHBondContact O-N 3.25Å; G286-H289 WeakPolarHBondContact O-CB 3.34Å; G286-H289 PolarHBondContact O-N 3.49Å
287M91.5Very high90.6Very high6 Ų631.6 Ų31.63%0.0317%0.172CC..Hα-helixtrans-60.7-36177.3-72.5-167.5179.800112.7Y37 F79 W86 Y108 E283 T284 L285 H289 C290Y37-M287 HydrophobicContact CE1-CB 4.2Å; Y37-M287 HydrophobicContact CE1-SD 3.67Å; Y37-M287 HydrophobicContact CE2-SD 3.86Å; Y37-M287 PolarHBondContact OH-SD 3.3Å; F79-M287 HydrophobicContact CE1-CB 4.1Å; F79-M287 HydrophobicContact CE1-CG 4Å; F79-M287 HydrophobicContact CZ-CB 4.39Å; F79-M287 HydrophobicContact CZ-CG 3.9Å; W86-M287 HydrophobicContact CG-CE 4.38Å; Y108-M287 HydrophobicContact CE2-CE 3.85Å; E283-M287 HydrophobicContact CG-CE 4.16Å; E283-M287 WeakPolarHBondContact O-CG 3.49Å; E283-M287 PolarHBondContact O-N 3.28Å; T284-M287 PolarHBondContact O-N 3.28Å; L285-M287 VanDerWaalsContact C-N 3.3Å; L285-M287 PolarHBondContact O-N 2.92Å; M287-H289 PolarHBondContact O-N 3.31Å; M287-C290 PolarHBondContact O-SG 2.86Å
288T93.8Very high90.4Very high22 Ų2229.1 Ų29.114%0.13517%0.165CC..Hα-helixtrans-67.3-18.5177.968.90000113.4V40 F247 T284 L285 G286 C290 C291V40-T288 HydrophobicContact CG2-CG2 3.74Å; F247-T288 WeakPolarHBondContact CD1-OG1 3.46Å; F247-T288 VanDerWaalsContact CE1-OG1 3.23Å; F247-T288 WeakPolarHBondContact CE1-OG1 3.38Å; T284-T288 VanDerWaalsContact O-CG2 3.28Å; T284-T288 WeakPolarHBondContact O-CG2 3.39Å; T284-T288 PolarHBondContact O-N 2.89Å; T284-T288 VanDerWaalsContact O-N 3.13Å; L285-T288 PolarHBondContact O-N 2.86Å; L285-T288 VanDerWaalsContact O-N 3.08Å; L285-T288 PolarHBondContact O-OG1 3Å; G286-T288 VanDerWaalsContact C-N 3.28Å; G286-T288 PolarHBondContact O-N 3.25Å; T288-C290 PolarHBondContact O-N 3.3Å; T288-C291 PolarHBondContact O-N 3.07Å; T288-C291 PolarHBondContact O-SG 3.5Å
289H94.3Very high89.8Confident9 Ų935.2 Ų35.24%0.04219%0.185CC..G310 helixtrans-55.8-35.4-179.8176.5-95.9000113.4Y244 F247 W248 G286 M287 C291 I292Y244-H289 AromaticContact CD2-CE1 3.81Å; Y244-H289 AromaticContact CD2-NE2 3.88Å; F247-H289 HydrophobicContact CB-CB 3.93Å; F247-H289 HydrophobicContact CD1-CB 3.95Å; F247-H289 HydrophobicContact CG-CB 4.17Å; W248-H289 AromaticContact CD1-CG 3.87Å; W248-H289 AromaticContact NE1-CG 3.53Å; W248-H289 AromaticContact NE1-ND1 3.59Å; G286-H289 WeakPolarHBondContact O-CB 3.34Å; G286-H289 PolarHBondContact O-N 3.49Å; M287-H289 PolarHBondContact O-N 3.31Å; H289-C291 PolarHBondContact O-N 2.87Å; H289-C291 VanDerWaalsContact O-N 3.09Å; H289-I292 WeakPolarHBondContact O-CB 3.3Å; H289-I292 PolarHBondContact O-N 3.46Å
290C91.4Very high89.1Confident3 Ų334.7 Ų34.72%0.0218%0.184CC..G310 helixtrans-61.6-20.4-175.264.70000114.2N48 D76 F79 L80 M287 T288N48-C290 PolarHBondContact ND2-O 3.37Å; D76-C290 HydrophobicContact CB-CB 4.38Å; F79-C290 HydrophobicContact CD1-CB 4.02Å; L80-C290 WeakPolarHBondContact CD2-SG 3.44Å; L80-C290 HydrophobicContact CG-CB 4.23Å; M287-C290 PolarHBondContact O-SG 2.86Å; T288-C290 PolarHBondContact O-N 3.3Å
291C91.8Very high88.3Confident13 Ų1332.1 Ų32.19%0.08818%0.175CC..G310 helixtrans-95.5-7.5175.273.10000113.9V40 F43 G44 T288 H289V40-C291 HydrophobicContact CG1-CB 4.5Å; F43-C291 HydrophobicContact CB-CB 4.42Å; G44-C291 VanDerWaalsContact CA-CB 3.49Å; T288-C291 PolarHBondContact O-N 3.07Å; T288-C291 PolarHBondContact O-SG 3.5Å; H289-C291 PolarHBondContact O-N 2.87Å; H289-C291 VanDerWaalsContact O-N 3.09Å
