A0A077ZI22_TRITR Loading...

Innexin

Structural component of the gap junctions.

AlphaFold DB , UniProt , Accession A0A077ZI22, Species TRITR (Trichuris trichiura, Whipworm), Gene inx, Length 261 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
1M50.5Low62.2Low241 Ų241124.3 Ų124.3100%1.18769%0.686SS**  0-14.20-87.7175.2177.600114.3C3M1-C3 PolarHBondContact O-N 3.39Å
2A52.8Low63.4Low87 Ų87125.1 Ų125.172%0.71967%0.672SS**THydrogen-bonded Turntrans-86.712.4-177.400000116.4
3C55.8Low64.3Low129 Ų129118.8 Ų118.887%0.87264%0.635SS**THydrogen-bonded Turntrans-12931.1-176.2-62.30000113.1M1 A5M1-C3 PolarHBondContact O-N 3.39Å; C3-A5 PolarHBondContact O-N 3.46Å
4D58.9Low65.3Low94 Ų94116.5 Ų116.550%0.50362%0.62SS.*  trans-78.3114175.7-158.6-9.5000109.9R6 L7D4-R6 PolarHBondContact O-N 2.82Å; D4-R6 WeakPolarHBondContact OD1-CG 3.44Å; D4-R6 IonicContact OD1-NE 3.83Å; D4-L7 PolarHBondContact O-N 3.05Å; D4-L7 VanDerWaalsContact O-N 3.14Å
5A64.2Low66.5Low79 Ų79119 Ų11965%0.65362%0.618SS**G310 helixtrans-59.4-18-178.800000113C3 L7 M8C3-A5 PolarHBondContact O-N 3.46Å; A5-L7 PolarHBondContact O-N 3.23Å; A5-M8 WeakPolarHBondContact O-CB 3.49Å; A5-M8 PolarHBondContact O-N 3.36Å
6R59.5Low67.3Low186 Ų186114.8 Ų114.870%0.70260%0.599SS**G310 helixtrans-64-20.3176.4-60.8178-163.4-169.13.8113.7D4 M8 D9D4-R6 PolarHBondContact O-N 2.82Å; D4-R6 WeakPolarHBondContact OD1-CG 3.44Å; D4-R6 IonicContact OD1-NE 3.83Å; R6-M8 PolarHBondContact O-N 3.35Å; R6-D9 PolarHBondContact O-N 3.14Å
7L59.1Low68Low80 Ų80108.2 Ų108.242%0.41957%0.565SS.*G310 helixtrans-75.7-6.3178-139.278.1000113.6D4 A5 D9 I229D4-L7 PolarHBondContact O-N 3.05Å; D4-L7 VanDerWaalsContact O-N 3.14Å; A5-L7 PolarHBondContact O-N 3.23Å; L7-D9 VanDerWaalsContact C-N 3.3Å; L7-I229 HydrophobicContact CD2-CD1 3.51Å
8M60.6Low68.9Low180 Ų180106.3 Ų106.389%0.88756%0.555SS**G310 helixtrans-72.1-24.1173.3-77.2-170.9164.200112.9A5 R6A5-M8 WeakPolarHBondContact O-CB 3.49Å; A5-M8 PolarHBondContact O-N 3.36Å; R6-M8 PolarHBondContact O-N 3.35Å
9D72.6Confident69.8Low84 Ų84104.2 Ų104.245%0.44955%0.547SS..SBendtrans-81.5121.9-178.8-159.4-2.9000110.2R6 L7 E11 Y12 K13R6-D9 PolarHBondContact O-N 3.14Å; L7-D9 VanDerWaalsContact C-N 3.3Å; D9-E11 VanDerWaalsContact C-N 3.27Å; D9-E11 PolarHBondContact O-N 3.03Å; D9-Y12 HydrophobicContact CB-CD2 3.79Å; D9-Y12 PolarHBondContact O-N 3.09Å; D9-Y12 WeakPolarHBondContact OD2-CD2 3.43Å; D9-K13 PolarHBondContact O-N 3.43Å
10S73.1Confident70.3Confident80 Ų80103.2 Ų103.256%0.55954%0.54SS*.Hα-helixtrans-61.2-36.7-168-167.10000112K13 M14S10-K13 PolarHBondContact O-N 2.98Å; S10-M14 WeakPolarHBondContact O-CB 3.38Å; S10-M14 PolarHBondContact O-N 3.08Å
11E76.8Confident70.8Confident127 Ų12798.3 Ų98.359%0.59352%0.515SS*.Hα-helixtrans-67.7-42.7178.3-67-161.2112.200112.4D9 M14 R15D9-E11 VanDerWaalsContact C-N 3.27Å; D9-E11 PolarHBondContact O-N 3.03Å; E11-M14 PolarHBondContact O-N 3.46Å; E11-R15 WeakPolarHBondContact O-CG 3.46Å; E11-R15 PolarHBondContact O-N 3.17Å
12Y77.4Confident72.3Confident134 Ų13492.3 Ų92.353%0.52548%0.484SS..Hα-helixtrans-67-39.5177.4-77.3-88.8000111.6D9 T16D9-Y12 HydrophobicContact CB-CD2 3.79Å; D9-Y12 PolarHBondContact O-N 3.09Å; D9-Y12 WeakPolarHBondContact OD2-CD2 3.43Å; Y12-T16 WeakPolarHBondContact O-CB 3.38Å; Y12-T16 PolarHBondContact O-N 3.09Å; Y12-T16 PolarHBondContact O-OG1 3.03Å
13K75.1Confident73.8Confident44 Ų4493.7 Ų93.719%0.19148%0.476CS..Hα-helixtrans-58.5-50173.3-169.9-170.174.4174.30110.7D9 S10 T16 V17 I229D9-K13 PolarHBondContact O-N 3.43Å; S10-K13 PolarHBondContact O-N 2.98Å; K13-T16 PolarHBondContact O-N 3.41Å; K13-V17 WeakPolarHBondContact O-CG2 3.43Å; K13-V17 PolarHBondContact O-N 3.44Å; K13-I229 HydrophobicContact CD-CG1 4.33Å; K13-I229 HydrophobicContact CG-CG1 4.47Å
14M78.4Confident74.9Confident86 Ų8688.3 Ų88.342%0.42444%0.438SS..Hα-helixtrans-62.3-45.1-179.2-17168.888.400111.9S10 E11 T16 V17 L18S10-M14 WeakPolarHBondContact O-CB 3.38Å; S10-M14 PolarHBondContact O-N 3.08Å; E11-M14 PolarHBondContact O-N 3.46Å; M14-T16 VanDerWaalsContact C-N 3.32Å; M14-T16 PolarHBondContact O-N 3.43Å; M14-V17 PolarHBondContact O-N 3.11Å; M14-L18 HydrophobicContact CG-CD1 4.02Å; M14-L18 WeakPolarHBondContact O-CB 3.33Å; M14-L18 WeakPolarHBondContact O-CG 3.44Å; M14-L18 PolarHBondContact O-N 3.22Å
15R82.6Confident75.8Confident154 Ų15485.5 Ų85.558%0.58142%0.422SS*.Hα-helixtrans-61-40.8175.8-71.9-179.9-171.9-177.36.1112.3E11 L18 T19E11-R15 WeakPolarHBondContact O-CG 3.46Å; E11-R15 PolarHBondContact O-N 3.17Å; R15-L18 PolarHBondContact O-N 2.98Å; R15-T19 WeakPolarHBondContact O-CB 3.31Å; R15-T19 PolarHBondContact O-N 3.02Å; R15-T19 PolarHBondContact O-OG1 3.31Å
16T80.1Confident76.5Confident52 Ų5285.9 Ų85.932%0.31941%0.413SS..Hα-helixtrans-64.5-44.3177.3-55.80000110.9Y12 K13 M14 T19 M20Y12-T16 WeakPolarHBondContact O-CB 3.38Å; Y12-T16 PolarHBondContact O-N 3.09Å; Y12-T16 PolarHBondContact O-OG1 3.03Å; K13-T16 PolarHBondContact O-N 3.41Å; M14-T16 VanDerWaalsContact C-N 3.32Å; M14-T16 PolarHBondContact O-N 3.43Å; T16-T19 PolarHBondContact O-N 3.49Å; T16-M20 HydrophobicContact CG2-CE 3.6Å; T16-M20 HydrophobicContact CG2-SD 4.15Å; T16-M20 WeakPolarHBondContact O-CB 3.24Å; T16-M20 VanDerWaalsContact O-CG 3.23Å; T16-M20 WeakPolarHBondContact O-CG 3.37Å; T16-M20 PolarHBondContact O-N 3.12Å
17V78.8Confident77.1Confident3 Ų382.5 Ų82.52%0.01841%0.405CS..Hα-helixtrans-61.9-46.2176.3170.30000111.3K13 M14 M20 A21 I229 L233K13-V17 WeakPolarHBondContact O-CG2 3.43Å; K13-V17 PolarHBondContact O-N 3.44Å; M14-V17 PolarHBondContact O-N 3.11Å; V17-M20 PolarHBondContact O-N 3.49Å; V17-A21 WeakPolarHBondContact O-CB 3.06Å; V17-A21 PolarHBondContact O-N 3.36Å; V17-I229 HydrophobicContact CG2-CG2 3.87Å; V17-L233 HydrophobicContact CG1-CB 4Å; V17-L233 HydrophobicContact CG1-CD1 3.88Å
18L83.9Confident77.8Confident73 Ų7379 Ų7938%0.38239%0.386SS..Hα-helixtrans-62-44.4176.7-76.7163.1000112M14 R15 M20 A21 Q22 T236M14-L18 HydrophobicContact CG-CD1 4.02Å; M14-L18 WeakPolarHBondContact O-CB 3.33Å; M14-L18 WeakPolarHBondContact O-CG 3.44Å; M14-L18 PolarHBondContact O-N 3.22Å; R15-L18 PolarHBondContact O-N 2.98Å; L18-M20 VanDerWaalsContact C-N 3.31Å; L18-M20 PolarHBondContact O-N 2.97Å; L18-A21 PolarHBondContact O-N 3.2Å; L18-Q22 WeakPolarHBondContact O-CB 3.01Å; L18-Q22 WeakPolarHBondContact O-CG 3.48Å; L18-Q22 PolarHBondContact O-N 2.96Å; L18-T236 HydrophobicContact CD2-CG2 3.94Å
19T85.3Confident78.4Confident67 Ų6775.3 Ų75.341%0.41137%0.367SS..Hα-helixtrans-63.4-39.5177.2-52.10000111R15 T16 H23R15-T19 WeakPolarHBondContact O-CB 3.31Å; R15-T19 PolarHBondContact O-N 3.02Å; R15-T19 PolarHBondContact O-OG1 3.31Å; T16-T19 PolarHBondContact O-N 3.49Å; T19-H23 WeakPolarHBondContact O-CB 3.46Å; T19-H23 PolarHBondContact O-CD2 2.97Å; T19-H23 PolarHBondContact O-N 3.28Å
20M80.3Confident78.2Confident83 Ų8377.1 Ų77.141%0.40937%0.374SS..Hα-helixtrans-65.4-41.7174.2-73.9175.117800112T16 V17 L18 M24T16-M20 HydrophobicContact CG2-CE 3.6Å; T16-M20 HydrophobicContact CG2-SD 4.15Å; T16-M20 WeakPolarHBondContact O-CB 3.24Å; T16-M20 VanDerWaalsContact O-CG 3.23Å; T16-M20 WeakPolarHBondContact O-CG 3.37Å; T16-M20 PolarHBondContact O-N 3.12Å; V17-M20 PolarHBondContact O-N 3.49Å; L18-M20 VanDerWaalsContact C-N 3.31Å; L18-M20 PolarHBondContact O-N 2.97Å; M20-M24 WeakPolarHBondContact O-CB 3.07Å; M20-M24 WeakPolarHBondContact O-CG 3.18Å; M20-M24 PolarHBondContact O-N 3.42Å
21A80.6Confident77.8Confident2 Ų274.4 Ų74.42%0.01735%0.353CS..Hα-helixtrans-62.6-49.4177.300000111.1V17 L18 H23 M24 E25 L233 L237V17-A21 WeakPolarHBondContact O-CB 3.06Å; V17-A21 PolarHBondContact O-N 3.36Å; L18-A21 PolarHBondContact O-N 3.2Å; A21-H23 PolarHBondContact O-N 3.24Å; A21-M24 WeakPolarHBondContact O-CB 3.37Å; A21-M24 PolarHBondContact O-N 2.9Å; A21-M24 VanDerWaalsContact O-N 3.08Å; A21-E25 WeakPolarHBondContact O-CG 3.47Å; A21-E25 PolarHBondContact O-N 3.17Å; A21-L233 HydrophobicContact CB-CD1 3.71Å; A21-L237 HydrophobicContact CB-CD2 4.09Å
22Q83.5Confident77.2Confident114 Ų11472.4 Ų72.453%0.53334%0.342SS..Hα-helixtrans-58.6-46.5177.5-72.8178.4-37.300111.7L18 M24 E25 D26L18-Q22 WeakPolarHBondContact O-CB 3.01Å; L18-Q22 WeakPolarHBondContact O-CG 3.48Å; L18-Q22 PolarHBondContact O-N 2.96Å; Q22-M24 VanDerWaalsContact C-N 3.31Å; Q22-M24 PolarHBondContact O-N 3.38Å; Q22-E25 PolarHBondContact O-N 2.81Å; Q22-D26 WeakPolarHBondContact O-CB 3.29Å; Q22-D26 VanDerWaalsContact O-CG 3.27Å; Q22-D26 PolarHBondContact O-N 3.45Å
23H82.5Confident76.7Confident117 Ų11772 Ų7254%0.54235%0.348SS..Hα-helixtrans-64.1-34.7175.7-77.2-45.4000113.3T19 A21 E27T19-H23 WeakPolarHBondContact O-CB 3.46Å; T19-H23 PolarHBondContact O-CD2 2.97Å; T19-H23 PolarHBondContact O-N 3.28Å; A21-H23 PolarHBondContact O-N 3.24Å; H23-E27 WeakPolarHBondContact O-CB 3.37Å; H23-E27 WeakPolarHBondContact O-CG 3.34Å; H23-E27 PolarHBondContact O-N 3.44Å
24M78.8Confident75.7Confident16 Ų1672.1 Ų72.18%0.07935%0.354CS..Hα-helixtrans-66.8-44.2174.3-77174.9160.700111.6M20 A21 Q22 E27 F28 I217 I221 L233M20-M24 WeakPolarHBondContact O-CB 3.07Å; M20-M24 WeakPolarHBondContact O-CG 3.18Å; M20-M24 PolarHBondContact O-N 3.42Å; A21-M24 WeakPolarHBondContact O-CB 3.37Å; A21-M24 PolarHBondContact O-N 2.9Å; A21-M24 VanDerWaalsContact O-N 3.08Å; Q22-M24 VanDerWaalsContact C-N 3.31Å; Q22-M24 PolarHBondContact O-N 3.38Å; M24-E27 PolarHBondContact O-N 3.13Å; M24-F28 HydrophobicContact CB-CE2 3.83Å; M24-F28 HydrophobicContact CB-CZ 4.1Å; M24-F28 WeakPolarHBondContact O-CD2 3.45Å; M24-F28 WeakPolarHBondContact O-CE2 3.49Å; M24-F28 WeakPolarHBondContact O-CG 3.39Å; M24-F28 PolarHBondContact O-N 3.25Å; M24-I217 HydrophobicContact CE-CB 3.62Å; M24-I217 HydrophobicContact CE-CD1 4.34Å; M24-I217 HydrophobicContact CE-CG2 3.07Å; M24-I221 HydrophobicContact CE-CD1 3.61Å; M24-L233 HydrophobicContact CE-CD2 4.29Å; M24-L233 HydrophobicContact SD-CD2 4.13Å
25E78.2Confident74.6Confident34 Ų3470.3 Ų70.316%0.15935%0.35CS..Hα-helixtrans-61.3-50.1178.3-74.5165.7-176.900111.1A21 Q22 E27 F28 E29 F209 L237A21-E25 WeakPolarHBondContact O-CG 3.47Å; A21-E25 PolarHBondContact O-N 3.17Å; Q22-E25 PolarHBondContact O-N 2.81Å; E25-E27 VanDerWaalsContact C-N 3.28Å; E25-E27 PolarHBondContact O-N 3.06Å; E25-F28 CarbonylContact O-C 3.59Å; E25-F28 PolarHBondContact O-N 3Å; E25-E29 WeakPolarHBondContact O-CG 3.37Å; E25-E29 PolarHBondContact O-N 3.34Å; E25-F209 HydrophobicContact CG-CZ 3.92Å; E25-L237 HydrophobicContact CG-CD2 4.07Å; E25-L237 WeakPolarHBondContact OE1-CD2 3.48Å
26D78.8Confident73Confident88 Ų8868.3 Ų68.347%0.47136%0.358SS..Hα-helixtrans-54.3-44.8176.7-71.8-21.2000111.5Q22 E29 M30Q22-D26 WeakPolarHBondContact O-CB 3.29Å; Q22-D26 VanDerWaalsContact O-CG 3.27Å; Q22-D26 PolarHBondContact O-N 3.45Å; D26-E29 PolarHBondContact O-N 3.44Å; D26-M30 VanDerWaalsContact O-CG 3.24Å; D26-M30 WeakPolarHBondContact O-CG 3.38Å; D26-M30 PolarHBondContact O-N 3.23Å
27E73.2Confident71.7Confident115 Ų11572 Ų7254%0.53738%0.376SS..Hα-helixtrans-66.1-37.2177.7-72.2-72.4150.300112H23 M24 E25 Q31H23-E27 WeakPolarHBondContact O-CB 3.37Å; H23-E27 WeakPolarHBondContact O-CG 3.34Å; H23-E27 PolarHBondContact O-N 3.44Å; M24-E27 PolarHBondContact O-N 3.13Å; E25-E27 VanDerWaalsContact C-N 3.28Å; E25-E27 PolarHBondContact O-N 3.06Å; E27-Q31 VanDerWaalsContact O-CG 3.27Å; E27-Q31 WeakPolarHBondContact O-CG 3.33Å; E27-Q31 PolarHBondContact O-N 2.67Å