292I92.8Very high87.5Confident33 Ų3330.7 Ų30.717%0.16916%0.161CC..Hα-helixtrans-82.3-30-175.5-53.6-60.2000112V243 F247 H289 I295 I296V243-I292 HydrophobicContact CG1-CB 4.49Å; V243-I292 HydrophobicContact CG1-CG2 3.71Å; F247-I292 HydrophobicContact CE1-CD1 4.23Å; F247-I292 HydrophobicContact CE1-CG1 3.8Å; F247-I292 HydrophobicContact CZ-CD1 4.13Å; F247-I292 HydrophobicContact CZ-CG1 3.86Å; H289-I292 WeakPolarHBondContact O-CB 3.3Å; H289-I292 PolarHBondContact O-N 3.46Å; I292-I295 HydrophobicContact CD1-CD1 4.25Å; I292-I295 WeakPolarHBondContact O-CA 3.11Å; I292-I295 VanDerWaalsContact O-CB 3.31Å; I292-I295 WeakPolarHBondContact O-CB 3.48Å; I292-I295 PolarHBondContact O-N 3.05Å; I292-I296 HydrophobicContact CG2-CD1 3.99Å; I292-I296 HydrophobicContact CG2-CG1 4.01Å; I292-I296 WeakPolarHBondContact O-CG1 3.4Å; I292-I296 PolarHBondContact O-N 3.15Å
293N89.4Confident86.5Confident0 Ų036.3 Ų36.30%018%0.184CC..Hα-helixtrans-55.2-50.9-179.6-76.1-29.3000113.4D76 I295 I296 Y297D76-N293 PolarHBondContact OD2-ND2 2.93Å; N293-I295 VanDerWaalsContact C-N 3.28Å; N293-I295 PolarHBondContact O-N 3.35Å; N293-I296 PolarHBondContact O-N 3.48Å; N293-Y297 HydrophobicContact CB-CE2 4.14Å; N293-Y297 WeakPolarHBondContact O-CD2 3.3Å; N293-Y297 WeakPolarHBondContact O-CE2 3.36Å; N293-Y297 VanDerWaalsContact O-CG 3.27Å; N293-Y297 PolarHBondContact O-N 3.4Å
294P88.9Confident85.5Confident13 Ų1335 Ų358%0.08418%0.178CC..Hα-helixtrans-57-38.1173.2-26.134.7000114.1G47 V51 Y297 A298G47-P294 VanDerWaalsContact C-CG 3.41Å; V51-P294 HydrophobicContact CG2-CB 4.11Å; V51-P294 HydrophobicContact CG2-CG 4.18Å; P294-Y297 PolarHBondContact O-N 2.82Å; P294-A298 PolarHBondContact O-N 2.92Å
295I88.7Confident84.9Confident78 Ų7840.4 Ų40.440%0.420%0.197SC..Hα-helixtrans-62.9-48177.5-62.3175.9000109.4I292 N293 Y297 A298 F299I292-I295 HydrophobicContact CD1-CD1 4.25Å; I292-I295 WeakPolarHBondContact O-CA 3.11Å; I292-I295 VanDerWaalsContact O-CB 3.31Å; I292-I295 WeakPolarHBondContact O-CB 3.48Å; I292-I295 PolarHBondContact O-N 3.05Å; N293-I295 VanDerWaalsContact C-N 3.28Å; N293-I295 PolarHBondContact O-N 3.35Å; I295-Y297 VanDerWaalsContact C-N 3.28Å; I295-Y297 PolarHBondContact O-N 3.4Å; I295-A298 PolarHBondContact O-N 3.27Å; I295-A298 VanDerWaalsContact O-N 3.14Å; I295-F299 HydrophobicContact CG2-CD2 3.62Å; I295-F299 HydrophobicContact CG2-CE2 3.75Å; I295-F299 VanDerWaalsContact O-CD2 3.22Å; I295-F299 WeakPolarHBondContact O-CD2 3.32Å; I295-F299 PolarHBondContact O-N 3.49Å
296I87.4Confident84.2Confident10 Ų1041.8 Ų41.85%0.05121%0.205CC..Hα-helixtrans-56.8-44.1175.5-63.7168.9000110.5L236 T239 I240 V243 I292 N293 A298 F299 V300L236-I296 HydrophobicContact CD1-CG2 3.89Å; T239-I296 HydrophobicContact CG2-CG2 4.06Å; I240-I296 HydrophobicContact CG1-CD1 4.31Å; I240-I296 HydrophobicContact CG1-CG2 3.89Å; V243-I296 HydrophobicContact CB-CD1 3.94Å; V243-I296 HydrophobicContact CG1-CD1 3.99Å; V243-I296 HydrophobicContact CG2-CD1 4Å; I292-I296 HydrophobicContact CG2-CD1 3.99Å; I292-I296 HydrophobicContact CG2-CG1 4.01Å; I292-I296 WeakPolarHBondContact O-CG1 3.4Å; I292-I296 PolarHBondContact O-N 3.15Å; N293-I296 PolarHBondContact O-N 3.48Å; I296-A298 VanDerWaalsContact C-N 3.35Å; I296-A298 PolarHBondContact O-N 2.81Å; I296-F299 PolarHBondContact O-N 3.43Å; I296-V300 HydrophobicContact CG2-CB 4.24Å; I296-V300 HydrophobicContact CG2-CG2 4.06Å; I296-V300 WeakPolarHBondContact O-CA 3.38Å; I296-V300 VanDerWaalsContact O-CB 3.25Å; I296-V300 WeakPolarHBondContact O-CB 3.37Å; I296-V300 PolarHBondContact O-N 3.17Å