28F73.4Confident70.3Confident6 Ų678.5 Ų78.53%0.02640%0.404CS..Hα-helixtrans-71.6-36.8176.5-59.2-31.8000112.4M24 E25 Q31 K32 L210M24-F28 HydrophobicContact CB-CE2 3.83Å; M24-F28 HydrophobicContact CB-CZ 4.1Å; M24-F28 WeakPolarHBondContact O-CD2 3.45Å; M24-F28 WeakPolarHBondContact O-CE2 3.49Å; M24-F28 WeakPolarHBondContact O-CG 3.39Å; M24-F28 PolarHBondContact O-N 3.25Å; E25-F28 CarbonylContact O-C 3.59Å; E25-F28 PolarHBondContact O-N 3Å; F28-Q31 WeakPolarHBondContact O-CB 3.48Å; F28-Q31 PolarHBondContact O-N 3.18Å; F28-K32 PolarHBondContact O-N 3.24Å; F28-K32 VanDerWaalsContact O-N 3.08Å; F28-L210 HydrophobicContact CE2-CD1 4.03Å; F28-L210 HydrophobicContact CZ-CD1 4.35Å
29E72.1Confident68.7Low103 Ų10378.5 Ų78.548%0.48142%0.422SS..Hα-helixtrans-64.2-42.9174.7-69.5-158.2148.400111.7E25 D26 Q31 K32 L33E25-E29 WeakPolarHBondContact O-CG 3.37Å; E25-E29 PolarHBondContact O-N 3.34Å; D26-E29 PolarHBondContact O-N 3.44Å; E29-Q31 PolarHBondContact O-N 3.31Å; E29-K32 WeakPolarHBondContact O-CB 3.47Å; E29-K32 PolarHBondContact O-N 3.06Å; E29-K32 VanDerWaalsContact O-N 3.11Å; E29-L33 PolarHBondContact O-N 3.08Å; E29-L33 VanDerWaalsContact O-N 3.12Å
30M68.3Low66.8Low122 Ų12286.1 Ų86.160%0.60144%0.443SS*.Hα-helixtrans-59.6-35.9173.8-70.5-67.9174.900112.1D26 L33 C34D26-M30 VanDerWaalsContact O-CG 3.24Å; D26-M30 WeakPolarHBondContact O-CG 3.38Å; D26-M30 PolarHBondContact O-N 3.23Å; M30-L33 HydrophobicContact SD-CD1 4.4Å; M30-C34 PolarHBondContact O-N 2.85Å; M30-C34 PolarHBondContact O-SG 3.36Å; M30-C34 VanDerWaalsContact O-SG 3.34Å
31Q65.1Low64.9Low23 Ų2385.6 Ų85.611%0.10746%0.459CS..Hα-helixtrans-69.3-34.8175.5-71.6176.417.600113.3E27 F28 E29 S35E27-Q31 VanDerWaalsContact O-CG 3.27Å; E27-Q31 WeakPolarHBondContact O-CG 3.33Å; E27-Q31 PolarHBondContact O-N 2.67Å; F28-Q31 WeakPolarHBondContact O-CB 3.48Å; F28-Q31 PolarHBondContact O-N 3.18Å; E29-Q31 PolarHBondContact O-N 3.31Å; Q31-S35 PolarHBondContact O-N 3.37Å; Q31-S35 PolarHBondContact O-OG 2.75Å; Q31-S35 VanDerWaalsContact O-OG 3.06Å
32K65.5Low63Low85 Ų8595.5 Ų95.537%0.3750%0.502SS..Hα-helixtrans-65.4-46.9175.4-75.4-179.9-179.6174.80111.5F28 E29 C34 S35 C36 D208F28-K32 PolarHBondContact O-N 3.24Å; F28-K32 VanDerWaalsContact O-N 3.08Å; E29-K32 WeakPolarHBondContact O-CB 3.47Å; E29-K32 PolarHBondContact O-N 3.06Å; E29-K32 VanDerWaalsContact O-N 3.11Å; K32-C34 PolarHBondContact O-N 3.42Å; K32-S35 PolarHBondContact O-N 3.31Å; K32-C36 PolarHBondContact O-N 2.83Å; K32-D208 WeakPolarHBondContact CE-O 3.36Å; K32-D208 PolarHBondContact NZ-O 3.11Å
33L65.3Low60.9Low125 Ų12598.5 Ų98.565%0.65452%0.516SS*.Hα-helixtrans-54.3-41.5178.7-76.3164.9000112E29 M30E29-L33 PolarHBondContact O-N 3.08Å; E29-L33 VanDerWaalsContact O-N 3.12Å; M30-L33 HydrophobicContact SD-CD1 4.4Å
34C55.6Low59Low47 Ų4797.9 Ų97.932%0.31852%0.524SS..Hα-helixtrans-79.5-16.9-179.3-61.60000114.2M30 K32 H53M30-C34 PolarHBondContact O-N 2.85Å; M30-C34 PolarHBondContact O-SG 3.36Å; M30-C34 VanDerWaalsContact O-SG 3.34Å; K32-C34 PolarHBondContact O-N 3.42Å; C34-H53 HydrophobicContact CB-CB 4.28Å; C34-H53 WeakPolarHBondContact CB-CE1 3.41Å; C34-H53 VanDerWaalsContact CB-CG 3.45Å; C34-H53 WeakPolarHBondContact CB-ND1 3.21Å; C34-H53 PolarHBondContact SG-CE1 2.7Å; C34-H53 PolarHBondContact SG-NE2 2.91Å; C34-H53 VanDerWaalsContact SG-NE2 3.44Å
35S53.8Low57.2Low48 Ų48102.3 Ų102.334%0.33655%0.551SS.*Hα-helixtrans-74.9-27.7174.5-64.60000112.2Q31 K32 D37Q31-S35 PolarHBondContact O-N 3.37Å; Q31-S35 PolarHBondContact O-OG 2.75Å; Q31-S35 VanDerWaalsContact O-OG 3.06Å; K32-S35 PolarHBondContact O-N 3.31Å; S35-D37 PolarHBondContact O-N 3.39Å
36C50.4Low55.3Low111 Ų111107 Ų10775%0.7558%0.578SS**G310 helixtrans-73.9-19.6179.8-70.40000114.4K32 K38K32-C36 PolarHBondContact O-N 2.83Å; C36-K38 PolarHBondContact O-N 3.23Å
37D51.9Low53.6Low130 Ų130113.6 Ų113.670%0.69560%0.597SS**G310 helixtrans-77.5-7.3-178.1-159.329.6000113.6S35 G39S35-D37 PolarHBondContact O-N 3.39Å; D37-G39 PolarHBondContact O-N 3.01Å
38K49.8Very low52.1Low139 Ų139119.7 Ų119.760%0.60462%0.615SS**G310 helixtrans-69.71.7178.5-71.7-176.5-177.71670114.9C36 H53C36-K38 PolarHBondContact O-N 3.23Å; K38-H53 WeakPolarHBondContact CE-O 3.36Å; K38-H53 PolarHBondContact NZ-O 3.29Å
39G49.5Very low50.5Low73 Ų73122.9 Ų122.975%0.75364%0.638SS**G310 helixtrans-83-5.4178.300000115.8D37D37-G39 PolarHBondContact O-N 3.01Å
40R46.2Very low49Very low227 Ų227128 Ų12886%0.85766%0.659SS**SBendtrans-131.4103.5-178-78-179.1173.6172-1.2113
41G41.1Very low48Very low72 Ų72127.6 Ų127.674%0.74266%0.655SS**  trans63.687.5138.100000119.4Q43G41-Q43 PolarHBondContact O-N 2.98Å
42F39.9Very low47.1Very low210 Ų210136.2 Ų136.292%0.92169%0.687SS**  4657.6117.8-137.3-91.9000119.5
43Q40.3Very low46.2Very low178 Ų178135.2 Ų135.283%0.83268%0.683SS**  trans-158.453.1153.7-145.7166.37.700115.1G41G41-Q43 PolarHBondContact O-N 2.98Å
44C41Very low45.7Very low104 Ų104133.1 Ų133.170%0.70368%0.678SS**  trans-107.662.9162-75.80000110.1C49C44-C49 HydrophobicContact CB-CB 3.88Å; C44-C49 WeakPolarHBondContact CB-SG 3.41Å
45V41.7Very low45.9Very low108 Ų108131.3 Ų131.366%0.65567%0.667SS**  trans-93.2124.8175172.50000108.4
46N38.2Very low46.9Very low134 Ų134130.7 Ų130.772%0.71766%0.663SS**SBendtrans90.798.7167-60-20.6000118.1W48N46-W48 PolarHBondContact O-N 2.91Å
47Y43Very low48.3Very low226 Ų226129.8 Ų129.889%0.88665%0.645SS**SBendtrans72.4-17.1150.4-97.2-94000120.7
48W42.5Very low49.8Very low242 Ų242126.4 Ų126.492%0.91763%0.626SS**SBendtrans-115.513.1-177.3-98.849.6000115.4N46N46-W48 PolarHBondContact O-N 2.91Å
49C40.2Very low51.5Low73 Ų73120.4 Ų120.449%0.49360%0.601SS.*  trans-105.44.8-177.3-147.20000114.8C44 H51C44-C49 HydrophobicContact CB-CB 3.88Å; C44-C49 WeakPolarHBondContact CB-SG 3.41Å; C49-H51 PolarHBondContact O-N 3.29Å
50F40.3Very low53.2Low212 Ų212119.3 Ų119.393%0.9359%0.585SS**THydrogen-bonded Turntrans-77.6-5178.2-122.3-88.6000113.9
51H46.2Very low55.2Low113 Ų113111.5 Ų111.552%0.52356%0.56SS.*THydrogen-bonded Turntrans-119.12.8-160.1-151.1-148.8000115.7C49 Y57C49-H51 PolarHBondContact O-N 3.29Å; H51-Y57 AromaticContact CD2-CE2 3.4Å; H51-Y57 VanDerWaalsContact CD2-CE2 3.4Å; H51-Y57 WeakPolarHBondContact CD2-CE2 3.45Å; H51-Y57 AromaticContact CE1-CE2 3.46Å; H51-Y57 VanDerWaalsContact CE1-CE2 3.46Å; H51-Y57 WeakPolarHBondContact CE1-CE2 3.43Å; H51-Y57 AromaticContact CE1-CZ 3.76Å; H51-Y57 PolarHBondContact CE1-OH 3.38Å; H51-Y57 AromaticContact CG-CE2 3.71Å; H51-Y57 AromaticContact ND1-CE2 3.75Å; H51-Y57 AromaticContact NE2-CE2 3.25Å; H51-Y57 WeakPolarHBondContact NE2-CE2 3.25Å; H51-Y57 AromaticContact NE2-CZ 3.82Å; H51-Y57 WeakPolarHBondContact O-CD2 3.11Å; H51-Y57 WeakPolarHBondContact O-CE2 3.03Å
52R47Very low57.5Low204 Ų204110 Ų11077%0.7753%0.532SS*.SBendtrans-151.183-159.2-161.4177.7165140-3116
53H46.8Very low59.9Low64 Ų64101.2 Ų101.230%0.29649%0.494SS..  trans124.375.8157.4-72.9-70.4000117.6C34 K38C34-H53 HydrophobicContact CB-CB 4.28Å; C34-H53 WeakPolarHBondContact CB-CE1 3.41Å; C34-H53 VanDerWaalsContact CB-CG 3.45Å; C34-H53 WeakPolarHBondContact CB-ND1 3.21Å; C34-H53 PolarHBondContact SG-CE1 2.7Å; C34-H53 PolarHBondContact SG-NE2 2.91Å; C34-H53 VanDerWaalsContact SG-NE2 3.44Å; K38-H53 WeakPolarHBondContact CE-O 3.36Å; K38-H53 PolarHBondContact NZ-O 3.29Å
54C53.8Low62.3Low80 Ų8096.3 Ų96.354%0.54148%0.477SS..SBendtrans-150.2138.6141.8-114.40000103.1S56C54-S56 PolarHBondContact O-N 2.91Å
55G60.7Low64.8Low9 Ų994.9 Ų94.99%0.09346%0.461CS..SBendtrans-60.960.5-169.300000116.2K212 D213G55-K212 PolarHBondContact O-N 3.27Å; G55-D213 VanDerWaalsContact C-CG 3.48Å; G55-D213 PolarHBondContact O-N 3.38Å; G55-D213 VanDerWaalsContact O-N 3.13Å
56S73.8Confident67.2Low36 Ų3691.7 Ų91.725%0.25244%0.438SS..  trans-15111.5-173.4-570000110.6C54 A60 K212 D213C54-S56 PolarHBondContact O-N 2.91Å; S56-A60 WeakPolarHBondContact O-CB 3.27Å; S56-A60 PolarHBondContact O-N 3.05Å; S56-K212 WeakPolarHBondContact OG-CD 3.29Å; S56-D213 VanDerWaalsContact CA-CG 3.41Å; S56-D213 WeakPolarHBondContact CA-OD1 3.46Å; S56-D213 WeakPolarHBondContact CA-OD2 3.35Å; S56-D213 PolarHBondContact N-OD2 2.96Å
57Y79.6Confident69.8Low92 Ų9288.6 Ų88.636%0.36142%0.422SS..Hα-helixtrans-68.2-49-175.8170.1-100000110.6H51 T59 A60 L61 D213H51-Y57 AromaticContact CD2-CE2 3.4Å; H51-Y57 VanDerWaalsContact CD2-CE2 3.4Å; H51-Y57 WeakPolarHBondContact CD2-CE2 3.45Å; H51-Y57 AromaticContact CE1-CE2 3.46Å; H51-Y57 VanDerWaalsContact CE1-CE2 3.46Å; H51-Y57 WeakPolarHBondContact CE1-CE2 3.43Å; H51-Y57 AromaticContact CE1-CZ 3.76Å; H51-Y57 PolarHBondContact CE1-OH 3.38Å; H51-Y57 AromaticContact CG-CE2 3.71Å; H51-Y57 AromaticContact ND1-CE2 3.75Å; H51-Y57 AromaticContact NE2-CE2 3.25Å; H51-Y57 WeakPolarHBondContact NE2-CE2 3.25Å; H51-Y57 AromaticContact NE2-CZ 3.82Å; H51-Y57 WeakPolarHBondContact O-CD2 3.11Å; H51-Y57 WeakPolarHBondContact O-CE2 3.03Å; Y57-T59 VanDerWaalsContact C-N 3.29Å; Y57-T59 PolarHBondContact O-N 3.21Å; Y57-A60 PolarHBondContact O-N 3.05Å; Y57-L61 HydrophobicContact CE1-CD1 4.02Å; Y57-L61 WeakPolarHBondContact O-CB 3.33Å; Y57-L61 PolarHBondContact O-N 3.26Å; Y57-D213 PolarHBondContact N-OD1 2.84Å; Y57-D213 PolarHBondContact N-OD2 3.42Å
58I84.2Confident72.3Confident59 Ų5983.2 Ų83.230%0.30341%0.407SS..Hα-helixtrans-63.5-43.2-178.6-58.8176.1000109.1L61 Y62 D213 F216 I217I58-L61 PolarHBondContact O-N 2.58Å; I58-Y62 WeakPolarHBondContact O-CB 3.46Å; I58-Y62 PolarHBondContact O-N 3.09Å; I58-D213 PolarHBondContact N-OD1 2.88Å; I58-D213 PolarHBondContact N-OD2 3.15Å; I58-F216 HydrophobicContact CG2-CD1 3.97Å; I58-F216 HydrophobicContact CG2-CE1 3.86Å; I58-I217 HydrophobicContact CD1-CD1 4.26Å
59T85.1Confident74.7Confident12 Ų1278.9 Ų78.97%0.07439%0.392CS..Hα-helixtrans-61.6-46.6176.5-53.50000111.6Y57 Y62 I63 L171 D213 F216Y57-T59 VanDerWaalsContact C-N 3.29Å; Y57-T59 PolarHBondContact O-N 3.21Å; T59-Y62 PolarHBondContact O-N 2.7Å; T59-I63 HydrophobicContact CG2-CD1 4.1Å; T59-I63 WeakPolarHBondContact O-CG1 3.46Å; T59-I63 PolarHBondContact O-N 3.04Å; T59-L171 HydrophobicContact CG2-CB 4.28Å; T59-L171 HydrophobicContact CG2-CD1 4.17Å; T59-L171 HydrophobicContact CG2-CD2 4.26Å; T59-L171 HydrophobicContact CG2-CG 4.46Å; T59-D213 VanDerWaalsContact CB-OD1 3.3Å; T59-D213 WeakPolarHBondContact CB-OD1 3.37Å; T59-D213 PolarHBondContact N-OD1 3.43Å; T59-D213 PolarHBondContact OG1-OD1 3.37Å; T59-F216 HydrophobicContact CG2-CB 4.41Å; T59-F216 HydrophobicContact CG2-CG 4.43Å; T59-F216 WeakPolarHBondContact OG1-CB 3.4Å
60A85.5Confident77.3Confident50 Ų5076.4 Ų76.441%0.41338%0.376SS..Hα-helixtrans-64.8-40.9179.300000112.1S56 Y57 I63 T64S56-A60 WeakPolarHBondContact O-CB 3.27Å; S56-A60 PolarHBondContact O-N 3.05Å; Y57-A60 PolarHBondContact O-N 3.05Å; A60-I63 PolarHBondContact O-N 3.35Å; A60-T64 WeakPolarHBondContact O-CB 3.06Å; A60-T64 PolarHBondContact O-N 2.72Å; A60-T64 PolarHBondContact O-OG1 3.47Å
61L89.1Confident79.9Confident64 Ų6470.9 Ų70.934%0.33536%0.359SS..Hα-helixtrans-61.8-45.2175.6-174154.4000110.6Y57 I58 T64 I65Y57-L61 HydrophobicContact CE1-CD1 4.02Å; Y57-L61 WeakPolarHBondContact O-CB 3.33Å; Y57-L61 PolarHBondContact O-N 3.26Å; I58-L61 PolarHBondContact O-N 2.58Å; L61-T64 PolarHBondContact O-N 2.8Å; L61-I65 HydrophobicContact CD2-CD1 3.42Å; L61-I65 VanDerWaalsContact CD2-CD1 3.42Å; L61-I65 HydrophobicContact CD2-CG1 4.2Å; L61-I65 HydrophobicContact CG-CD1 4.44Å; L61-I65 WeakPolarHBondContact O-CG1 3.48Å; L61-I65 PolarHBondContact O-N 3.22Å