297Y84.2Confident83.5Confident9 Ų945.9 Ų45.94%0.03522%0.221CC..Hα-helixtrans-64-38.8178.8-56-36.7000112.8V51 L69 L72 L236 I240 N293 P294 I295 G301V51-Y297 HydrophobicContact CG1-CD2 4.31Å; V51-Y297 HydrophobicContact CG1-CE2 4.21Å; V51-Y297 HydrophobicContact CG2-CD2 3.7Å; V51-Y297 HydrophobicContact CG2-CE2 4.16Å; L69-Y297 HydrophobicContact CD2-CE1 3.84Å; L69-Y297 WeakPolarHBondContact CD2-OH 3.44Å; L72-Y297 WeakPolarHBondContact CD2-OH 3.14Å; L236-Y297 HydrophobicContact CD1-CD1 4.26Å; I240-Y297 HydrophobicContact CD1-CE1 3.63Å; I240-Y297 HydrophobicContact CG1-CE1 4.39Å; N293-Y297 HydrophobicContact CB-CE2 4.14Å; N293-Y297 WeakPolarHBondContact O-CD2 3.3Å; N293-Y297 WeakPolarHBondContact O-CE2 3.36Å; N293-Y297 VanDerWaalsContact O-CG 3.27Å; N293-Y297 PolarHBondContact O-N 3.4Å; P294-Y297 PolarHBondContact O-N 2.82Å; I295-Y297 VanDerWaalsContact C-N 3.28Å; I295-Y297 PolarHBondContact O-N 3.4Å; Y297-G301 WeakPolarHBondContact O-CA 3.37Å; Y297-G301 PolarHBondContact O-N 2.75Å; Y297-G301 VanDerWaalsContact O-N 3.07Å
298A80.2Confident82.8Confident31 Ų3147.2 Ų47.226%0.25623%0.228SC..Hα-helixtrans-67.3-40.7178.800000112.9P294 I295 I296P294-A298 PolarHBondContact O-N 2.92Å; I295-A298 PolarHBondContact O-N 3.27Å; I295-A298 VanDerWaalsContact O-N 3.14Å; I296-A298 VanDerWaalsContact C-N 3.35Å; I296-A298 PolarHBondContact O-N 2.81Å
299F76.1Confident82.1Confident165 Ų16550.1 Ų50.172%0.72424%0.242SC*.Hα-helixtrans-90.2-39.9-175.6-72.1-73.1000113.8I295 I296I295-F299 HydrophobicContact CG2-CD2 3.62Å; I295-F299 HydrophobicContact CG2-CE2 3.75Å; I295-F299 VanDerWaalsContact O-CD2 3.22Å; I295-F299 WeakPolarHBondContact O-CD2 3.32Å; I295-F299 PolarHBondContact O-N 3.49Å; I296-F299 PolarHBondContact O-N 3.43Å
300V74.3Confident81.4Confident32 Ų3253.4 Ų53.419%0.19426%0.263CS..Hα-helixtrans-95.9-29-174.4-172.40000111.7L236 T239 I296 E302L236-V300 HydrophobicContact CB-CG1 4.36Å; L236-V300 HydrophobicContact CD1-CB 3.84Å; L236-V300 HydrophobicContact CD1-CG1 3.85Å; T239-V300 HydrophobicContact CG2-CG2 4.25Å; I296-V300 HydrophobicContact CG2-CB 4.24Å; I296-V300 HydrophobicContact CG2-CG2 4.06Å; I296-V300 WeakPolarHBondContact O-CA 3.38Å; I296-V300 VanDerWaalsContact O-CB 3.25Å; I296-V300 WeakPolarHBondContact O-CB 3.37Å; I296-V300 PolarHBondContact O-N 3.17Å; V300-E302 PolarHBondContact O-N 3.02Å
301G72.9Confident80.7Confident9 Ų954.7 Ų54.79%0.09327%0.268CS..  trans-90.586.9-175.700000113.9Y297 K303 F304 R305Y297-G301 WeakPolarHBondContact O-CA 3.37Å; Y297-G301 PolarHBondContact O-N 2.75Å; Y297-G301 VanDerWaalsContact O-N 3.07Å; G301-K303 VanDerWaalsContact C-N 3.25Å; G301-K303 PolarHBondContact O-N 2.97Å; G301-K303 VanDerWaalsContact O-N 3.13Å; G301-F304 WeakPolarHBondContact O-CB 3.23Å; G301-F304 PolarHBondContact O-N 2.91Å; G301-R305 PolarHBondContact O-N 3Å
302E73.6Confident80.2Confident71 Ų7157 Ų5733%0.33228%0.279SS..Hα-helixtrans-51.1-41.4178.1-69.2174.3-171.500113.8R232 V300 N306R232-E302 WeakPolarHBondContact CD-OE2 3.42Å; R232-E302 IonicContact CZ-OE1 3.17Å; R232-E302 IonicContact CZ-OE2 3.22Å; R232-E302 VanDerWaalsContact CZ-OE2 3.25Å; R232-E302 IonicContact NE-OE1 3.31Å; R232-E302 PolarHBondContact NE-OE1 3.36Å; R232-E302 IonicContact NE-OE2 3.85Å; R232-E302 IonicContact NH1-OE1 2.76Å; R232-E302 IonicContact NH1-OE2 2.62Å; R232-E302 PolarHBondContact NH1-OE2 3.43Å; V300-E302 PolarHBondContact O-N 3.02Å; E302-N306 PolarHBondContact O-N 3.45Å; E302-N306 VanDerWaalsContact O-N 3.1Å
303K71.7Confident79.5Confident136 Ų13661.4 Ų61.459%0.59130%0.299SS*.Hα-helixtrans-64.7-43.8176.9-69.6-173.6179.4-1770111.8G301 N306 Y307G301-K303 VanDerWaalsContact C-N 3.25Å; G301-K303 PolarHBondContact O-N 2.97Å; G301-K303 VanDerWaalsContact O-N 3.13Å; K303-N306 PolarHBondContact O-N 3.37Å; K303-Y307 HydrophobicContact CB-CE2 4.49Å; K303-Y307 WeakPolarHBondContact O-CD2 3.26Å; K303-Y307 PolarHBondContact O-N 2.91Å; K303-Y307 VanDerWaalsContact O-N 3.09Å
304F72.4Confident78.7Confident17 Ų1768.1 Ų68.18%0.07533%0.328CS..Hα-helixtrans-65.2-43.2-179.4-175.7-95000110.4V51 I54 G301 N306 Y307 L308V51-F304 HydrophobicContact CB-CE2 4.35Å; V51-F304 HydrophobicContact CB-CZ 4.39Å; V51-F304 HydrophobicContact CG1-CE2 4.45Å; V51-F304 HydrophobicContact CG2-CE2 3.94Å; V51-F304 HydrophobicContact CG2-CZ 3.62Å; I54-F304 HydrophobicContact CB-CE2 4.1Å; I54-F304 HydrophobicContact CD1-CD2 4.46Å; I54-F304 HydrophobicContact CD1-CE1 4.28Å; I54-F304 HydrophobicContact CD1-CE2 3.71Å; I54-F304 HydrophobicContact CD1-CZ 3.61Å; I54-F304 HydrophobicContact CG2-CD2 4.11Å; I54-F304 HydrophobicContact CG2-CE2 3.96Å; G301-F304 WeakPolarHBondContact O-CB 3.23Å; G301-F304 PolarHBondContact O-N 2.91Å; F304-N306 VanDerWaalsContact C-N 3.34Å; F304-N306 PolarHBondContact O-N 3.35Å; F304-Y307 PolarHBondContact O-N 3.43Å; F304-L308 HydrophobicContact CD1-CD1 4.45Å; F304-L308 HydrophobicContact CE1-CD1 3.76Å; F304-L308 HydrophobicContact CZ-CD1 4.43Å; F304-L308 WeakPolarHBondContact O-CB 3.37Å; F304-L308 PolarHBondContact O-N 3.4Å
305R78.8Confident77.8Confident128 Ų12871.9 Ų71.948%0.48334%0.344SS..Hα-helixtrans-56.3-44.7173.9-169.1177.169.5-174.13.5112.6G301 L308 L309G301-R305 PolarHBondContact O-N 3Å; R305-L308 PolarHBondContact O-N 2.07Å; R305-L309 WeakPolarHBondContact O-CG 3.32Å; R305-L309 PolarHBondContact O-N 2.96Å
306N80.2Confident76.6Confident93 Ų9371.9 Ų71.950%0.49734%0.344SS..Hα-helixtrans-64.3-41.8177.2-72.1-2.3000112.1E302 K303 F304 L308 L309 V310E302-N306 PolarHBondContact O-N 3.45Å; E302-N306 VanDerWaalsContact O-N 3.1Å; K303-N306 PolarHBondContact O-N 3.37Å; F304-N306 VanDerWaalsContact C-N 3.34Å; F304-N306 PolarHBondContact O-N 3.35Å; N306-L308 VanDerWaalsContact C-N 3.35Å; N306-L309 PolarHBondContact O-N 3.17Å; N306-V310 WeakPolarHBondContact O-CG2 3.41Å; N306-V310 PolarHBondContact O-N 3.1Å