62Y89.5Confident82.3Confident39 Ų3969.2 Ų69.215%0.15335%0.354CS..Hα-helixtrans-61.4-45.3176.6179.9-102.1000112.8I58 T59 T64 I65 K66 W167 L171 F216I58-Y62 WeakPolarHBondContact O-CB 3.46Å; I58-Y62 PolarHBondContact O-N 3.09Å; T59-Y62 PolarHBondContact O-N 2.7Å; Y62-T64 VanDerWaalsContact C-N 3.32Å; Y62-T64 PolarHBondContact O-N 2.91Å; Y62-I65 PolarHBondContact O-N 3.49Å; Y62-K66 HydrophobicContact CD1-CG 4.36Å; Y62-K66 HydrophobicContact CE1-CG 4.02Å; Y62-K66 VanDerWaalsContact CZ-CE 3.46Å; Y62-K66 WeakPolarHBondContact O-CG 3.11Å; Y62-K66 PolarHBondContact O-N 2.94Å; Y62-K66 WeakPolarHBondContact OH-CE 3.37Å; Y62-W167 HydrophobicContact CE1-CB 4.48Å; Y62-W167 HydrophobicContact CE1-CD2 4.25Å; Y62-W167 HydrophobicContact CE1-CE3 4.19Å; Y62-W167 HydrophobicContact CE1-CG 4.38Å; Y62-L171 HydrophobicContact CD1-CD1 4.07Å; Y62-L171 HydrophobicContact CE1-CD1 4.35Å; Y62-F216 AromaticContact CD1-CE2 3.46Å; Y62-F216 HydrophobicContact CD1-CE2 3.46Å; Y62-F216 VanDerWaalsContact CD1-CE2 3.46Å; Y62-F216 AromaticContact CD1-CZ 3.5Å; Y62-F216 HydrophobicContact CD1-CZ 3.5Å; Y62-F216 HydrophobicContact CD2-CE2 4.33Å; Y62-F216 AromaticContact CD2-CZ 3.63Å; Y62-F216 HydrophobicContact CD2-CZ 3.63Å; Y62-F216 AromaticContact CE1-CE2 3.75Å; Y62-F216 HydrophobicContact CE1-CE2 3.75Å; Y62-F216 HydrophobicContact CE1-CZ 4.03Å; Y62-F216 HydrophobicContact CE2-CZ 4.15Å; Y62-F216 HydrophobicContact CG-CE1 4.17Å; Y62-F216 AromaticContact CG-CE2 3.77Å; Y62-F216 HydrophobicContact CG-CE2 3.77Å; Y62-F216 AromaticContact CG-CZ 3.26Å; Y62-F216 HydrophobicContact CG-CZ 3.26Å
63I89.8Confident84.5Confident27 Ų2760.1 Ų60.114%0.13832%0.32CS..Hα-helixtrans-61.3-44176.2-69.4168.8000110.4T59 A60 I65 K66 L67 M168 L171T59-I63 HydrophobicContact CG2-CD1 4.1Å; T59-I63 WeakPolarHBondContact O-CG1 3.46Å; T59-I63 PolarHBondContact O-N 3.04Å; A60-I63 PolarHBondContact O-N 3.35Å; I63-I65 PolarHBondContact O-N 2.98Å; I63-K66 WeakPolarHBondContact O-CB 3.44Å; I63-K66 PolarHBondContact O-N 3.02Å; I63-L67 HydrophobicContact CG2-CD1 3.99Å; I63-L67 HydrophobicContact CG2-CG 4.37Å; I63-L67 WeakPolarHBondContact O-CG 3.44Å; I63-L67 PolarHBondContact O-N 3.1Å; I63-M168 HydrophobicContact CG2-CG 4.15Å; I63-M168 HydrophobicContact CG2-SD 3.51Å; I63-M168 VanDerWaalsContact CG2-SD 3.51Å; I63-L171 HydrophobicContact CD1-CB 4.31Å; I63-L171 HydrophobicContact CD1-CD1 4.12Å; I63-L171 HydrophobicContact CG1-CD1 3.9Å
64T90.9Very high86.7Confident75 Ų7560.7 Ų60.746%0.4632%0.324SS..Hα-helixtrans-59.8-48.8178.2-59.60000110.7A60 L61 Y62 K66 L67 L68A60-T64 WeakPolarHBondContact O-CB 3.06Å; A60-T64 PolarHBondContact O-N 2.72Å; A60-T64 PolarHBondContact O-OG1 3.47Å; L61-T64 PolarHBondContact O-N 2.8Å; Y62-T64 VanDerWaalsContact C-N 3.32Å; Y62-T64 PolarHBondContact O-N 2.91Å; T64-K66 VanDerWaalsContact C-N 3.34Å; T64-K66 PolarHBondContact O-N 3.25Å; T64-L67 WeakPolarHBondContact O-CB 3.21Å; T64-L67 PolarHBondContact O-N 3.46Å; T64-L68 HydrophobicContact CG2-CD1 3.65Å; T64-L68 WeakPolarHBondContact O-CD1 3.27Å; T64-L68 PolarHBondContact O-N 2.96Å
65I92.8Very high88.6Confident74 Ų7461.7 Ų61.738%0.37932%0.324SS..Hα-helixtrans-58.1-45175.9-71.1178000111.5L61 Y62 I63 L67 L68 Y69L61-I65 HydrophobicContact CD2-CD1 3.42Å; L61-I65 VanDerWaalsContact CD2-CD1 3.42Å; L61-I65 HydrophobicContact CD2-CG1 4.2Å; L61-I65 HydrophobicContact CG-CD1 4.44Å; L61-I65 WeakPolarHBondContact O-CG1 3.48Å; L61-I65 PolarHBondContact O-N 3.22Å; Y62-I65 PolarHBondContact O-N 3.49Å; I63-I65 PolarHBondContact O-N 2.98Å; I65-L67 VanDerWaalsContact C-N 3.34Å; I65-L67 PolarHBondContact O-N 2.86Å; I65-L68 PolarHBondContact O-N 3.34Å; I65-Y69 HydrophobicContact CG2-CD2 3.67Å; I65-Y69 HydrophobicContact CG2-CE2 3.36Å; I65-Y69 WeakPolarHBondContact O-CD2 3.49Å; I65-Y69 PolarHBondContact O-N 3.07Å
66K92.2Very high90.1Very high40 Ų4065.1 Ų65.117%0.17434%0.337CS..Hα-helixtrans-60.1-43.1176.7-78-76.5-173.2173.30112.2Y62 I63 T64 Y69 S70 N163 T164Y62-K66 HydrophobicContact CD1-CG 4.36Å; Y62-K66 HydrophobicContact CE1-CG 4.02Å; Y62-K66 VanDerWaalsContact CZ-CE 3.46Å; Y62-K66 WeakPolarHBondContact O-CG 3.11Å; Y62-K66 PolarHBondContact O-N 2.94Å; Y62-K66 WeakPolarHBondContact OH-CE 3.37Å; I63-K66 WeakPolarHBondContact O-CB 3.44Å; I63-K66 PolarHBondContact O-N 3.02Å; T64-K66 VanDerWaalsContact C-N 3.34Å; T64-K66 PolarHBondContact O-N 3.25Å; K66-Y69 PolarHBondContact O-N 3.23Å; K66-S70 PolarHBondContact O-N 3.01Å; K66-N163 PolarHBondContact NZ-OD1 3.48Å; K66-T164 HydrophobicContact CB-CG2 4.01Å
67L92.8Very high90.9Very high70 Ų7064.5 Ų64.537%0.36633%0.33SS..Hα-helixtrans-63.1-43.5174.4-70.5172.7000111.4I63 T64 I65 Y69 S70 V71 T164 M168I63-L67 HydrophobicContact CG2-CD1 3.99Å; I63-L67 HydrophobicContact CG2-CG 4.37Å; I63-L67 WeakPolarHBondContact O-CG 3.44Å; I63-L67 PolarHBondContact O-N 3.1Å; T64-L67 WeakPolarHBondContact O-CB 3.21Å; T64-L67 PolarHBondContact O-N 3.46Å; I65-L67 VanDerWaalsContact C-N 3.34Å; I65-L67 PolarHBondContact O-N 2.86Å; L67-Y69 VanDerWaalsContact C-N 3.32Å; L67-Y69 PolarHBondContact O-N 3.08Å; L67-S70 CarbonylContact O-C 3.59Å; L67-S70 WeakPolarHBondContact O-CB 3.38Å; L67-S70 PolarHBondContact O-N 2.96Å; L67-S70 VanDerWaalsContact O-N 3.11Å; L67-V71 WeakPolarHBondContact O-CG2 3.46Å; L67-V71 PolarHBondContact O-N 2.74Å; L67-T164 HydrophobicContact CD2-CG2 4.11Å; L67-M168 HydrophobicContact CD1-SD 4.37Å; L67-M168 HydrophobicContact CD2-CE 3.87Å; L67-M168 HydrophobicContact CD2-SD 4.22Å; L67-M168 HydrophobicContact CG-SD 4.43Å
68L95Very high91.4Very high112 Ų11265 Ų6559%0.58634%0.338SS*.Hα-helixtrans-58.8-42.5175.5-9277.5000111.8T64 I65 V71 N72T64-L68 HydrophobicContact CG2-CD1 3.65Å; T64-L68 WeakPolarHBondContact O-CD1 3.27Å; T64-L68 PolarHBondContact O-N 2.96Å; I65-L68 PolarHBondContact O-N 3.34Å; L68-V71 PolarHBondContact O-N 3.2Å; L68-N72 VanDerWaalsContact O-CB 3.28Å; L68-N72 WeakPolarHBondContact O-CB 3.23Å; L68-N72 PolarHBondContact O-N 2.89Å
69Y93.8Very high91.8Very high152 Ų15266.2 Ų66.260%0.59635%0.349SS*.Hα-helixtrans-63.9-40.7174.1-77.4-61.4000112.4I65 K66 L67 N72 I73I65-Y69 HydrophobicContact CG2-CD2 3.67Å; I65-Y69 HydrophobicContact CG2-CE2 3.36Å; I65-Y69 WeakPolarHBondContact O-CD2 3.49Å; I65-Y69 PolarHBondContact O-N 3.07Å; K66-Y69 PolarHBondContact O-N 3.23Å; L67-Y69 VanDerWaalsContact C-N 3.32Å; L67-Y69 PolarHBondContact O-N 3.08Å; Y69-N72 PolarHBondContact O-N 3.27Å; Y69-I73 PolarHBondContact O-N 2.96Å
70S93.6Very high92Very high21 Ų2166.4 Ų66.415%0.14735%0.349CS..Hα-helixtrans-64.6-38.9175.2-168.40000112.4K66 L67 I73 M74 V161K66-S70 PolarHBondContact O-N 3.01Å; L67-S70 CarbonylContact O-C 3.59Å; L67-S70 WeakPolarHBondContact O-CB 3.38Å; L67-S70 PolarHBondContact O-N 2.96Å; L67-S70 VanDerWaalsContact O-N 3.11Å; S70-I73 WeakPolarHBondContact O-CG2 3.44Å; S70-M74 VanDerWaalsContact O-CG 3.25Å; S70-M74 WeakPolarHBondContact O-CG 3.46Å; S70-M74 PolarHBondContact O-N 2.88Å; S70-V161 WeakPolarHBondContact OG-CG2 3.28Å
71V95.4Very high92.1Very high96 Ų9664.6 Ų64.658%0.58233%0.333SS*.Hα-helixtrans-68.3-40174.8171.20000110.3L67 L68 I73 M74 L75L67-V71 WeakPolarHBondContact O-CG2 3.46Å; L67-V71 PolarHBondContact O-N 2.74Å; L68-V71 PolarHBondContact O-N 3.2Å; V71-I73 PolarHBondContact O-N 3.22Å; V71-M74 PolarHBondContact O-N 2.89Å; V71-L75 WeakPolarHBondContact O-CB 3.45Å; V71-L75 PolarHBondContact O-N 2.84Å
72N96.2Very high92.1Very high78 Ų7869.1 Ų69.142%0.41735%0.352SS..Hα-helixtrans-61-46.2179-172.4-89.2000111.8L68 Y69 M74 L75 Q76L68-N72 VanDerWaalsContact O-CB 3.28Å; L68-N72 WeakPolarHBondContact O-CB 3.23Å; L68-N72 PolarHBondContact O-N 2.89Å; Y69-N72 PolarHBondContact O-N 3.27Å; N72-M74 PolarHBondContact O-N 3.46Å; N72-L75 PolarHBondContact O-N 2.97Å; N72-Q76 WeakPolarHBondContact O-CG 3.47Å; N72-Q76 PolarHBondContact O-N 2.92Å; N72-Q76 PolarHBondContact OD1-NE2 3.4Å
73I94.3Very high91.9Very high12 Ų1274.3 Ų74.36%0.06238%0.375CS..Hα-helixtrans-66.5-37.2177.7-169.662.9000112Y69 S70 V71 Q76 F77 F153 V156 T160Y69-I73 PolarHBondContact O-N 2.96Å; S70-I73 WeakPolarHBondContact O-CG2 3.44Å; V71-I73 PolarHBondContact O-N 3.22Å; I73-Q76 PolarHBondContact O-N 2.97Å; I73-F77 WeakPolarHBondContact O-CB 3.41Å; I73-F77 PolarHBondContact O-N 2.88Å; I73-F153 HydrophobicContact CD1-CD1 3.64Å; I73-F153 HydrophobicContact CD1-CE1 4.28Å; I73-V156 HydrophobicContact CD1-CG1 4.05Å; I73-V156 HydrophobicContact CG1-CG1 4.44Å; I73-T160 HydrophobicContact CG2-CG2 4.42Å
74M92.1Very high91.7Very high77 Ų7774.1 Ų74.138%0.37937%0.374SS..Hα-helixtrans-65.1-41.5173.8-69.6-63.599.300111.7S70 V71 N72 F77 L78S70-M74 VanDerWaalsContact O-CG 3.25Å; S70-M74 WeakPolarHBondContact O-CG 3.46Å; S70-M74 PolarHBondContact O-N 2.88Å; V71-M74 PolarHBondContact O-N 2.89Å; N72-M74 PolarHBondContact O-N 3.46Å; M74-F77 PolarHBondContact O-N 3.15Å; M74-L78 WeakPolarHBondContact O-CB 3.37Å; M74-L78 VanDerWaalsContact O-CG 3.28Å; M74-L78 WeakPolarHBondContact O-CG 3.42Å; M74-L78 PolarHBondContact O-N 2.74Å
75L93.3Very high90.9Very high101 Ų10173.7 Ų73.753%0.52939%0.385SS..Hα-helixtrans-63.7-45.2175.7-178.463.5000111.3V71 N72 F77 L78 V79V71-L75 WeakPolarHBondContact O-CB 3.45Å; V71-L75 PolarHBondContact O-N 2.84Å; N72-L75 PolarHBondContact O-N 2.97Å; L75-F77 VanDerWaalsContact C-N 3.31Å; L75-F77 PolarHBondContact O-N 3.26Å; L75-L78 PolarHBondContact O-N 3.41Å; L75-V79 HydrophobicContact CD1-CG2 4.3Å; L75-V79 HydrophobicContact CG-CG2 4.41Å; L75-V79 WeakPolarHBondContact O-CB 3.42Å; L75-V79 VanDerWaalsContact O-CG2 3.28Å; L75-V79 WeakPolarHBondContact O-CG2 3.45Å; L75-V79 PolarHBondContact O-N 3.27Å
76Q92.9Very high89.9Confident81 Ų8171.5 Ų71.538%0.37938%0.375SS..Hα-helixtrans-60.2-42.1175.7-72-178.715.800111.5N72 I73 V79 L80 F153N72-Q76 WeakPolarHBondContact O-CG 3.47Å; N72-Q76 PolarHBondContact O-N 2.92Å; N72-Q76 PolarHBondContact OD1-NE2 3.4Å; I73-Q76 PolarHBondContact O-N 2.97Å; Q76-V79 PolarHBondContact O-N 3.18Å; Q76-L80 WeakPolarHBondContact O-CB 3.33Å; Q76-L80 PolarHBondContact O-N 3.26Å; Q76-F153 HydrophobicContact CB-CE1 4.44Å; Q76-F153 VanDerWaalsContact OE1-CE1 3.22Å
77F91.6Very high88.8Confident22 Ų2279.6 Ų79.610%0.09641%0.41CS..Hα-helixtrans-63.9-41175.3-175.4-105.7000112.1I73 M74 L75 L80 N81 I89 W150 F153I73-F77 WeakPolarHBondContact O-CB 3.41Å; I73-F77 PolarHBondContact O-N 2.88Å; M74-F77 PolarHBondContact O-N 3.15Å; L75-F77 VanDerWaalsContact C-N 3.31Å; L75-F77 PolarHBondContact O-N 3.26Å; F77-L80 PolarHBondContact O-N 3.42Å; F77-N81 WeakPolarHBondContact CD1-ND2 3.25Å; F77-N81 VanDerWaalsContact CE1-ND2 3.26Å; F77-N81 WeakPolarHBondContact CE1-ND2 3.33Å; F77-N81 VanDerWaalsContact CZ-ND2 3.34Å; F77-N81 WeakPolarHBondContact CZ-ND2 3.12Å; F77-N81 PolarHBondContact O-N 2.88Å; F77-N81 PolarHBondContact O-ND2 3.22Å; F77-I89 HydrophobicContact CE1-CG2 3.92Å; F77-I89 HydrophobicContact CZ-CG2 4.43Å; F77-W150 AromaticContact CE2-CD1 3.95Å; F77-W150 HydrophobicContact CE2-CD2 4.39Å; F77-W150 AromaticContact CE2-CE2 3.86Å; F77-W150 HydrophobicContact CE2-CG 4.43Å; F77-W150 HydrophobicContact CE2-CZ2 4.33Å; F77-W150 AromaticContact CE2-NE1 3.58Å; F77-W150 AromaticContact CZ-CE2 3.92Å; F77-W150 HydrophobicContact CZ-CZ2 4.03Å; F77-W150 AromaticContact CZ-NE1 3.68Å; F77-F153 HydrophobicContact CD2-CB 4.2Å
78L89.8Confident88Confident102 Ų10281.4 Ų81.453%0.53442%0.42SS..Hα-helixtrans-67-42.1175.7-71.9173.9000112.4M74 L75 L80 N81 H82M74-L78 WeakPolarHBondContact O-CB 3.37Å; M74-L78 VanDerWaalsContact O-CG 3.28Å; M74-L78 WeakPolarHBondContact O-CG 3.42Å; M74-L78 PolarHBondContact O-N 2.74Å; L75-L78 PolarHBondContact O-N 3.41Å; L78-L80 VanDerWaalsContact C-N 3.31Å; L78-L80 PolarHBondContact O-N 2.99Å; L78-N81 PolarHBondContact O-N 3.37Å; L78-H82 WeakPolarHBondContact O-CB 3.3Å; L78-H82 PolarHBondContact O-N 3.44Å
79V91.5Very high87.1Confident86 Ų8681.3 Ų81.352%0.52142%0.419SS..Hα-helixtrans-61.8-41175.41700000110.5L75 Q76 H82 F83L75-V79 HydrophobicContact CD1-CG2 4.3Å; L75-V79 HydrophobicContact CG-CG2 4.41Å; L75-V79 WeakPolarHBondContact O-CB 3.42Å; L75-V79 VanDerWaalsContact O-CG2 3.28Å; L75-V79 WeakPolarHBondContact O-CG2 3.45Å; L75-V79 PolarHBondContact O-N 3.27Å; Q76-V79 PolarHBondContact O-N 3.18Å; V79-H82 PolarHBondContact O-N 3.13Å; V79-F83 WeakPolarHBondContact O-CB 3.4Å; V79-F83 PolarHBondContact O-N 3.47Å
80L90.2Very high86.5Confident16 Ų1679.5 Ų79.58%0.08442%0.418CS..Hα-helixtrans-59.7-54.4173.4179.970.5000111Q76 F77 L78 H82 F83 L84 F146 W150 F153Q76-L80 WeakPolarHBondContact O-CB 3.33Å; Q76-L80 PolarHBondContact O-N 3.26Å; F77-L80 PolarHBondContact O-N 3.42Å; L78-L80 VanDerWaalsContact C-N 3.31Å; L78-L80 PolarHBondContact O-N 2.99Å; L80-H82 PolarHBondContact O-N 3.5Å; L80-F83 PolarHBondContact O-N 3.43Å; L80-F83 VanDerWaalsContact O-N 3.11Å; L80-L84 HydrophobicContact CD1-CD1 3.49Å; L80-L84 VanDerWaalsContact CD1-CD1 3.49Å; L80-L84 HydrophobicContact CG-CD1 3.79Å; L80-L84 WeakPolarHBondContact O-CD1 3.29Å; L80-L84 PolarHBondContact O-N 2.86Å; L80-F146 HydrophobicContact CD1-CD1 3.93Å; L80-F146 HydrophobicContact CD1-CE1 4.4Å; L80-W150 HydrophobicContact CD2-CB 4.13Å; L80-W150 HydrophobicContact CD2-CG 4.47Å; L80-F153 HydrophobicContact CD2-CD2 3.88Å
81N88.2Confident85.9Confident12 Ų1278.8 Ų78.86%0.06441%0.412CS..Hα-helixtrans-59.4-34.4179-76.4-82.2000112F77 L78 I89 W150F77-N81 WeakPolarHBondContact CD1-ND2 3.25Å; F77-N81 VanDerWaalsContact CE1-ND2 3.26Å; F77-N81 WeakPolarHBondContact CE1-ND2 3.33Å; F77-N81 VanDerWaalsContact CZ-ND2 3.34Å; F77-N81 WeakPolarHBondContact CZ-ND2 3.12Å; F77-N81 PolarHBondContact O-N 2.88Å; F77-N81 PolarHBondContact O-ND2 3.22Å; L78-N81 PolarHBondContact O-N 3.37Å; N81-I89 PolarHBondContact OD1-O 2.92Å; N81-W150 PolarHBondContact OD1-NE1 2.87Å
82H87.5Confident85.4Confident159 Ų15974.2 Ų74.274%0.73638%0.384SS*.Hα-helixtrans-68.3-44.2174.8-176.131.6000112.5L78 V79 L80 L84 G85L78-H82 WeakPolarHBondContact O-CB 3.3Å; L78-H82 PolarHBondContact O-N 3.44Å; V79-H82 PolarHBondContact O-N 3.13Å; L80-H82 PolarHBondContact O-N 3.5Å; H82-L84 VanDerWaalsContact C-N 3.3Å; H82-L84 PolarHBondContact O-N 3.3Å; H82-G85 PolarHBondContact O-N 3.33Å
83F86.7Confident84.9Confident147 Ų14775.3 Ų75.365%0.64539%0.385SS*.Hα-helixtrans-62.8-36179.1-176.9-97.8000112.4V79 L80 G85 F146V79-F83 WeakPolarHBondContact O-CB 3.4Å; V79-F83 PolarHBondContact O-N 3.47Å; L80-F83 PolarHBondContact O-N 3.43Å; L80-F83 VanDerWaalsContact O-N 3.11Å; F83-G85 PolarHBondContact O-N 3.33Å; F83-F146 HydrophobicContact CD1-CE1 4.26Å; F83-F146 AromaticContact CD1-CZ 3.97Å; F83-F146 HydrophobicContact CD1-CZ 3.97Å; F83-F146 HydrophobicContact CE1-CE1 4.21Å; F83-F146 AromaticContact CE1-CE2 3.98Å; F83-F146 HydrophobicContact CE1-CE2 3.98Å; F83-F146 AromaticContact CE1-CZ 3.49Å; F83-F146 HydrophobicContact CE1-CZ 3.49Å; F83-F146 VanDerWaalsContact CE1-CZ 3.49Å
84L84.3Confident84.5Confident23 Ų2377.1 Ų77.112%0.1240%0.399CS..THydrogen-bonded Turntrans-71.3-7.4175-80.787.7000113.4L80 H82 T86 Y91 F111 F146L80-L84 HydrophobicContact CD1-CD1 3.49Å; L80-L84 VanDerWaalsContact CD1-CD1 3.49Å; L80-L84 HydrophobicContact CG-CD1 3.79Å; L80-L84 WeakPolarHBondContact O-CD1 3.29Å; L80-L84 PolarHBondContact O-N 2.86Å; H82-L84 VanDerWaalsContact C-N 3.3Å; H82-L84 PolarHBondContact O-N 3.3Å; L84-T86 WeakPolarHBondContact O-CG2 3.17Å; L84-T86 PolarHBondContact O-N 2.89Å; L84-T86 VanDerWaalsContact O-N 3.12Å; L84-Y91 HydrophobicContact CD2-CD1 3.57Å; L84-Y91 HydrophobicContact CD2-CE1 3.02Å; L84-Y91 HydrophobicContact CD2-CE2 4.13Å; L84-Y91 HydrophobicContact CD2-CG 4.35Å; L84-Y91 HydrophobicContact CG-CE1 4.45Å; L84-F111 HydrophobicContact CD2-CE2 4.37Å; L84-F111 HydrophobicContact CD2-CZ 4.35Å; L84-F111 HydrophobicContact CG-CZ 4.36Å; L84-F146 HydrophobicContact CD1-CB 4.47Å; L84-F146 HydrophobicContact CD1-CD1 4.25Å; L84-F146 HydrophobicContact CD1-CG 4.32Å; L84-F146 HydrophobicContact CD2-CB 4.16Å
85G75.7Confident84.1Confident66 Ų6674.1 Ų74.168%0.6839%0.385SS*.THydrogen-bonded Turntrans68.98.7175.400000114.2H82 F83H82-G85 PolarHBondContact O-N 3.33Å; F83-G85 PolarHBondContact O-N 3.33Å
86T71.8Confident83.8Confident28 Ų2872.1 Ų72.117%0.17237%0.374CS..  trans-95.6127.1-176.261.10000110.6L84 N88 Y91 I110L84-T86 WeakPolarHBondContact O-CG2 3.17Å; L84-T86 PolarHBondContact O-N 2.89Å; L84-T86 VanDerWaalsContact O-N 3.12Å; T86-N88 PolarHBondContact O-N 3.26Å; T86-Y91 HydrophobicContact CG2-CD2 3.24Å; T86-Y91 HydrophobicContact CG2-CE2 3.4Å; T86-Y91 VanDerWaalsContact CG2-CE2 3.4Å; T86-Y91 HydrophobicContact CG2-CG 4.25Å; T86-Y91 WeakPolarHBondContact OG1-CD2 3.44Å; T86-I110 HydrophobicContact CG2-CD1 4.47Å
87K69.5Low83.5Confident210 Ų21073 Ų7391%0.91338%0.379SS*.SBendtrans-68.7-13178.4-66.8-179.6179.2176.10113.5
88N75Confident83.2Confident108 Ų10873.9 Ų73.958%0.57838%0.384SS*.  trans-96.1117.7-173.1-61.5-27.2000110.6T86 M90 Y91T86-N88 PolarHBondContact O-N 3.26Å; N88-M90 PolarHBondContact O-N 2.91Å; N88-Y91 WeakPolarHBondContact O-CB 3.36Å; N88-Y91 PolarHBondContact O-N 3.42Å
89I75.3Confident83Confident110 Ų11072.3 Ų72.356%0.56438%0.376SS*.THydrogen-bonded Turntrans-58.6-29.8174.7-61.3170.9000111.3F77 N81 Y91 W150F77-I89 HydrophobicContact CE1-CG2 3.92Å; F77-I89 HydrophobicContact CZ-CG2 4.43Å; N81-I89 PolarHBondContact OD1-O 2.92Å; I89-Y91 PolarHBondContact O-N 3.48Å; I89-W150 WeakPolarHBondContact O-CZ2 3.23Å
90M81.5Confident82.9Confident115 Ų11574.6 Ų74.657%0.56738%0.384SS*.THydrogen-bonded Turntrans-85.623.6177.9-61-61.2-163.500113.4N88 G92 F93 S94N88-M90 PolarHBondContact O-N 2.91Å; M90-G92 VanDerWaalsContact C-N 3.3Å; M90-G92 PolarHBondContact O-N 2.95Å; M90-F93 PolarHBondContact O-N 2.63Å; M90-F93 VanDerWaalsContact O-N 3.17Å; M90-F93 HydrophobicContact SD-CD2 3.8Å; M90-F93 HydrophobicContact SD-CE2 4.08Å; M90-S94 PolarHBondContact O-N 3.13Å; M90-S94 PolarHBondContact O-OG 3.41Å
91Y81.6Confident82.8Confident6 Ų679.6 Ų79.62%0.02441%0.406CS..Hα-helixtrans-47.5-49.3-179.9168.8-94.6000113.2L84 T86 N88 I89 F93 S94 V95 I110 F111L84-Y91 HydrophobicContact CD2-CD1 3.57Å; L84-Y91 HydrophobicContact CD2-CE1 3.02Å; L84-Y91 HydrophobicContact CD2-CE2 4.13Å; L84-Y91 HydrophobicContact CD2-CG 4.35Å; L84-Y91 HydrophobicContact CG-CE1 4.45Å; T86-Y91 HydrophobicContact CG2-CD2 3.24Å; T86-Y91 HydrophobicContact CG2-CE2 3.4Å; T86-Y91 VanDerWaalsContact CG2-CE2 3.4Å; T86-Y91 HydrophobicContact CG2-CG 4.25Å; T86-Y91 WeakPolarHBondContact OG1-CD2 3.44Å; N88-Y91 WeakPolarHBondContact O-CB 3.36Å; N88-Y91 PolarHBondContact O-N 3.42Å; I89-Y91 PolarHBondContact O-N 3.48Å; Y91-F93 VanDerWaalsContact C-N 3.31Å; Y91-F93 PolarHBondContact O-N 3.43Å; Y91-S94 PolarHBondContact O-N 3.24Å; Y91-V95 HydrophobicContact CD1-CG2 4.38Å; Y91-V95 HydrophobicContact CD2-CG2 3.9Å; Y91-V95 HydrophobicContact CE1-CB 4.46Å; Y91-V95 HydrophobicContact CE1-CG2 3.85Å; Y91-V95 HydrophobicContact CE2-CG2 3.39Å; Y91-V95 HydrophobicContact CG-CG2 4.4Å; Y91-V95 WeakPolarHBondContact O-CG2 3.26Å; Y91-V95 PolarHBondContact O-N 2.98Å; Y91-I110 HydrophobicContact CE2-CD1 4Å; Y91-I110 HydrophobicContact CE2-CG2 4.1Å; Y91-I110 WeakPolarHBondContact OH-CG2 3.36Å; Y91-F111 VanDerWaalsContact OH-CE2 3.29Å; Y91-F111 WeakPolarHBondContact OH-CE2 3.1Å
92G84.4Confident82.7Confident0 Ų085.8 Ų85.80%044%0.439CS..Hα-helixtrans-65.3-32.8-17500000113.6M90 L96M90-G92 VanDerWaalsContact C-N 3.3Å; M90-G92 PolarHBondContact O-N 2.95Å; G92-L96 WeakPolarHBondContact O-CB 3.13Å; G92-L96 PolarHBondContact O-N 2.93Å
93F86Confident82.5Confident101 Ų10180.8 Ų80.844%0.44342%0.417SS..Hα-helixtrans-71.1-41.2173.9-71.6-63.9000112M90 Y91 L96 Q97 W150 F151 L154M90-F93 PolarHBondContact O-N 2.63Å; M90-F93 VanDerWaalsContact O-N 3.17Å; M90-F93 HydrophobicContact SD-CD2 3.8Å; M90-F93 HydrophobicContact SD-CE2 4.08Å; Y91-F93 VanDerWaalsContact C-N 3.31Å; Y91-F93 PolarHBondContact O-N 3.43Å; F93-L96 PolarHBondContact O-N 2.84Å; F93-Q97 WeakPolarHBondContact O-CB 3.29Å; F93-Q97 PolarHBondContact O-N 3.5Å; F93-W150 AromaticContact CD2-CH2 3.44Å; F93-W150 HydrophobicContact CD2-CH2 3.44Å; F93-W150 VanDerWaalsContact CD2-CH2 3.44Å; F93-W150 HydrophobicContact CD2-CZ2 4.41Å; F93-W150 HydrophobicContact CD2-CZ3 4.06Å; F93-W150 AromaticContact CE2-CH2 3.49Å; F93-W150 HydrophobicContact CE2-CH2 3.49Å; F93-W150 VanDerWaalsContact CE2-CH2 3.49Å; F93-W150 HydrophobicContact CE2-CZ3 4.01Å; F93-W150 HydrophobicContact CG-CH2 4.15Å; F93-W150 HydrophobicContact CG-CZ3 4.42Å; F93-W150 HydrophobicContact CZ-CH2 4.22Å; F93-W150 HydrophobicContact CZ-CZ3 4.3Å; F93-F151 HydrophobicContact CD1-CE1 4.19Å; F93-F151 HydrophobicContact CD1-CZ 4.5Å; F93-F151 AromaticContact CE1-CE1 3.96Å; F93-F151 HydrophobicContact CE1-CE1 3.96Å; F93-L154 HydrophobicContact CE2-CD2 4.07Å; F93-L154 HydrophobicContact CZ-CD2 3.98Å
94S84.8Confident82.2Confident49 Ų4979.3 Ų79.334%0.34341%0.412SS..Hα-helixtrans-61.8-48.9176.1-61.80000111.4M90 Y91 L96 Q97 D98M90-S94 PolarHBondContact O-N 3.13Å; M90-S94 PolarHBondContact O-OG 3.41Å; Y91-S94 PolarHBondContact O-N 3.24Å; S94-L96 VanDerWaalsContact C-N 3.34Å; S94-L96 PolarHBondContact O-N 2.46Å; S94-Q97 WeakPolarHBondContact O-CB 3.45Å; S94-Q97 PolarHBondContact O-N 3.31Å; S94-Q97 VanDerWaalsContact O-N 3.13Å; S94-D98 VanDerWaalsContact O-CG 3.23Å; S94-D98 PolarHBondContact O-N 2.76Å
95V84.6Confident82Confident15 Ų1580.7 Ų80.79%0.09142%0.415CS..Hα-helixtrans-66.1-36.7178.9177.50000112.1Y91 Q97 D98 L99 L147Y91-V95 HydrophobicContact CD1-CG2 4.38Å; Y91-V95 HydrophobicContact CD2-CG2 3.9Å; Y91-V95 HydrophobicContact CE1-CB 4.46Å; Y91-V95 HydrophobicContact CE1-CG2 3.85Å; Y91-V95 HydrophobicContact CE2-CG2 3.39Å; Y91-V95 HydrophobicContact CG-CG2 4.4Å; Y91-V95 WeakPolarHBondContact O-CG2 3.26Å; Y91-V95 PolarHBondContact O-N 2.98Å; V95-Q97 VanDerWaalsContact C-N 3.33Å; V95-D98 PolarHBondContact O-N 2.89Å; V95-L99 VanDerWaalsContact O-CB 3.25Å; V95-L99 WeakPolarHBondContact O-CB 3.33Å; V95-L99 PolarHBondContact O-N 2.86Å; V95-L147 HydrophobicContact CG1-CD1 3.94Å
96L86.5Confident82Confident59 Ų5984.1 Ų84.131%0.30941%0.414SS..Hα-helixtrans-62.9-41.8173.4-178.364.2000111.3G92 F93 S94 L99 L100 F151G92-L96 WeakPolarHBondContact O-CB 3.13Å; G92-L96 PolarHBondContact O-N 2.93Å; F93-L96 PolarHBondContact O-N 2.84Å; S94-L96 VanDerWaalsContact C-N 3.34Å; S94-L96 PolarHBondContact O-N 2.46Å; L96-L99 PolarHBondContact O-N 3.45Å; L96-L100 HydrophobicContact CD1-CD1 4.49Å; L96-L100 HydrophobicContact CG-CD1 4.16Å; L96-L100 WeakPolarHBondContact O-CB 3.37Å; L96-L100 VanDerWaalsContact O-CG 3.25Å; L96-L100 WeakPolarHBondContact O-CG 3.23Å; L96-L100 PolarHBondContact O-N 3.43Å; L96-F151 HydrophobicContact CB-CE2 4.28Å; L96-F151 HydrophobicContact CB-CZ 4.01Å; L96-F151 HydrophobicContact CD2-CE1 4.31Å; L96-F151 HydrophobicContact CD2-CE2 4.12Å; L96-F151 HydrophobicContact CD2-CZ 3.54Å; L96-F151 HydrophobicContact CG-CZ 4.32Å