307Y78.3Confident75.3Confident86 Ų8673.5 Ų73.534%0.33736%0.359SS..Hα-helixtrans-66.2-37.9175-72.5-61.7000112.6I54 C58 K59 K303 F304 V310 F311I54-Y307 HydrophobicContact CG2-CG 4.33Å; C58-Y307 HydrophobicContact CB-CD1 3.64Å; C58-Y307 HydrophobicContact CB-CE1 4.18Å; C58-Y307 HydrophobicContact CB-CG 4.17Å; K59-Y307 HydrophobicContact CD-CE2 4.3Å; K59-Y307 HydrophobicContact CG-CD2 4.05Å; K59-Y307 HydrophobicContact CG-CE2 3.72Å; K303-Y307 HydrophobicContact CB-CE2 4.49Å; K303-Y307 WeakPolarHBondContact O-CD2 3.26Å; K303-Y307 PolarHBondContact O-N 2.91Å; K303-Y307 VanDerWaalsContact O-N 3.09Å; F304-Y307 PolarHBondContact O-N 3.43Å; Y307-V310 PolarHBondContact O-N 3.08Å; Y307-F311 VanDerWaalsContact O-CB 3.24Å; Y307-F311 WeakPolarHBondContact O-CB 3.19Å; Y307-F311 PolarHBondContact O-N 3.09Å
308L78.2Confident73.8Confident34 Ų3480.4 Ų80.418%0.17839%0.389CS..Hα-helixtrans-62.2-46.4175.4-174.2143.1000110.3L50 I54 F304 R305 N306 V310 F311 L312L50-L308 HydrophobicContact CD2-CD1 3.57Å; L50-L308 HydrophobicContact CD2-CG 4.24Å; L50-L308 HydrophobicContact CG-CD1 4.48Å; I54-L308 HydrophobicContact CD1-CB 4Å; I54-L308 HydrophobicContact CD1-CD1 4.41Å; I54-L308 HydrophobicContact CD1-CG 4.43Å; F304-L308 HydrophobicContact CD1-CD1 4.45Å; F304-L308 HydrophobicContact CE1-CD1 3.76Å; F304-L308 HydrophobicContact CZ-CD1 4.43Å; F304-L308 WeakPolarHBondContact O-CB 3.37Å; F304-L308 PolarHBondContact O-N 3.4Å; R305-L308 PolarHBondContact O-N 2.07Å; N306-L308 VanDerWaalsContact C-N 3.35Å; L308-V310 PolarHBondContact O-N 3.24Å; L308-F311 PolarHBondContact O-N 2.88Å; L308-L312 HydrophobicContact CD2-CD1 3.5Å; L308-L312 HydrophobicContact CD2-CG 4.18Å; L308-L312 HydrophobicContact CG-CD1 4.37Å; L308-L312 WeakPolarHBondContact O-CB 3.25Å; L308-L312 WeakPolarHBondContact O-CG 3.15Å; L308-L312 PolarHBondContact O-N 2.84Å
309L79.3Confident72.4Confident82 Ų8288.6 Ų88.643%0.42941%0.414SS..Hα-helixtrans-59.2-46.9174.5-72.1171.5000112.5R305 N306 F311 L312 Q313R305-L309 WeakPolarHBondContact O-CG 3.32Å; R305-L309 PolarHBondContact O-N 2.96Å; N306-L309 PolarHBondContact O-N 3.17Å; L309-F311 VanDerWaalsContact C-N 3.32Å; L309-F311 PolarHBondContact O-N 2.91Å; L309-L312 PolarHBondContact O-N 3.25Å; L309-Q313 WeakPolarHBondContact O-CB 3.33Å; L309-Q313 VanDerWaalsContact O-CG 3.25Å; L309-Q313 WeakPolarHBondContact O-CG 3.29Å; L309-Q313 PolarHBondContact O-N 2.94Å
310V79.7Confident71.2Confident79 Ų7987.6 Ų87.648%0.47941%0.409SS..Hα-helixtrans-63-39.5176.9171.50000111.4N306 Y307 L308 Q313 K314N306-V310 WeakPolarHBondContact O-CG2 3.41Å; N306-V310 PolarHBondContact O-N 3.1Å; Y307-V310 PolarHBondContact O-N 3.08Å; L308-V310 PolarHBondContact O-N 3.24Å; V310-Q313 PolarHBondContact O-N 3.34Å; V310-K314 VanDerWaalsContact O-CB 3.25Å; V310-K314 WeakPolarHBondContact O-CB 3.17Å; V310-K314 PolarHBondContact O-N 2.79Å
311F77Confident69.8Low30 Ų3089.8 Ų89.813%0.13243%0.425CS..Hα-helixtrans-64.9-46.4177-178-93.5000111.5L50 L53 Y307 L308 L309 K314 H315L50-F311 HydrophobicContact CD1-CD1 3.69Å; L50-F311 HydrophobicContact CD1-CE1 3.58Å; L50-F311 HydrophobicContact CD1-CZ 4.36Å; L53-F311 HydrophobicContact CD1-CZ 4.31Å; Y307-F311 VanDerWaalsContact O-CB 3.24Å; Y307-F311 WeakPolarHBondContact O-CB 3.19Å; Y307-F311 PolarHBondContact O-N 3.09Å; L308-F311 PolarHBondContact O-N 2.88Å; L309-F311 VanDerWaalsContact C-N 3.32Å; L309-F311 PolarHBondContact O-N 2.91Å; F311-K314 PolarHBondContact O-N 2.74Å; F311-H315 AromaticContact CD2-CD2 3.62Å; F311-H315 AromaticContact CE2-CD2 3.52Å; F311-H315 AromaticContact CE2-NE2 3.96Å; F311-H315 WeakPolarHBondContact O-CB 3.45Å; F311-H315 PolarHBondContact O-N 2.95Å
312L79.9Confident68.4Low60 Ų6098.4 Ų98.431%0.31446%0.46SS..Hα-helixtrans-61.3-44.4175.3-65.4175.4000111.1L308 L309 K314 I316 A317L308-L312 HydrophobicContact CD2-CD1 3.5Å; L308-L312 HydrophobicContact CD2-CG 4.18Å; L308-L312 HydrophobicContact CG-CD1 4.37Å; L308-L312 WeakPolarHBondContact O-CB 3.25Å; L308-L312 WeakPolarHBondContact O-CG 3.15Å; L308-L312 PolarHBondContact O-N 2.84Å; L309-L312 PolarHBondContact O-N 3.25Å; L312-K314 PolarHBondContact O-N 3.28Å; L312-I316 HydrophobicContact CD2-CD1 3.32Å; L312-I316 HydrophobicContact CD2-CG1 4.06Å; L312-I316 CarbonylContact O-C 3.36Å; L312-I316 VanDerWaalsContact O-CA 3.28Å; L312-I316 WeakPolarHBondContact O-CA 3.21Å; L312-I316 VanDerWaalsContact O-CB 3.23Å; L312-I316 WeakPolarHBondContact O-CB 3.27Å; L312-I316 PolarHBondContact O-N 3.16Å; L312-A317 PolarHBondContact O-N 3.32Å
313Q77.8Confident67.1Low126 Ų126100.4 Ų100.459%0.58948%0.481SS*.Iπ-helixtrans-62-43.9176.2-73.7171.3-10.300111.9L309 V310 A317 K318L309-Q313 WeakPolarHBondContact O-CB 3.33Å; L309-Q313 VanDerWaalsContact O-CG 3.25Å; L309-Q313 WeakPolarHBondContact O-CG 3.29Å; L309-Q313 PolarHBondContact O-N 2.94Å; V310-Q313 PolarHBondContact O-N 3.34Å; Q313-A317 WeakPolarHBondContact O-CB 3.28Å; Q313-K318 PolarHBondContact O-N 3.4Å
314K72.8Confident65.5Low141 Ų14197.6 Ų97.661%0.61348%0.477SS*.Iπ-helixtrans-73.5-35.4-176.3-169.6177.4179.7-176.30113.6V310 F311 L312 K318V310-K314 VanDerWaalsContact O-CB 3.25Å; V310-K314 WeakPolarHBondContact O-CB 3.17Å; V310-K314 PolarHBondContact O-N 2.79Å; F311-K314 PolarHBondContact O-N 2.74Å; L312-K314 PolarHBondContact O-N 3.28Å; K314-K318 WeakPolarHBondContact O-CB 3.27Å
315H69.6Low63.6Low93 Ų93102.4 Ų102.443%0.43151%0.513SS..Iπ-helixtrans-109.7-34-172.2-71.6-78.6000114.4F311 R319F311-H315 AromaticContact CD2-CD2 3.62Å; F311-H315 AromaticContact CE2-CD2 3.52Å; F311-H315 AromaticContact CE2-NE2 3.96Å; F311-H315 WeakPolarHBondContact O-CB 3.45Å; F311-H315 PolarHBondContact O-N 2.95Å; H315-R319 WeakPolarHBondContact O-CB 3.37Å; H315-R319 WeakPolarHBondContact O-CG 3.48Å
316I65.2Low61.9Low78 Ų78103.5 Ų103.540%0.453%0.527SS..Iπ-helixtrans-92.5-53.7179.5-55.9-164.3000109.6L312 K318 R319 F320L312-I316 HydrophobicContact CD2-CD1 3.32Å; L312-I316 HydrophobicContact CD2-CG1 4.06Å; L312-I316 CarbonylContact O-C 3.36Å; L312-I316 VanDerWaalsContact O-CA 3.28Å; L312-I316 WeakPolarHBondContact O-CA 3.21Å; L312-I316 VanDerWaalsContact O-CB 3.23Å; L312-I316 WeakPolarHBondContact O-CB 3.27Å; L312-I316 PolarHBondContact O-N 3.16Å; I316-K318 VanDerWaalsContact C-N 3.3Å; I316-K318 PolarHBondContact O-N 3.43Å; I316-R319 PolarHBondContact O-N 3.22Å; I316-F320 HydrophobicContact CG2-CD2 3.52Å; I316-F320 HydrophobicContact CG2-CE2 3.73Å; I316-F320 WeakPolarHBondContact O-CD2 3.41Å; I316-F320 PolarHBondContact O-N 3.45Å
317A58.4Low59.9Low44 Ų44107.6 Ų107.636%0.36454%0.541SS..Iπ-helixtrans-64.8-33.6179.400000112.1L312 Q313 R319 C321L312-A317 PolarHBondContact O-N 3.32Å; Q313-A317 WeakPolarHBondContact O-CB 3.28Å; A317-R319 PolarHBondContact O-N 3.36Å; A317-C321 WeakPolarHBondContact O-CA 3.47Å; A317-C321 WeakPolarHBondContact O-CB 3.4Å; A317-C321 PolarHBondContact O-N 2.89Å; A317-C321 PolarHBondContact O-SG 3.48Å; A317-C321 VanDerWaalsContact O-SG 3.4Å