97Q87.3Confident82.1Confident100 Ų10090.3 Ų90.347%0.46744%0.441SS..Hα-helixtrans-66.2-40.9177.6-174.3178.31100112F93 S94 V95 L99 L100 K101F93-Q97 WeakPolarHBondContact O-CB 3.29Å; F93-Q97 PolarHBondContact O-N 3.5Å; S94-Q97 WeakPolarHBondContact O-CB 3.45Å; S94-Q97 PolarHBondContact O-N 3.31Å; S94-Q97 VanDerWaalsContact O-N 3.13Å; V95-Q97 VanDerWaalsContact C-N 3.33Å; Q97-L99 VanDerWaalsContact C-N 3.35Å; Q97-L100 PolarHBondContact O-N 3.4Å; Q97-K101 HydrophobicContact CG-CD 4.32Å; Q97-K101 WeakPolarHBondContact O-CG 3.33Å; Q97-K101 PolarHBondContact O-N 2.93Å; Q97-K101 VanDerWaalsContact O-N 3.12Å
98D85.6Confident82.5Confident40 Ų4082.7 Ų82.721%0.21441%0.412CS..Hα-helixtrans-66.4-40177.8-66.3-21000110.8S94 V95 K101 D102 I103 T108S94-D98 VanDerWaalsContact O-CG 3.23Å; S94-D98 PolarHBondContact O-N 2.76Å; V95-D98 PolarHBondContact O-N 2.89Å; D98-K101 CarbonylContact O-C 3.6Å; D98-K101 PolarHBondContact O-N 3.16Å; D98-D102 PolarHBondContact O-N 2.96Å; D98-I103 HydrophobicContact CB-CB 4.24Å; D98-I103 PolarHBondContact O-N 3.35Å; D98-T108 HydrophobicContact CB-CG2 4.49Å
99L85Confident82.6Confident69 Ų6980.5 Ų80.536%0.36142%0.415SS..Hα-helixtrans-67.8-34.2175.7-170.166.6000112.6V95 L96 Q97 K101 D102 K144 L147V95-L99 VanDerWaalsContact O-CB 3.25Å; V95-L99 WeakPolarHBondContact O-CB 3.33Å; V95-L99 PolarHBondContact O-N 2.86Å; L96-L99 PolarHBondContact O-N 3.45Å; Q97-L99 VanDerWaalsContact C-N 3.35Å; L99-K101 VanDerWaalsContact C-N 3.28Å; L99-D102 PolarHBondContact O-N 3.37Å; L99-K144 VanDerWaalsContact CD1-NZ 3.28Å; L99-L147 HydrophobicContact CD2-CD1 4.49Å
100L88.9Confident82.7Confident133 Ų13377.7 Ų77.770%0.69640%0.4SS*.Hα-helixtrans-72.4-21174.2-75.4170.1000113.2L96 Q97L96-L100 HydrophobicContact CD1-CD1 4.49Å; L96-L100 HydrophobicContact CG-CD1 4.16Å; L96-L100 WeakPolarHBondContact O-CB 3.37Å; L96-L100 VanDerWaalsContact O-CG 3.25Å; L96-L100 WeakPolarHBondContact O-CG 3.23Å; L96-L100 PolarHBondContact O-N 3.43Å; Q97-L100 PolarHBondContact O-N 3.4Å
101K89.4Confident82.7Confident122 Ų12274 Ų7453%0.5338%0.381SS..THydrogen-bonded Turntrans-95.85.2176.8-71.6176.7-177.5173.60113Q97 D98 L99 I103Q97-K101 HydrophobicContact CG-CD 4.32Å; Q97-K101 WeakPolarHBondContact O-CG 3.33Å; Q97-K101 PolarHBondContact O-N 2.93Å; Q97-K101 VanDerWaalsContact O-N 3.12Å; D98-K101 CarbonylContact O-C 3.6Å; D98-K101 PolarHBondContact O-N 3.16Å; L99-K101 VanDerWaalsContact C-N 3.28Å; K101-I103 HydrophobicContact CB-CD1 4.01Å; K101-I103 HydrophobicContact CB-CG1 3.94Å; K101-I103 HydrophobicContact CD-CD1 4.11Å; K101-I103 PolarHBondContact O-N 2.92Å
102D84.9Confident82.9Confident142 Ų14276 Ų7676%0.75940%0.395SS*.THydrogen-bonded Turntrans54.434.2-174.4-62.3-50.3000113.5D98 L99 E104D98-D102 PolarHBondContact O-N 2.96Å; L99-D102 PolarHBondContact O-N 3.37Å; D102-E104 PolarHBondContact O-N 3.03Å
103I83.7Confident83.1Confident53 Ų5379.7 Ų79.727%0.27241%0.409SS..  trans-79.6118.4174.7-62.3173000108.7D98 K101 Q107 T108D98-I103 HydrophobicContact CB-CB 4.24Å; D98-I103 PolarHBondContact O-N 3.35Å; K101-I103 HydrophobicContact CB-CD1 4.01Å; K101-I103 HydrophobicContact CB-CG1 3.94Å; K101-I103 HydrophobicContact CD-CD1 4.11Å; K101-I103 PolarHBondContact O-N 2.92Å; I103-Q107 HydrophobicContact CG2-CB 3.97Å; I103-Q107 HydrophobicContact CG2-CG 4.48Å; I103-T108 HydrophobicContact CG2-CG2 4.14Å
104E80.7Confident83.2Confident117 Ų11777.2 Ų77.255%0.54740%0.402SS..  trans-75.5157.1-178.9-62.2-169.9133.500113D102 E106 Q107D102-E104 PolarHBondContact O-N 3.03Å; E104-E106 PolarHBondContact O-N 3.15Å; E104-Q107 PolarHBondContact O-N 3.02Å
105W79.2Confident83.5Confident51 Ų5176.9 Ų76.919%0.19340%0.398CS..Hα-helixtrans-55.9-21.2179.460.3-87.8000113.7Q107 T108 G109 P112 R113 V114W105-Q107 PolarHBondContact O-N 3.49Å; W105-T108 PolarHBondContact O-N 3.24Å; W105-G109 WeakPolarHBondContact O-CA 3.45Å; W105-G109 PolarHBondContact O-N 3.5Å; W105-P112 HydrophobicContact CE3-CB 3.89Å; W105-P112 HydrophobicContact CZ3-CB 3.82Å; W105-R113 HydrophobicContact CG-CG 4.45Å; W105-R113 HydrophobicContact CZ2-CB 4.29Å; W105-V114 HydrophobicContact CH2-CB 4.12Å; W105-V114 HydrophobicContact CZ2-CB 4.41Å; W105-V114 HydrophobicContact CZ2-CG2 4.37Å
106E76Confident83.8Confident138 Ų13882.5 Ų82.565%0.64543%0.427SS*.Hα-helixtrans-61.6-31.3177-60.7-170.117400112.5E104E104-E106 PolarHBondContact O-N 3.15Å
107Q75.1Confident84.2Confident158 Ų15882 Ų8274%0.73843%0.427SS*.Hα-helixtrans-89-36.3179.7-62.3-169.5-8.100112.6I103 E104 W105I103-Q107 HydrophobicContact CG2-CB 3.97Å; I103-Q107 HydrophobicContact CG2-CG 4.48Å; E104-Q107 PolarHBondContact O-N 3.02Å; W105-Q107 PolarHBondContact O-N 3.49Å
108T76.9Confident84.5Confident51 Ų5182.3 Ų82.331%0.31343%0.432SS..Hα-helixtrans-81.6-25.1-177.264.10000112.3D98 I103 W105 I110D98-T108 HydrophobicContact CB-CG2 4.49Å; I103-T108 HydrophobicContact CG2-CG2 4.14Å; W105-T108 PolarHBondContact O-N 3.24Å; T108-I110 PolarHBondContact O-N 3.14Å; T108-I110 PolarHBondContact OG1-N 3.01Å
109G77Confident84.8Confident61 Ų6184.7 Ų84.763%0.62944%0.444SS*.  trans67.55.3-172.900000113.5W105W105-G109 WeakPolarHBondContact O-CA 3.45Å; W105-G109 PolarHBondContact O-N 3.5Å
110I77.1Confident85.1Confident51 Ų5185.5 Ų85.526%0.26245%0.452SS..SBendtrans-94.4125.6-177.3-65.9161.1000108T86 Y91 T108T86-I110 HydrophobicContact CG2-CD1 4.47Å; Y91-I110 HydrophobicContact CE2-CD1 4Å; Y91-I110 HydrophobicContact CE2-CG2 4.1Å; Y91-I110 WeakPolarHBondContact OH-CG2 3.36Å; T108-I110 PolarHBondContact O-N 3.14Å; T108-I110 PolarHBondContact OG1-N 3.01Å
111F81.4Confident85.1Confident37 Ų3782.3 Ų82.316%0.16244%0.438CS..SBendtrans53.674.1179.7-62.6-56.8000115.2L84 Y91 R113 N139 E143 F146L84-F111 HydrophobicContact CD2-CE2 4.37Å; L84-F111 HydrophobicContact CD2-CZ 4.35Å; L84-F111 HydrophobicContact CG-CZ 4.36Å; Y91-F111 VanDerWaalsContact OH-CE2 3.29Å; Y91-F111 WeakPolarHBondContact OH-CE2 3.1Å; F111-R113 PolarHBondContact O-N 3.34Å; F111-N139 WeakPolarHBondContact CA-ND2 3.43Å; F111-N139 WeakPolarHBondContact CB-ND2 3.49Å; F111-N139 WeakPolarHBondContact CD1-OD1 3.45Å; F111-N139 PolarHBondContact O-ND2 3.3Å; F111-E143 HydrophobicContact CB-CB 4.43Å; F111-E143 HydrophobicContact CD2-CB 4.06Å; F111-E143 HydrophobicContact CD2-CG 4.04Å; F111-E143 HydrophobicContact CG-CB 4.44Å; F111-F146 HydrophobicContact CE1-CD2 4.24Å; F111-F146 HydrophobicContact CE1-CE2 4.47Å; F111-F146 HydrophobicContact CE2-CD2 4.41Å; F111-F146 AromaticContact CZ-CD2 3.64Å; F111-F146 HydrophobicContact CZ-CD2 3.64Å; F111-F146 HydrophobicContact CZ-CE2 4.26Å
112P86.6Confident85Confident48 Ų4886.5 Ų86.531%0.31245%0.451SS..  trans-66132.9177.628.6-35.3000112.7W105 T115 N139W105-P112 HydrophobicContact CE3-CB 3.89Å; W105-P112 HydrophobicContact CZ3-CB 3.82Å; P112-T115 HydrophobicContact CB-CG2 4.38Å; P112-T115 HydrophobicContact CG-CG2 4.11Å; P112-N139 VanDerWaalsContact N-ND2 3.15Å; P112-N139 PolarHBondContact O-ND2 3.02Å
113R87.4Confident85.2Confident78 Ų7883.2 Ų83.229%0.29444%0.435SS..SBendtrans-85.3-19.7177-61.7-179.2-172.3161.95.5112.5W105 F111 L136 E143W105-R113 HydrophobicContact CG-CG 4.45Å; W105-R113 HydrophobicContact CZ2-CB 4.29Å; F111-R113 PolarHBondContact O-N 3.34Å; R113-L136 PolarHBondContact O-N 3.08Å; R113-E143 IonicContact CZ-OE2 3.84Å; R113-E143 IonicContact NE-OE2 3.81Å; R113-E143 IonicContact NH2-OE2 2.96Å; R113-E143 PolarHBondContact NH2-OE2 2.88Å
114V89Confident85.3Confident50 Ų5089.1 Ų89.130%0.30347%0.467SS..EExtended strand (participates in β ladder)trans-125.9131.6178.3-179.70000108.5W105 Q133 C134W105-V114 HydrophobicContact CH2-CB 4.12Å; W105-V114 HydrophobicContact CZ2-CB 4.41Å; W105-V114 HydrophobicContact CZ2-CG2 4.37Å; V114-Q133 HydrophobicContact CG1-CG 3.41Å; V114-Q133 VanDerWaalsContact CG1-CG 3.41Å; V114-Q133 VanDerWaalsContact CG1-NE2 3.32Å; V114-C134 WeakPolarHBondContact CA-O 3.36Å
115T90.7Very high85.5Confident42 Ų4287.5 Ų87.526%0.25848%0.481SS..EExtended strand (participates in β ladder)trans-132153-179.7550000110.3P112 C134P112-T115 HydrophobicContact CB-CG2 4.38Å; P112-T115 HydrophobicContact CG-CG2 4.11Å; T115-C134 PolarHBondContact N-O 3.47Å; T115-C134 PolarHBondContact O-N 2.66Å
116L92.4Very high85.9Confident133 Ų13389.6 Ų89.670%0.69650%0.496SS*.EExtended strand (participates in β ladder)trans-96.8124.4172-65.4173.4000108.7V132 Q133L116-V132 WeakPolarHBondContact CA-O 3.34Å; L116-Q133 HydrophobicContact CD2-CB 4.39Å
117C93.3Very high86.5Confident48 Ų4886.4 Ų86.432%0.32449%0.486SS..EExtended strand (participates in β ladder)trans-110.7127.5179.2-71.30000110.3T131 V132 C134C117-T131 WeakPolarHBondContact O-CA 3.2Å; C117-V132 HydrophobicContact CB-CG2 4.19Å; C117-V132 PolarHBondContact N-O 3.47Å; C117-V132 PolarHBondContact O-N 3.46Å; C117-C134 PolarHBondContact SG-SG 2.77Å
118D94.2Very high87.1Confident107 Ų10783 Ų8357%0.57247%0.47SS*.EExtended strand (participates in β ladder)trans-85.1113.7175-71.7-15.1000110.3T131D118-T131 WeakPolarHBondContact OD1-CG2 3.23Å
119L91.6Very high87.7Confident89 Ų8989.9 Ų89.947%0.46649%0.49SS..EExtended strand (participates in β ladder)trans-96.6130.1173.5-64.8173.8000109.8R129 H130 V132L119-R129 WeakPolarHBondContact O-CA 3.34Å; L119-H130 PolarHBondContact N-O 2.91Å; L119-H130 PolarHBondContact O-N 3.28Å; L119-V132 HydrophobicContact CD1-CB 4.41Å; L119-V132 HydrophobicContact CD1-CG1 3.88Å; L119-V132 HydrophobicContact CD1-CG2 3.6Å; L119-V132 HydrophobicContact CG-CG2 4.02Å
120V90.8Very high88.4Confident87 Ų8792.4 Ų92.453%0.52749%0.485SS..EExtended strand (participates in β ladder)trans-101.3109.3177.7-175.70000108.9V127 R129V120-V127 HydrophobicContact CG1-CG1 3.13Å; V120-R129 HydrophobicContact CG2-CG 4.32Å
121V89.6Confident89.2Confident66 Ų6694.7 Ų94.740%0.450%0.502SS..EExtended strand (participates in β ladder)trans-108.4133.1179.5-1740000109.1V123 H128V121-V123 HydrophobicContact CG1-CG2 4.01Å; V121-H128 PolarHBondContact N-O 3.01Å; V121-H128 PolarHBondContact O-N 3.34Å
122R88.3Confident89.8Confident210 Ų21095.6 Ų95.679%0.79251%0.51SS*.EExtended strand (participates in β ladder)trans-98.6120.9175.9-66-173.3179.1-174.8-0.1109.9N126 V127R122-N126 WeakPolarHBondContact CA-O 3.45Å; R122-V127 HydrophobicContact CG-CG2 4.22Å
123V87.7Confident90.1Very high72 Ų72100 Ų10044%0.43653%0.527SS..EExtended strand (participates in β ladder)trans-131.3127175.8-171.40000107.7V121 G125 N126V121-V123 HydrophobicContact CG1-CG2 4.01Å; V123-G125 PolarHBondContact O-N 3.43Å; V123-G125 VanDerWaalsContact O-N 3.16Å; V123-N126 PolarHBondContact N-O 3Å; V123-N126 PolarHBondContact O-N 3.4Å
124L86.1Confident90.4Very high178 Ų17898.4 Ų98.493%0.93253%0.527SS*.THydrogen-bonded Turntrans55.332.9176.3-67.2147.9000114.8N126L124-N126 PolarHBondContact O-N 2.89Å
125G85.5Confident90.5Very high82 Ų82100.9 Ų100.985%0.84554%0.542SS*.THydrogen-bonded Turntrans80.6-5.1-178.400000114.9V123V123-G125 PolarHBondContact O-N 3.43Å; V123-G125 VanDerWaalsContact O-N 3.16Å
126N87.6Confident90.5Very high96 Ų96102.2 Ų102.251%0.51355%0.547SS..EExtended strand (participates in β ladder)trans-99.4150173.3-157.412.7000111.7R122 V123 L124R122-N126 WeakPolarHBondContact CA-O 3.45Å; V123-N126 PolarHBondContact N-O 3Å; V123-N126 PolarHBondContact O-N 3.4Å; L124-N126 PolarHBondContact O-N 2.89Å
127V87.9Confident90.3Very high71 Ų71102.7 Ų102.743%0.4355%0.548SS..EExtended strand (participates in β ladder)trans-103110-177.2-178.40000108.9V120 R122V120-V127 HydrophobicContact CG1-CG1 3.13Å; R122-V127 HydrophobicContact CG-CG2 4.22Å