318K52.9Low58.1Low153 Ų153112.5 Ų112.567%0.66557%0.567SS**Hα-helixtrans-72.2-24.7173.8-150.4176-174.4178.90114.1Q313 K314 I316 K322Q313-K318 PolarHBondContact O-N 3.4Å; K314-K318 WeakPolarHBondContact O-CB 3.27Å; I316-K318 VanDerWaalsContact C-N 3.3Å; I316-K318 PolarHBondContact O-N 3.43Å; K318-K322 PolarHBondContact O-N 2.96Å
319R51.7Low56.2Low203 Ų203118.6 Ų118.677%0.76659%0.594SS**Hα-helixtrans-80.8-41.3171.9-93.4-177.4169-179.7-3.3111.6H315 I316 A317 K322H315-R319 WeakPolarHBondContact O-CB 3.37Å; H315-R319 WeakPolarHBondContact O-CG 3.48Å; I316-R319 PolarHBondContact O-N 3.22Å; A317-R319 PolarHBondContact O-N 3.36Å; R319-K322 WeakPolarHBondContact O-CB 3.39Å; R319-K322 PolarHBondContact O-N 3.37Å
320F50.4Low54.1Low145 Ų145123 Ų12364%0.63661%0.612SS**Hα-helixtrans-73.3-36.2176.3-83.7-85.5000112.6I316 K322 C323 C324I316-F320 HydrophobicContact CG2-CD2 3.52Å; I316-F320 HydrophobicContact CG2-CE2 3.73Å; I316-F320 WeakPolarHBondContact O-CD2 3.41Å; I316-F320 PolarHBondContact O-N 3.45Å; F320-K322 PolarHBondContact O-N 3.24Å; F320-C323 CarbonylContact O-C 3.54Å; F320-C323 WeakPolarHBondContact O-CA 3.32Å; F320-C323 PolarHBondContact O-N 3.2Å; F320-C324 PolarHBondContact O-N 3.34Å; F320-C324 VanDerWaalsContact O-N 3.09Å
321C45.8Very low51.9Low78 Ų78123.4 Ų123.453%0.52762%0.624SS.*THydrogen-bonded Turntrans-68.8-15.2169.5-77.50000113.5A317 C323A317-C321 WeakPolarHBondContact O-CA 3.47Å; A317-C321 WeakPolarHBondContact O-CB 3.4Å; A317-C321 PolarHBondContact O-N 2.89Å; A317-C321 PolarHBondContact O-SG 3.48Å; A317-C321 VanDerWaalsContact O-SG 3.4Å; C321-C323 VanDerWaalsContact C-N 3.33Å
322K43.7Very low50Low189 Ų189128.1 Ų128.182%0.82266%0.658SS**THydrogen-bonded Turntrans-76.6-21.3166.2-99.1-170.6174.4-168.10112.6K318 R319 F320K318-K322 PolarHBondContact O-N 2.96Å; R319-K322 WeakPolarHBondContact O-CB 3.39Å; R319-K322 PolarHBondContact O-N 3.37Å; F320-K322 PolarHBondContact O-N 3.24Å
323C44.5Very low47.8Very low113 Ų113134 Ų13476%0.76468%0.684SS**THydrogen-bonded Turntrans-94.8-8173.8-780000113.6F320 C321F320-C323 CarbonylContact O-C 3.54Å; F320-C323 WeakPolarHBondContact O-CA 3.32Å; F320-C323 PolarHBondContact O-N 3.2Å; C321-C323 VanDerWaalsContact C-N 3.33Å
324C38.3Very low46.1Very low78 Ų78140 Ų14053%0.52770%0.701SS.*  trans-117.896.7173.5-70.30000110.4F320 I326F320-C324 PolarHBondContact O-N 3.34Å; F320-C324 VanDerWaalsContact O-N 3.09Å; C324-I326 PolarHBondContact O-N 3.43Å
325S34.2Very low44.3Very low118 Ų118138 Ų13883%0.82571%0.711SS**THydrogen-bonded Turntrans-72.939.4171.561.90000113.2
326I43Very low42.7Very low151 Ų151138.4 Ų138.477%0.77472%0.724SS**THydrogen-bonded Turntrans-119.6-10.8-177.5-69.9-179.2000112.4C324C324-I326 PolarHBondContact O-N 3.43Å
327F36.6Very low41.7Very low179 Ų179140.3 Ų140.379%0.78574%0.744SS**  trans-119.743.1-179.8-117.4-84.2000113.4
328Q40.4Very low40.7Very low188 Ų188144.3 Ų144.388%0.87976%0.764SS**  trans-108.758.2170.8-156.4173.1-12.800110.5
329Q39.5Very low39.9Very low163 Ų163147.8 Ų147.876%0.76278%0.775SS**  trans-160.3119166.8-133.6163.6-1100104.2
330E33.9Very low39Very low173 Ų173144.3 Ų144.381%0.80878%0.776SS**  cis-142.9144.519.1-67.4167.6143.300108.4