128H87.8Confident90.2Very high86 Ų86105.4 Ų105.440%0.39856%0.558SS.*EExtended strand (participates in β ladder)trans-103.2137.3176.1-66.8-78.8000110.6V121V121-H128 PolarHBondContact N-O 3.01Å; V121-H128 PolarHBondContact O-N 3.34Å
129R89.8Confident90Very high196 Ų196101 Ų10174%0.7453%0.534SS*.EExtended strand (participates in β ladder)trans-104.3124.6176.6-62.5-171.6178.9167.20.1109.6L119 V120L119-R129 WeakPolarHBondContact O-CA 3.34Å; V120-R129 HydrophobicContact CG2-CG 4.32Å
130H92.2Very high89.8Confident113 Ų113101.6 Ų101.652%0.52354%0.536SS..EExtended strand (participates in β ladder)trans-116.6134.4173.9-69.9-76.7000109.5L119L119-H130 PolarHBondContact N-O 2.91Å; L119-H130 PolarHBondContact O-N 3.28Å
131T93.9Very high89.8Confident99 Ų99104 Ų10461%0.60754%0.539SS*.EExtended strand (participates in β ladder)trans-93.9130.2175.155.40000109.1C117 D118C117-T131 WeakPolarHBondContact O-CA 3.2Å; D118-T131 WeakPolarHBondContact OD1-CG2 3.23Å
132V93.4Very high89.8Confident56 Ų56103.1 Ų103.134%0.33953%0.532SS..EExtended strand (participates in β ladder)trans-123.8148.3174.9-63.10000110.6L116 C117 L119L116-V132 WeakPolarHBondContact CA-O 3.34Å; C117-V132 HydrophobicContact CB-CG2 4.19Å; C117-V132 PolarHBondContact N-O 3.47Å; C117-V132 PolarHBondContact O-N 3.46Å; L119-V132 HydrophobicContact CD1-CB 4.41Å; L119-V132 HydrophobicContact CD1-CG1 3.88Å; L119-V132 HydrophobicContact CD1-CG2 3.6Å; L119-V132 HydrophobicContact CG-CG2 4.02Å
133Q93.6Very high89.7Confident141 Ų14194 Ų9466%0.65950%0.499SS*.EExtended strand (participates in β ladder)trans-82.2120.5174.4-174.8177.2-24.900110V114 L116V114-Q133 HydrophobicContact CG1-CG 3.41Å; V114-Q133 VanDerWaalsContact CG1-CG 3.41Å; V114-Q133 VanDerWaalsContact CG1-NE2 3.32Å; L116-Q133 HydrophobicContact CD2-CB 4.39Å
134C93.1Very high89.8Confident44 Ų4494.4 Ų94.430%0.29750%0.495SS..EExtended strand (participates in β ladder)trans-111.2135.1176.9-66.20000110.6V114 T115 C117V114-C134 WeakPolarHBondContact CA-O 3.36Å; T115-C134 PolarHBondContact N-O 3.47Å; T115-C134 PolarHBondContact O-N 2.66Å; C117-C134 PolarHBondContact SG-SG 2.77Å
135V91.1Very high90.1Very high102 Ų10290 Ų9062%0.61847%0.471SS*.EExtended strand (participates in β ladder)trans-93.2121.6173.2-178.10000108.9M137V135-M137 HydrophobicContact CG1-CG 4.04Å; V135-M137 PolarHBondContact O-N 3.23Å
136L90.2Very high90.3Very high71 Ų7187.6 Ų87.637%0.37244%0.437SS..  trans-101.174.3-176.8-165.364.3000110.4R113 I138 N139R113-L136 PolarHBondContact O-N 3.08Å; L136-I138 HydrophobicContact CD1-CG2 3.62Å; L136-I138 HydrophobicContact CG-CG2 3.74Å; L136-I138 PolarHBondContact O-N 3.07Å; L136-N139 HydrophobicContact CB-CB 4.43Å; L136-N139 HydrophobicContact CD2-CB 4.03Å; L136-N139 HydrophobicContact CG-CB 4.06Å; L136-N139 WeakPolarHBondContact O-CB 3.34Å; L136-N139 PolarHBondContact O-N 2.97Å
137M89.2Confident90.4Very high143 Ų14384.3 Ų84.370%0.70442%0.42SS*.Hα-helixtrans-58-33-177-64.7-173.6-70.300113.2V135 N139 M140 F141V135-M137 HydrophobicContact CG1-CG 4.04Å; V135-M137 PolarHBondContact O-N 3.23Å; M137-N139 PolarHBondContact O-N 2.87Å; M137-N139 VanDerWaalsContact O-N 3.16Å; M137-M140 WeakPolarHBondContact O-CB 3.35Å; M137-M140 PolarHBondContact O-N 3.34Å; M137-F141 WeakPolarHBondContact O-CD2 3.36Å
138I90.7Very high90.5Very high105 Ų10587.2 Ų87.254%0.53843%0.427SS..Hα-helixtrans-58.3-29.3177.5-169166000112.6L136 M140 F141 N142L136-I138 HydrophobicContact CD1-CG2 3.62Å; L136-I138 HydrophobicContact CG-CG2 3.74Å; L136-I138 PolarHBondContact O-N 3.07Å; I138-M140 VanDerWaalsContact C-N 3.34Å; I138-M140 PolarHBondContact O-N 2.99Å; I138-F141 PolarHBondContact O-N 3.41Å; I138-N142 PolarHBondContact O-N 3.21Å
139N90.2Very high90.8Very high15 Ų1585.7 Ų85.78%0.0842%0.421CS..Hα-helixtrans-73-30.7-176.6-151.925.9000112.8F111 P112 L136 M137 F141 N142 E143F111-N139 WeakPolarHBondContact CA-ND2 3.43Å; F111-N139 WeakPolarHBondContact CB-ND2 3.49Å; F111-N139 WeakPolarHBondContact CD1-OD1 3.45Å; F111-N139 PolarHBondContact O-ND2 3.3Å; P112-N139 VanDerWaalsContact N-ND2 3.15Å; P112-N139 PolarHBondContact O-ND2 3.02Å; L136-N139 HydrophobicContact CB-CB 4.43Å; L136-N139 HydrophobicContact CD2-CB 4.03Å; L136-N139 HydrophobicContact CG-CB 4.06Å; L136-N139 WeakPolarHBondContact O-CB 3.34Å; L136-N139 PolarHBondContact O-N 2.97Å; M137-N139 PolarHBondContact O-N 2.87Å; M137-N139 VanDerWaalsContact O-N 3.16Å; N139-F141 VanDerWaalsContact C-N 3.27Å; N139-F141 PolarHBondContact O-N 3.29Å; N139-N142 PolarHBondContact O-N 2.84Å; N139-E143 WeakPolarHBondContact O-CB 3.42Å; N139-E143 PolarHBondContact O-N 2.92Å
140M87.2Confident90.8Very high100 Ų10076.4 Ų76.449%0.49339%0.386SS..Hα-helixtrans-61.8-37.9172.5-176.2179.3174.200111.2M137 I138M137-M140 WeakPolarHBondContact O-CB 3.35Å; M137-M140 PolarHBondContact O-N 3.34Å; I138-M140 VanDerWaalsContact C-N 3.34Å; I138-M140 PolarHBondContact O-N 2.99Å
141F90.4Very high90.8Very high137 Ų13773.4 Ų73.460%0.60137%0.372SS*.Hα-helixtrans-71.4-44.2174.7-68-75.9000111.8M137 I138 N139 E143 K144 I145M137-F141 WeakPolarHBondContact O-CD2 3.36Å; I138-F141 PolarHBondContact O-N 3.41Å; N139-F141 VanDerWaalsContact C-N 3.27Å; N139-F141 PolarHBondContact O-N 3.29Å; F141-E143 VanDerWaalsContact C-N 3.35Å; F141-E143 PolarHBondContact O-N 3.36Å; F141-K144 PolarHBondContact O-N 3.19Å; F141-I145 HydrophobicContact CB-CD1 4.39Å; F141-I145 VanDerWaalsContact O-CG1 3.31Å; F141-I145 WeakPolarHBondContact O-CG1 3.22Å; F141-I145 PolarHBondContact O-N 3Å
142N89.8Confident90.8Very high49 Ų4975.6 Ų75.626%0.26237%0.369SS..Hα-helixtrans-59.3-43.2178.5-75.7-18.8000112.5I138 N139 K144 I145 F146I138-N142 PolarHBondContact O-N 3.21Å; N139-N142 PolarHBondContact O-N 2.84Å; N142-K144 PolarHBondContact O-N 3.49Å; N142-I145 PolarHBondContact O-N 3.33Å; N142-F146 HydrophobicContact CB-CD2 3.95Å; N142-F146 HydrophobicContact CB-CE2 3.83Å; N142-F146 WeakPolarHBondContact O-CB 3.46Å; N142-F146 WeakPolarHBondContact O-CD2 3.45Å; N142-F146 PolarHBondContact O-N 3.5Å
143E87.1Confident90.8Very high18 Ų1875 Ų758%0.08436%0.362CS..Hα-helixtrans-51.2-46.1176.4-168.8-156.8128.900111F111 R113 N139 F141 L147F111-E143 HydrophobicContact CB-CB 4.43Å; F111-E143 HydrophobicContact CD2-CB 4.06Å; F111-E143 HydrophobicContact CD2-CG 4.04Å; F111-E143 HydrophobicContact CG-CB 4.44Å; R113-E143 IonicContact CZ-OE2 3.84Å; R113-E143 IonicContact NE-OE2 3.81Å; R113-E143 IonicContact NH2-OE2 2.96Å; R113-E143 PolarHBondContact NH2-OE2 2.88Å; N139-E143 WeakPolarHBondContact O-CB 3.42Å; N139-E143 PolarHBondContact O-N 2.92Å; F141-E143 VanDerWaalsContact C-N 3.35Å; F141-E143 PolarHBondContact O-N 3.36Å; E143-L147 WeakPolarHBondContact O-CB 3.34Å; E143-L147 PolarHBondContact O-N 3.33Å
144K88.7Confident90.7Very high80 Ų8070.4 Ų70.435%0.34834%0.342SS..Hα-helixtrans-76.8-41.4-178.6-55.3-48.1-179-163.90112.9L99 F141 N142 L147 F148L99-K144 VanDerWaalsContact CD1-NZ 3.28Å; F141-K144 PolarHBondContact O-N 3.19Å; N142-K144 PolarHBondContact O-N 3.49Å; K144-L147 PolarHBondContact O-N 3.35Å; K144-F148 PolarHBondContact O-N 3.05Å
145I92.2Very high90.7Very high86 Ų8671.9 Ų71.944%0.44135%0.35SS..Hα-helixtrans-64.4-45.4179.1-67.1165000110.6F141 N142 F148 L149F141-I145 HydrophobicContact CB-CD1 4.39Å; F141-I145 VanDerWaalsContact O-CG1 3.31Å; F141-I145 WeakPolarHBondContact O-CG1 3.22Å; F141-I145 PolarHBondContact O-N 3Å; N142-I145 PolarHBondContact O-N 3.33Å; I145-F148 PolarHBondContact O-N 3.37Å; I145-L149 HydrophobicContact CG2-CD1 3.84Å; I145-L149 HydrophobicContact CG2-CG 4.25Å; I145-L149 WeakPolarHBondContact O-CB 3.26Å; I145-L149 WeakPolarHBondContact O-CG 3.2Å; I145-L149 PolarHBondContact O-N 3.47Å
146F89.9Confident90.9Very high31 Ų3169.2 Ų69.214%0.13633%0.333CS..Hα-helixtrans-68.8-35179.9-72-53.2000112.7L80 F83 L84 F111 N142 L149 W150L80-F146 HydrophobicContact CD1-CD1 3.93Å; L80-F146 HydrophobicContact CD1-CE1 4.4Å; F83-F146 HydrophobicContact CD1-CE1 4.26Å; F83-F146 AromaticContact CD1-CZ 3.97Å; F83-F146 HydrophobicContact CD1-CZ 3.97Å; F83-F146 HydrophobicContact CE1-CE1 4.21Å; F83-F146 AromaticContact CE1-CE2 3.98Å; F83-F146 HydrophobicContact CE1-CE2 3.98Å; F83-F146 AromaticContact CE1-CZ 3.49Å; F83-F146 HydrophobicContact CE1-CZ 3.49Å; F83-F146 VanDerWaalsContact CE1-CZ 3.49Å; L84-F146 HydrophobicContact CD1-CB 4.47Å; L84-F146 HydrophobicContact CD1-CD1 4.25Å; L84-F146 HydrophobicContact CD1-CG 4.32Å; L84-F146 HydrophobicContact CD2-CB 4.16Å; F111-F146 HydrophobicContact CE1-CD2 4.24Å; F111-F146 HydrophobicContact CE1-CE2 4.47Å; F111-F146 HydrophobicContact CE2-CD2 4.41Å; F111-F146 AromaticContact CZ-CD2 3.64Å; F111-F146 HydrophobicContact CZ-CD2 3.64Å; F111-F146 HydrophobicContact CZ-CE2 4.26Å; N142-F146 HydrophobicContact CB-CD2 3.95Å; N142-F146 HydrophobicContact CB-CE2 3.83Å; N142-F146 WeakPolarHBondContact O-CB 3.46Å; N142-F146 WeakPolarHBondContact O-CD2 3.45Å; N142-F146 PolarHBondContact O-N 3.5Å; F146-L149 HydrophobicContact CD1-CD1 4.26Å; F146-L149 PolarHBondContact O-N 2.94Å; F146-W150 VanDerWaalsContact O-CB 3.29Å; F146-W150 WeakPolarHBondContact O-CB 3.25Å; F146-W150 PolarHBondContact O-N 3.48Å
147L89Confident91.1Very high27 Ų2765.9 Ų65.914%0.14132%0.316CS..Hα-helixtrans-60.7-48.2171.3-175.7148.8000110.8V95 L99 E143 K144 W150 F151V95-L147 HydrophobicContact CG1-CD1 3.94Å; L99-L147 HydrophobicContact CD2-CD1 4.49Å; E143-L147 WeakPolarHBondContact O-CB 3.34Å; E143-L147 PolarHBondContact O-N 3.33Å; K144-L147 PolarHBondContact O-N 3.35Å; L147-W150 PolarHBondContact O-N 2.85Å; L147-F151 HydrophobicContact CD2-CD2 3.82Å; L147-F151 HydrophobicContact CD2-CE2 3.74Å; L147-F151 HydrophobicContact CG-CD2 4.24Å; L147-F151 HydrophobicContact CG-CE2 3.94Å; L147-F151 VanDerWaalsContact O-CD2 3.22Å; L147-F151 WeakPolarHBondContact O-CD2 3.44Å; L147-F151 PolarHBondContact O-N 2.88Å
148F92Very high91.4Very high133 Ų13362.8 Ų62.858%0.58330%0.302SS*.Hα-helixtrans-60.5-48.2176.9176.2-98.7000112.3K144 I145 W150 F151 W152K144-F148 PolarHBondContact O-N 3.05Å; I145-F148 PolarHBondContact O-N 3.37Å; F148-W150 VanDerWaalsContact C-N 3.29Å; F148-W150 PolarHBondContact O-N 3.02Å; F148-F151 PolarHBondContact O-N 3.31Å; F148-W152 HydrophobicContact CZ-CE3 4.43Å; F148-W152 WeakPolarHBondContact O-CB 3.12Å; F148-W152 PolarHBondContact O-N 3.23Å
149L92.4Very high91.6Very high53 Ų5363.2 Ų63.228%0.27731%0.305SS..Hα-helixtrans-60.3-38.8177.9-75174.8000112I145 F146 W152 F153I145-L149 HydrophobicContact CG2-CD1 3.84Å; I145-L149 HydrophobicContact CG2-CG 4.25Å; I145-L149 WeakPolarHBondContact O-CB 3.26Å; I145-L149 WeakPolarHBondContact O-CG 3.2Å; I145-L149 PolarHBondContact O-N 3.47Å; F146-L149 HydrophobicContact CD1-CD1 4.26Å; F146-L149 PolarHBondContact O-N 2.94Å; L149-W152 PolarHBondContact O-N 3.41Å; L149-F153 HydrophobicContact CB-CD2 4.29Å; L149-F153 HydrophobicContact CB-CE2 4.28Å; L149-F153 HydrophobicContact CD2-CE2 4.27Å; L149-F153 WeakPolarHBondContact O-CB 3.16Å; L149-F153 WeakPolarHBondContact O-CD2 3.14Å; L149-F153 PolarHBondContact O-N 3.32Å
150W91.4Very high91.9Very high2 Ų264.4 Ų64.41%0.00831%0.312CS..Hα-helixtrans-61.6-47.9178.7-172.197.3000111.6F77 L80 N81 I89 F93 F146 L147 F148 W152 F153 L154F77-W150 AromaticContact CE2-CD1 3.95Å; F77-W150 HydrophobicContact CE2-CD2 4.39Å; F77-W150 AromaticContact CE2-CE2 3.86Å; F77-W150 HydrophobicContact CE2-CG 4.43Å; F77-W150 HydrophobicContact CE2-CZ2 4.33Å; F77-W150 AromaticContact CE2-NE1 3.58Å; F77-W150 AromaticContact CZ-CE2 3.92Å; F77-W150 HydrophobicContact CZ-CZ2 4.03Å; F77-W150 AromaticContact CZ-NE1 3.68Å; L80-W150 HydrophobicContact CD2-CB 4.13Å; L80-W150 HydrophobicContact CD2-CG 4.47Å; N81-W150 PolarHBondContact OD1-NE1 2.87Å; I89-W150 WeakPolarHBondContact O-CZ2 3.23Å; F93-W150 AromaticContact CD2-CH2 3.44Å; F93-W150 HydrophobicContact CD2-CH2 3.44Å; F93-W150 VanDerWaalsContact CD2-CH2 3.44Å; F93-W150 HydrophobicContact CD2-CZ2 4.41Å; F93-W150 HydrophobicContact CD2-CZ3 4.06Å; F93-W150 AromaticContact CE2-CH2 3.49Å; F93-W150 HydrophobicContact CE2-CH2 3.49Å; F93-W150 VanDerWaalsContact CE2-CH2 3.49Å; F93-W150 HydrophobicContact CE2-CZ3 4.01Å; F93-W150 HydrophobicContact CG-CH2 4.15Å; F93-W150 HydrophobicContact CG-CZ3 4.42Å; F93-W150 HydrophobicContact CZ-CH2 4.22Å; F93-W150 HydrophobicContact CZ-CZ3 4.3Å; F146-W150 VanDerWaalsContact O-CB 3.29Å; F146-W150 WeakPolarHBondContact O-CB 3.25Å; F146-W150 PolarHBondContact O-N 3.48Å; L147-W150 PolarHBondContact O-N 2.85Å; F148-W150 VanDerWaalsContact C-N 3.29Å; F148-W150 PolarHBondContact O-N 3.02Å; W150-W152 VanDerWaalsContact C-N 3.34Å; W150-W152 PolarHBondContact O-N 3.38Å; W150-F153 PolarHBondContact O-N 3.36Å; W150-L154 HydrophobicContact CE3-CD2 4.45Å; W150-L154 HydrophobicContact CH2-CD2 3.72Å; W150-L154 HydrophobicContact CZ3-CD2 3.62Å; W150-L154 WeakPolarHBondContact O-CB 3.48Å; W150-L154 PolarHBondContact O-N 3.23Å
151F92.2Very high92.2Very high50 Ų5062.1 Ų62.122%0.21930%0.304CS..Hα-helixtrans-66.3-36.4175.9-75.4-69.6000112.6F93 L96 L147 F148 T155F93-F151 HydrophobicContact CD1-CE1 4.19Å; F93-F151 HydrophobicContact CD1-CZ 4.5Å; F93-F151 AromaticContact CE1-CE1 3.96Å; F93-F151 HydrophobicContact CE1-CE1 3.96Å; L96-F151 HydrophobicContact CB-CE2 4.28Å; L96-F151 HydrophobicContact CB-CZ 4.01Å; L96-F151 HydrophobicContact CD2-CE1 4.31Å; L96-F151 HydrophobicContact CD2-CE2 4.12Å; L96-F151 HydrophobicContact CD2-CZ 3.54Å; L96-F151 HydrophobicContact CG-CZ 4.32Å; L147-F151 HydrophobicContact CD2-CD2 3.82Å; L147-F151 HydrophobicContact CD2-CE2 3.74Å; L147-F151 HydrophobicContact CG-CD2 4.24Å; L147-F151 HydrophobicContact CG-CE2 3.94Å; L147-F151 VanDerWaalsContact O-CD2 3.22Å; L147-F151 WeakPolarHBondContact O-CD2 3.44Å; L147-F151 PolarHBondContact O-N 2.88Å; F148-F151 PolarHBondContact O-N 3.31Å; F151-T155 WeakPolarHBondContact O-CB 3.48Å; F151-T155 PolarHBondContact O-N 3.38Å; F151-T155 PolarHBondContact O-OG1 3.45Å
152W93.2Very high92.4Very high145 Ų14562.5 Ų62.555%0.54931%0.305SS..Hα-helixtrans-61.8-53175.3178.8-95.7000111.7F148 L149 W150 L154 T155 V156F148-W152 HydrophobicContact CZ-CE3 4.43Å; F148-W152 WeakPolarHBondContact O-CB 3.12Å; F148-W152 PolarHBondContact O-N 3.23Å; L149-W152 PolarHBondContact O-N 3.41Å; W150-W152 VanDerWaalsContact C-N 3.34Å; W150-W152 PolarHBondContact O-N 3.38Å; W152-L154 VanDerWaalsContact C-N 3.33Å; W152-L154 PolarHBondContact O-N 2.83Å; W152-T155 PolarHBondContact O-N 3.43Å; W152-V156 HydrophobicContact CD2-CG2 4.34Å; W152-V156 HydrophobicContact CZ2-CG2 4.23Å; W152-V156 WeakPolarHBondContact O-CG2 3.35Å; W152-V156 PolarHBondContact O-N 2.93Å
153F92.4Very high92.6Very high43 Ų4362.5 Ų62.519%0.18931%0.306CS..Hα-helixtrans-63.6-37.4178.4-77.3-59.1000112.4I73 Q76 F77 L80 L149 W150 G157I73-F153 HydrophobicContact CD1-CD1 3.64Å; I73-F153 HydrophobicContact CD1-CE1 4.28Å; Q76-F153 HydrophobicContact CB-CE1 4.44Å; Q76-F153 VanDerWaalsContact OE1-CE1 3.22Å; F77-F153 HydrophobicContact CD2-CB 4.2Å; L80-F153 HydrophobicContact CD2-CD2 3.88Å; L149-F153 HydrophobicContact CB-CD2 4.29Å; L149-F153 HydrophobicContact CB-CE2 4.28Å; L149-F153 HydrophobicContact CD2-CE2 4.27Å; L149-F153 WeakPolarHBondContact O-CB 3.16Å; L149-F153 WeakPolarHBondContact O-CD2 3.14Å; L149-F153 PolarHBondContact O-N 3.32Å; W150-F153 PolarHBondContact O-N 3.36Å; F153-G157 WeakPolarHBondContact O-CA 3.25Å; F153-G157 PolarHBondContact O-N 3.31Å
154L92.1Very high92.8Very high44 Ų4461.9 Ų61.923%0.2330%0.303CS..Hα-helixtrans-60.5-47.8173.2-178.366.2000111F93 W150 W152 G157 I158F93-L154 HydrophobicContact CE2-CD2 4.07Å; F93-L154 HydrophobicContact CZ-CD2 3.98Å; W150-L154 HydrophobicContact CE3-CD2 4.45Å; W150-L154 HydrophobicContact CH2-CD2 3.72Å; W150-L154 HydrophobicContact CZ3-CD2 3.62Å; W150-L154 WeakPolarHBondContact O-CB 3.48Å; W150-L154 PolarHBondContact O-N 3.23Å; W152-L154 VanDerWaalsContact C-N 3.33Å; W152-L154 PolarHBondContact O-N 2.83Å; L154-G157 PolarHBondContact O-N 3.05Å; L154-I158 HydrophobicContact CD1-CD1 4.01Å; L154-I158 HydrophobicContact CD1-CG1 4.39Å; L154-I158 HydrophobicContact CG-CD1 3.9Å; L154-I158 WeakPolarHBondContact O-CB 3.49Å; L154-I158 WeakPolarHBondContact O-CG1 3.48Å; L154-I158 PolarHBondContact O-N 3.23Å
155T93.8Very high93Very high76 Ų7661.2 Ų61.247%0.46631%0.305SS..Hα-helixtrans-63.3-49.6-180-56.80000111.5F151 W152 G157 I158 L159F151-T155 WeakPolarHBondContact O-CB 3.48Å; F151-T155 PolarHBondContact O-N 3.38Å; F151-T155 PolarHBondContact O-OG1 3.45Å; W152-T155 PolarHBondContact O-N 3.43Å; T155-G157 VanDerWaalsContact C-N 3.31Å; T155-G157 PolarHBondContact O-N 3.41Å; T155-I158 PolarHBondContact O-N 2.89Å; T155-L159 HydrophobicContact CG2-CD1 4.19Å; T155-L159 WeakPolarHBondContact O-CG 3.03Å; T155-L159 PolarHBondContact O-N 3.16Å
156V95.4Very high93Very high45 Ų4563.5 Ų63.527%0.27331%0.309SS..Hα-helixtrans-62.9-39.4177.6173.30000111.2I73 W152 L159 T160I73-V156 HydrophobicContact CD1-CG1 4.05Å; I73-V156 HydrophobicContact CG1-CG1 4.44Å; W152-V156 HydrophobicContact CD2-CG2 4.34Å; W152-V156 HydrophobicContact CZ2-CG2 4.23Å; W152-V156 WeakPolarHBondContact O-CG2 3.35Å; W152-V156 PolarHBondContact O-N 2.93Å; V156-L159 PolarHBondContact O-N 3.25Å; V156-T160 VanDerWaalsContact O-CB 3.26Å; V156-T160 WeakPolarHBondContact O-CB 3.35Å; V156-T160 PolarHBondContact O-N 3.19Å; V156-T160 PolarHBondContact O-OG1 3.22Å
157G94.2Very high93Very high2 Ų262.4 Ų62.42%0.02131%0.305CS..Hα-helixtrans-60.9-50.2175.900000111.9F153 L154 T155 L159 T160 V161F153-G157 WeakPolarHBondContact O-CA 3.25Å; F153-G157 PolarHBondContact O-N 3.31Å; L154-G157 PolarHBondContact O-N 3.05Å; T155-G157 VanDerWaalsContact C-N 3.31Å; T155-G157 PolarHBondContact O-N 3.41Å; G157-L159 PolarHBondContact O-N 3.34Å; G157-T160 PolarHBondContact O-N 3.21Å; G157-V161 WeakPolarHBondContact O-CB 3.08Å; G157-V161 VanDerWaalsContact O-CG2 3.26Å; G157-V161 WeakPolarHBondContact O-CG2 3.42Å; G157-V161 PolarHBondContact O-N 2.86Å
158I94.5Very high92.9Very high78 Ų7863.6 Ų63.640%0.431%0.31SS..Hα-helixtrans-57.9-50.9177.1-71.8169.4000110.7L154 T155 T160 V161 F162L154-I158 HydrophobicContact CD1-CD1 4.01Å; L154-I158 HydrophobicContact CD1-CG1 4.39Å; L154-I158 HydrophobicContact CG-CD1 3.9Å; L154-I158 WeakPolarHBondContact O-CB 3.49Å; L154-I158 WeakPolarHBondContact O-CG1 3.48Å; L154-I158 PolarHBondContact O-N 3.23Å; T155-I158 PolarHBondContact O-N 2.89Å; I158-T160 VanDerWaalsContact C-N 3.33Å; I158-T160 PolarHBondContact O-N 2.99Å; I158-V161 PolarHBondContact O-N 3.18Å; I158-F162 HydrophobicContact CG2-CD2 3.42Å; I158-F162 VanDerWaalsContact CG2-CD2 3.42Å; I158-F162 HydrophobicContact CG2-CE2 3.37Å; I158-F162 WeakPolarHBondContact O-CB 3.21Å; I158-F162 WeakPolarHBondContact O-CD2 3.3Å; I158-F162 PolarHBondContact O-N 3.49Å
159L96Very high92.8Very high114 Ų11462.1 Ų62.160%0.59731%0.307SS*.Hα-helixtrans-60.8-41.1179.5-69.7174000112.3T155 V156 G157 N163T155-L159 HydrophobicContact CG2-CD1 4.19Å; T155-L159 WeakPolarHBondContact O-CG 3.03Å; T155-L159 PolarHBondContact O-N 3.16Å; V156-L159 PolarHBondContact O-N 3.25Å; G157-L159 PolarHBondContact O-N 3.34Å; L159-N163 WeakPolarHBondContact O-CB 3.18Å; L159-N163 PolarHBondContact O-N 3.38Å
160T94.9Very high92.5Very high39 Ų3960.7 Ų60.724%0.23930%0.3CS..Hα-helixtrans-68.9-42.7-179.9-59.10000111.8I73 V156 G157 I158 N163 T164I73-T160 HydrophobicContact CG2-CG2 4.42Å; V156-T160 VanDerWaalsContact O-CB 3.26Å; V156-T160 WeakPolarHBondContact O-CB 3.35Å; V156-T160 PolarHBondContact O-N 3.19Å; V156-T160 PolarHBondContact O-OG1 3.22Å; G157-T160 PolarHBondContact O-N 3.21Å; I158-T160 VanDerWaalsContact C-N 3.33Å; I158-T160 PolarHBondContact O-N 2.99Å; T160-N163 PolarHBondContact O-N 3.26Å; T160-T164 VanDerWaalsContact O-CB 3.31Å; T160-T164 WeakPolarHBondContact O-CB 3.07Å; T160-T164 PolarHBondContact O-N 3.23Å; T160-T164 PolarHBondContact O-OG1 3.41Å
161V93.9Very high92.2Very high52 Ų5261.9 Ų61.932%0.31531%0.306SS..Hα-helixtrans-65.8-48.4177.3172.30000110.1S70 G157 I158 N163 T164 V165S70-V161 WeakPolarHBondContact OG-CG2 3.28Å; G157-V161 WeakPolarHBondContact O-CB 3.08Å; G157-V161 VanDerWaalsContact O-CG2 3.26Å; G157-V161 WeakPolarHBondContact O-CG2 3.42Å; G157-V161 PolarHBondContact O-N 2.86Å; I158-V161 PolarHBondContact O-N 3.18Å; V161-N163 VanDerWaalsContact C-N 3.33Å; V161-N163 PolarHBondContact O-N 2.89Å; V161-T164 PolarHBondContact O-N 3.46Å; V161-T164 VanDerWaalsContact O-N 3.17Å; V161-V165 HydrophobicContact CG1-CG2 4.25Å; V161-V165 WeakPolarHBondContact O-CB 3.42Å; V161-V165 VanDerWaalsContact O-CG2 3.31Å; V161-V165 WeakPolarHBondContact O-CG2 3.39Å; V161-V165 PolarHBondContact O-N 2.73Å
162F95.3Very high91.6Very high145 Ų14565.1 Ų65.164%0.63633%0.325SS*.Hα-helixtrans-59.6-43.3176.5-82.9-59.3000112.1I158 V165 Y166I158-F162 HydrophobicContact CG2-CD2 3.42Å; I158-F162 VanDerWaalsContact CG2-CD2 3.42Å; I158-F162 HydrophobicContact CG2-CE2 3.37Å; I158-F162 WeakPolarHBondContact O-CB 3.21Å; I158-F162 WeakPolarHBondContact O-CD2 3.3Å; I158-F162 PolarHBondContact O-N 3.49Å; F162-V165 PolarHBondContact O-N 3.3Å; F162-Y166 VanDerWaalsContact O-CB 3.25Å; F162-Y166 WeakPolarHBondContact O-CB 3.47Å; F162-Y166 PolarHBondContact O-N 3.04Å
163N93.5Very high91.1Very high50 Ų5062.5 Ų62.527%0.26732%0.321SS..Hα-helixtrans-61.4-45.6175.8-171.5-88000111.1K66 L159 T160 V161 Y166 W167K66-N163 PolarHBondContact NZ-OD1 3.48Å; L159-N163 WeakPolarHBondContact O-CB 3.18Å; L159-N163 PolarHBondContact O-N 3.38Å; T160-N163 PolarHBondContact O-N 3.26Å; V161-N163 VanDerWaalsContact C-N 3.33Å; V161-N163 PolarHBondContact O-N 2.89Å; N163-Y166 PolarHBondContact O-N 3.36Å; N163-W167 PolarHBondContact O-N 3.38Å; N163-W167 VanDerWaalsContact OD1-CD1 3.25Å
164T91.6Very high90.2Very high5 Ų564 Ų643%0.03134%0.336CS..Hα-helixtrans-63.2-45.8179.4-600000111.4K66 L67 T160 V161 W167 M168K66-T164 HydrophobicContact CB-CG2 4.01Å; L67-T164 HydrophobicContact CD2-CG2 4.11Å; T160-T164 VanDerWaalsContact O-CB 3.31Å; T160-T164 WeakPolarHBondContact O-CB 3.07Å; T160-T164 PolarHBondContact O-N 3.23Å; T160-T164 PolarHBondContact O-OG1 3.41Å; V161-T164 PolarHBondContact O-N 3.46Å; V161-T164 VanDerWaalsContact O-N 3.17Å; T164-W167 PolarHBondContact O-N 3.08Å; T164-M168 HydrophobicContact CG2-CG 4.39Å; T164-M168 WeakPolarHBondContact O-CB 3.36Å; T164-M168 VanDerWaalsContact O-CG 3.23Å; T164-M168 WeakPolarHBondContact O-CG 3.42Å; T164-M168 PolarHBondContact O-N 3.35Å
165V92.7Very high89.5Confident65 Ų6567.7 Ų67.739%0.39436%0.356SS..Hα-helixtrans-62.9-45176.7172.60000111V161 F162 W167 M168 L169V161-V165 HydrophobicContact CG1-CG2 4.25Å; V161-V165 WeakPolarHBondContact O-CB 3.42Å; V161-V165 VanDerWaalsContact O-CG2 3.31Å; V161-V165 WeakPolarHBondContact O-CG2 3.39Å; V161-V165 PolarHBondContact O-N 2.73Å; F162-V165 PolarHBondContact O-N 3.3Å; V165-W167 PolarHBondContact O-N 3.02Å; V165-M168 PolarHBondContact O-N 3.4Å; V165-L169 HydrophobicContact CG1-CD1 3.89Å; V165-L169 HydrophobicContact CG1-CG 4.26Å; V165-L169 WeakPolarHBondContact O-CB 3.35Å; V165-L169 VanDerWaalsContact O-CG 3.31Å; V165-L169 WeakPolarHBondContact O-CG 3.47Å; V165-L169 PolarHBondContact O-N 2.97Å