331A34.7Very low38.2Very low88 Ų88148 Ų14873%0.72779%0.786SS**  trans-76.2135.9162.100000108.3E333A331-E333 PolarHBondContact O-N 3.3Å; A331-E333 VanDerWaalsContact O-N 3.13Å
332P36.3Very low37.5Very low129 Ų129149.5 Ų149.584%0.83880%0.797SS**  trans-70.2113167.4-5.120.8000107.5R334P332-R334 PolarHBondContact O-N 2.9Å
333E34.8Very low37.4Very low185 Ų185147 Ų14786%0.86480%0.798SS**  trans-54.9135.7168.3-72.2-174.6154.100109.8A331 A335A331-E333 PolarHBondContact O-N 3.3Å; A331-E333 VanDerWaalsContact O-N 3.13Å; E333-A335 PolarHBondContact O-N 3.05Å
334R41Very low36.9Very low251 Ų251144.8 Ų144.895%0.94780%0.795SS**  trans-62.297.3166.6-79.7175170.4167-4.2108.2P332 S336P332-R334 PolarHBondContact O-N 2.9Å; R334-S336 PolarHBondContact O-N 3.03Å
335A35.7Very low36.9Very low100 Ų100150.3 Ų150.383%0.82681%0.813SS**  trans-73.6108.1163.500000108.7E333E333-A335 PolarHBondContact O-N 3.05Å
336S35.7Very low36.9Very low100 Ų100153.3 Ų153.370%0.69981%0.813SS**  trans-50147.5167.7440000112.8R334 V338R334-S336 PolarHBondContact O-N 3.03Å; S336-V338 PolarHBondContact O-N 2.81Å
337S45Very low36.8Very low118 Ų118155.1 Ų155.183%0.82582%0.819SS**  trans-38.9124.6167.752.50000114.1
338V36.9Very low36.9Very low129 Ų129153.9 Ų153.978%0.78282%0.819SS**  trans-121.9115.8155.6178.10000107.6S336 T340S336-V338 PolarHBondContact O-N 2.81Å; V338-T340 PolarHBondContact O-N 3.22Å
339Y35.7Very low36.5Very low225 Ų225150.5 Ų150.588%0.88282%0.816SS**  trans-75.9106.7176.3-153.3-90.7000107.7R341Y339-R341 PolarHBondContact O-N 3.1Å
340T33Very low36.4Very low130 Ų130150 Ų15080%0.79882%0.824SS**  trans-86.4106.7173-36.90000108.7V338 S342V338-T340 PolarHBondContact O-N 3.22Å; T340-S342 PolarHBondContact O-N 3.34Å
341R33.2Very low36.8Very low222 Ų222145.2 Ų145.284%0.83882%0.82SS**  trans-69.8106171.5-171.6178.1-175.3168.50.2108.3Y339Y339-R341 PolarHBondContact O-N 3.1Å
342S32.5Very low37Very low110 Ų110152.9 Ų152.977%0.76985%0.848SS**  trans-80.8115.9167.5171.30000108.6T340 G344T340-S342 PolarHBondContact O-N 3.34Å; S342-G344 PolarHBondContact O-N 3.42Å
343T41.6Very low37Very low137 Ų137154.1 Ų154.184%0.8485%0.849SS**  trans-71.111015937.40000108
344G33.4Very low37.2Very low67 Ų67152.5 Ų152.569%0.69185%0.848SS**  trans-128.5117.7167.200000107.7S342S342-G344 PolarHBondContact O-N 3.42Å
345E38.3Very low36.9Very low194 Ų194147 Ų14791%0.90784%0.842SS**  trans-55.1142.1177.7-67156.5140.500111.9
346Q34.8Very low37Very low180 Ų180149.8 Ų149.884%0.84184%0.843SS**  trans-150.199155.1-113.9172.1-6.700109
347E39.9Very low37.1Very low190 Ų190152.9 Ų152.989%0.88885%0.852SS**  trans-64.7123.4155.5-71.5-178.6144.800108.8
348I38.1Very low36.6Very low152 Ų152155.2 Ų155.278%0.77985%0.854SS**  trans-139.9120.9151.4-61.9-174.3000108.4
349S33.5Very low36.5Very low118 Ų118157.1 Ų157.183%0.82586%0.859SS**  trans-60144.3-176.8-47.30000115
350V36.4Very low36.6Very low153 Ų153151.8 Ų151.893%0.92786%0.857SS**  trans-116.4129.9160.8178.10000108.5
351G43.3Very low36.9Very low71 Ų71153.7 Ų153.773%0.73286%0.862SS**  trans166117.2169.800000107.1
352L38Very low37.3Very low250 Ų250147.5 Ų147.5100%1.30986%0.864SS**  cis-131.3018.7-115.896.4000110.9

Retrieved 352 of 352 residues in 427.1 ms (Link to these results)

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