166Y92.2Very high88.9Confident134 Ų13468.5 Ų68.553%0.52535%0.354SS..Hα-helixtrans-57-48.5175.5173-95.5000111.6F162 N163 L169 I170F162-Y166 VanDerWaalsContact O-CB 3.25Å; F162-Y166 WeakPolarHBondContact O-CB 3.47Å; F162-Y166 PolarHBondContact O-N 3.04Å; N163-Y166 PolarHBondContact O-N 3.36Å; Y166-L169 PolarHBondContact O-N 3.04Å; Y166-I170 HydrophobicContact CE1-CD1 4.46Å; Y166-I170 WeakPolarHBondContact O-CB 3.3Å; Y166-I170 WeakPolarHBondContact O-CG2 3.27Å; Y166-I170 PolarHBondContact O-N 2.93Å
167W89.5Confident88.3Confident9 Ų966.5 Ų66.53%0.03434%0.343CS..Hα-helixtrans-66.5-36.6177.5-81.5101000112.4Y62 N163 T164 V165 I170 L171 R219 Y223Y62-W167 HydrophobicContact CE1-CB 4.48Å; Y62-W167 HydrophobicContact CE1-CD2 4.25Å; Y62-W167 HydrophobicContact CE1-CE3 4.19Å; Y62-W167 HydrophobicContact CE1-CG 4.38Å; N163-W167 PolarHBondContact O-N 3.38Å; N163-W167 VanDerWaalsContact OD1-CD1 3.25Å; T164-W167 PolarHBondContact O-N 3.08Å; V165-W167 PolarHBondContact O-N 3.02Å; W167-I170 HydrophobicContact CE3-CG2 4.05Å; W167-I170 WeakPolarHBondContact O-CG2 3.41Å; W167-L171 HydrophobicContact CE3-CD1 4.32Å; W167-L171 HydrophobicContact CE3-CG 4.44Å; W167-L171 VanDerWaalsContact O-CB 3.28Å; W167-L171 WeakPolarHBondContact O-CB 3.31Å; W167-L171 WeakPolarHBondContact O-CD1 3.14Å; W167-L171 WeakPolarHBondContact O-CG 3.39Å; W167-L171 PolarHBondContact O-N 3.23Å; W167-L171 VanDerWaalsContact O-N 3.08Å; W167-R219 HydrophobicContact CH2-CG 4.06Å; W167-R219 HydrophobicContact CZ3-CG 3.89Å; W167-Y223 HydrophobicContact CH2-CD1 4.45Å; W167-Y223 HydrophobicContact CH2-CG 4.24Å; W167-Y223 AromaticContact CZ2-CD1 3.84Å; W167-Y223 HydrophobicContact CZ2-CD1 3.84Å; W167-Y223 HydrophobicContact CZ2-CD2 4.25Å; W167-Y223 HydrophobicContact CZ2-CE1 4.21Å; W167-Y223 AromaticContact CZ2-CG 3.86Å; W167-Y223 HydrophobicContact CZ2-CG 3.86Å
168M88Confident87.9Confident52 Ų5267.3 Ų67.326%0.25635%0.346SS..Hα-helixtrans-65-47.4174.9-72.6-132.7-73.500111.5I63 L67 T164 V165 I170 L171 L172I63-M168 HydrophobicContact CG2-CG 4.15Å; I63-M168 HydrophobicContact CG2-SD 3.51Å; I63-M168 VanDerWaalsContact CG2-SD 3.51Å; L67-M168 HydrophobicContact CD1-SD 4.37Å; L67-M168 HydrophobicContact CD2-CE 3.87Å; L67-M168 HydrophobicContact CD2-SD 4.22Å; L67-M168 HydrophobicContact CG-SD 4.43Å; T164-M168 HydrophobicContact CG2-CG 4.39Å; T164-M168 WeakPolarHBondContact O-CB 3.36Å; T164-M168 VanDerWaalsContact O-CG 3.23Å; T164-M168 WeakPolarHBondContact O-CG 3.42Å; T164-M168 PolarHBondContact O-N 3.35Å; V165-M168 PolarHBondContact O-N 3.4Å; M168-I170 PolarHBondContact O-N 2.97Å; M168-L171 PolarHBondContact O-N 3.04Å; M168-L172 HydrophobicContact CB-CD1 4.36Å; M168-L172 VanDerWaalsContact O-CB 3.25Å; M168-L172 WeakPolarHBondContact O-CB 3.34Å; M168-L172 WeakPolarHBondContact O-CG 3.39Å; M168-L172 PolarHBondContact O-N 3.38Å
169L89.4Confident87.4Confident101 Ų10166.5 Ų66.553%0.52935%0.347SS..Hα-helixtrans-60.6-45.5178.4-70.3172.5000111.4V165 Y166 L171 L173V165-L169 HydrophobicContact CG1-CD1 3.89Å; V165-L169 HydrophobicContact CG1-CG 4.26Å; V165-L169 WeakPolarHBondContact O-CB 3.35Å; V165-L169 VanDerWaalsContact O-CG 3.31Å; V165-L169 WeakPolarHBondContact O-CG 3.47Å; V165-L169 PolarHBondContact O-N 2.97Å; Y166-L169 PolarHBondContact O-N 3.04Å; L169-L171 VanDerWaalsContact C-N 3.31Å; L169-L171 PolarHBondContact O-N 2.98Å; L169-L173 WeakPolarHBondContact O-CB 3.35Å; L169-L173 WeakPolarHBondContact O-CD1 3.23Å; L169-L173 WeakPolarHBondContact O-CG 3.44Å; L169-L173 PolarHBondContact O-N 3.07Å
170I86.7Confident86.9Confident24 Ų2462.5 Ų62.512%0.12333%0.325CS..Hα-helixtrans-70.5-28.7-176.4-145.3-170.3000112.5Y166 W167 M168 Q176 R219Y166-I170 HydrophobicContact CE1-CD1 4.46Å; Y166-I170 WeakPolarHBondContact O-CB 3.3Å; Y166-I170 WeakPolarHBondContact O-CG2 3.27Å; Y166-I170 PolarHBondContact O-N 2.93Å; W167-I170 HydrophobicContact CE3-CG2 4.05Å; W167-I170 WeakPolarHBondContact O-CG2 3.41Å; M168-I170 PolarHBondContact O-N 2.97Å; I170-Q176 HydrophobicContact CG1-CB 4.35Å; I170-R219 VanDerWaalsContact C-NH1 3.28Å; I170-R219 VanDerWaalsContact CD1-CZ 3.44Å; I170-R219 PolarHBondContact O-NH1 3.13Å
171L83.7Confident86.5Confident26 Ų2660.7 Ų60.714%0.13631%0.314CS..Hα-helixtrans-85.1-35.2178.4-66.3171.4000113.3T59 Y62 I63 W167 M168 L169 F216T59-L171 HydrophobicContact CG2-CB 4.28Å; T59-L171 HydrophobicContact CG2-CD1 4.17Å; T59-L171 HydrophobicContact CG2-CD2 4.26Å; T59-L171 HydrophobicContact CG2-CG 4.46Å; Y62-L171 HydrophobicContact CD1-CD1 4.07Å; Y62-L171 HydrophobicContact CE1-CD1 4.35Å; I63-L171 HydrophobicContact CD1-CB 4.31Å; I63-L171 HydrophobicContact CD1-CD1 4.12Å; I63-L171 HydrophobicContact CG1-CD1 3.9Å; W167-L171 HydrophobicContact CE3-CD1 4.32Å; W167-L171 HydrophobicContact CE3-CG 4.44Å; W167-L171 VanDerWaalsContact O-CB 3.28Å; W167-L171 WeakPolarHBondContact O-CB 3.31Å; W167-L171 WeakPolarHBondContact O-CD1 3.14Å; W167-L171 WeakPolarHBondContact O-CG 3.39Å; W167-L171 PolarHBondContact O-N 3.23Å; W167-L171 VanDerWaalsContact O-N 3.08Å; M168-L171 PolarHBondContact O-N 3.04Å; L169-L171 VanDerWaalsContact C-N 3.31Å; L169-L171 PolarHBondContact O-N 2.98Å; L171-F216 HydrophobicContact CD1-CD2 4.08Å; L171-F216 HydrophobicContact CD1-CE2 4.18Å; L171-F216 HydrophobicContact CD2-CB 4.13Å; L171-F216 HydrophobicContact CD2-CD2 3.43Å; L171-F216 VanDerWaalsContact CD2-CD2 3.43Å; L171-F216 HydrophobicContact CD2-CE2 4.26Å; L171-F216 HydrophobicContact CD2-CG 4.18Å; L171-F216 HydrophobicContact CG-CD2 4.41Å
172L80.1Confident86.2Confident119 Ų11961.1 Ų61.162%0.62331%0.31SS*.Hα-helixtrans-76.9-25.4-179.6-68.2171.7000112.6M168 P174M168-L172 HydrophobicContact CB-CD1 4.36Å; M168-L172 VanDerWaalsContact O-CB 3.25Å; M168-L172 WeakPolarHBondContact O-CB 3.34Å; M168-L172 WeakPolarHBondContact O-CG 3.39Å; M168-L172 PolarHBondContact O-N 3.38Å; L172-P174 WeakPolarHBondContact O-CD 3.31Å
173L82.5Confident85.7Confident89 Ų8960.5 Ų60.547%0.46631%0.307SS..  trans-86.4103.6179.3-65.8173.4000111.1L169 N175 Q176L169-L173 WeakPolarHBondContact O-CB 3.35Å; L169-L173 WeakPolarHBondContact O-CD1 3.23Å; L169-L173 WeakPolarHBondContact O-CG 3.44Å; L169-L173 PolarHBondContact O-N 3.07Å; L173-N175 PolarHBondContact O-N 3.29Å; L173-Q176 HydrophobicContact CB-CB 4.3Å; L173-Q176 HydrophobicContact CB-CG 3.74Å; L173-Q176 HydrophobicContact CD1-CG 4.08Å; L173-Q176 PolarHBondContact O-N 2.97Å; L173-Q176 VanDerWaalsContact O-N 3.16Å
174P73.7Confident85.3Confident76 Ų7658.7 Ų58.749%0.49430%0.297SS..Hα-helixtrans-63.2-31.4-179.326.5-35.3000112.3L172 Q176 G177 I178L172-P174 WeakPolarHBondContact O-CD 3.31Å; P174-Q176 PolarHBondContact O-N 3.21Å; P174-G177 WeakPolarHBondContact O-CA 3.43Å; P174-G177 PolarHBondContact O-N 2.83Å; P174-I178 PolarHBondContact O-N 3.29Å
175N78.5Confident84.9Confident121 Ų12158.6 Ų58.665%0.64730%0.296SS*.Hα-helixtrans-60.5-34179-65.6-3.8000112.2L173 G177 S179L173-N175 PolarHBondContact O-N 3.29Å; N175-G177 VanDerWaalsContact C-N 3.31Å; N175-S179 WeakPolarHBondContact O-CB 3.48Å; N175-S179 PolarHBondContact O-N 3.49Å
176Q81.6Confident84.4Confident92 Ų9263.7 Ų63.743%0.4331%0.308SS..Hα-helixtrans-70.2-31.1176.8-63.5-63.989.200111.5I170 L173 P174 F180 R219I170-Q176 HydrophobicContact CG1-CB 4.35Å; L173-Q176 HydrophobicContact CB-CB 4.3Å; L173-Q176 HydrophobicContact CB-CG 3.74Å; L173-Q176 HydrophobicContact CD1-CG 4.08Å; L173-Q176 PolarHBondContact O-N 2.97Å; L173-Q176 VanDerWaalsContact O-N 3.16Å; P174-Q176 PolarHBondContact O-N 3.21Å; Q176-F180 WeakPolarHBondContact O-CB 3.48Å; Q176-F180 PolarHBondContact O-N 3.3Å; Q176-R219 PolarHBondContact O-NH2 2.84Å
177G82.1Confident83.6Confident3 Ų362.8 Ų62.83%0.03131%0.31CS..Hα-helixtrans-64.9-49.9174.200000111.9P174 N175 S179 F180 V181P174-G177 WeakPolarHBondContact O-CA 3.43Å; P174-G177 PolarHBondContact O-N 2.83Å; N175-G177 VanDerWaalsContact C-N 3.31Å; G177-S179 PolarHBondContact O-N 2.8Å; G177-F180 WeakPolarHBondContact O-CB 3.43Å; G177-F180 PolarHBondContact O-N 3.36Å; G177-V181 PolarHBondContact O-N 3.11Å; G177-V181 VanDerWaalsContact O-N 3.08Å
178I84.7Confident82.8Confident20 Ų2065.3 Ų65.310%0.10332%0.324CS..Hα-helixtrans-62.2-45.6178.2-60.6166.5000110.6P174 F180 V181 R182 L202 K203 V206P174-I178 PolarHBondContact O-N 3.29Å; I178-F180 VanDerWaalsContact C-N 3.27Å; I178-F180 PolarHBondContact O-N 3.39Å; I178-V181 PolarHBondContact O-N 2.83Å; I178-R182 VanDerWaalsContact O-CB 3.3Å; I178-R182 WeakPolarHBondContact O-CB 3.28Å; I178-R182 PolarHBondContact O-N 3.47Å; I178-L202 HydrophobicContact CG2-CD2 4.13Å; I178-L202 HydrophobicContact CG2-CG 4.5Å; I178-K203 HydrophobicContact CD1-CG 4.33Å; I178-V206 HydrophobicContact CG1-CB 4.27Å; I178-V206 HydrophobicContact CG1-CG1 3.8Å; I178-V206 HydrophobicContact CG1-CG2 4.44Å
179S85.5Confident81.8Confident60 Ų6064.6 Ų64.642%0.4232%0.324SS..Hα-helixtrans-64.4-32.8179-169.50000112.9N175 G177 K183N175-S179 WeakPolarHBondContact O-CB 3.48Å; N175-S179 PolarHBondContact O-N 3.49Å; G177-S179 PolarHBondContact O-N 2.8Å; S179-K183 PolarHBondContact O-N 2.99Å; S179-K183 VanDerWaalsContact O-N 3.13Å
180F85.8Confident80.5Confident31 Ų3167 Ų6714%0.13634%0.337CS..Hα-helixtrans-65-55.3175.4175-90.3000110.4Q176 G177 I178 R182 K183 Y184 L218 R219 S222Q176-F180 WeakPolarHBondContact O-CB 3.48Å; Q176-F180 PolarHBondContact O-N 3.3Å; G177-F180 WeakPolarHBondContact O-CB 3.43Å; G177-F180 PolarHBondContact O-N 3.36Å; I178-F180 VanDerWaalsContact C-N 3.27Å; I178-F180 PolarHBondContact O-N 3.39Å; F180-R182 VanDerWaalsContact C-N 3.3Å; F180-R182 PolarHBondContact O-N 3.43Å; F180-K183 WeakPolarHBondContact O-CB 3.28Å; F180-K183 PolarHBondContact O-N 3.44Å; F180-Y184 HydrophobicContact CD1-CD2 4.05Å; F180-Y184 HydrophobicContact CD1-CE2 4.1Å; F180-Y184 HydrophobicContact CD2-CD2 4.35Å; F180-Y184 AromaticContact CD2-CE2 3.73Å; F180-Y184 HydrophobicContact CD2-CE2 3.73Å; F180-Y184 AromaticContact CE1-CD2 3.82Å; F180-Y184 HydrophobicContact CE1-CD2 3.82Å; F180-Y184 AromaticContact CE1-CE2 3.66Å; F180-Y184 HydrophobicContact CE1-CE2 3.66Å; F180-Y184 HydrophobicContact CE2-CD2 4.18Å; F180-Y184 AromaticContact CE2-CE2 3.29Å; F180-Y184 HydrophobicContact CE2-CE2 3.29Å; F180-Y184 HydrophobicContact CG-CD2 4.3Å; F180-Y184 HydrophobicContact CG-CE2 4.13Å; F180-Y184 AromaticContact CZ-CD2 3.89Å; F180-Y184 HydrophobicContact CZ-CD2 3.89Å; F180-Y184 AromaticContact CZ-CE2 3.22Å; F180-Y184 HydrophobicContact CZ-CE2 3.22Å; F180-Y184 AromaticContact CZ-CZ 3.89Å; F180-Y184 VanDerWaalsContact O-CD2 3.3Å; F180-Y184 WeakPolarHBondContact O-CD2 3.28Å; F180-Y184 PolarHBondContact O-N 3.34Å; F180-L218 HydrophobicContact CE1-CB 4.36Å; F180-R219 HydrophobicContact CE2-CG 4.43Å; F180-R219 HydrophobicContact CZ-CB 4.27Å; F180-S222 WeakPolarHBondContact CZ-OG 3.43Å
181V86Confident79Confident0 Ų075.2 Ų75.20%038%0.375CS..Hα-helixtrans-59.2-42.8179.3177.10000111.1G177 I178 K183 Y184 L185 L202 F205 V206 L210 V234G177-V181 PolarHBondContact O-N 3.11Å; G177-V181 VanDerWaalsContact O-N 3.08Å; I178-V181 PolarHBondContact O-N 2.83Å; V181-K183 VanDerWaalsContact C-N 3.27Å; V181-K183 PolarHBondContact O-N 2.82Å; V181-Y184 PolarHBondContact O-N 3.43Å; V181-L185 HydrophobicContact CG1-CD1 3.78Å; V181-L185 HydrophobicContact CG1-CG 4.36Å; V181-L185 PolarHBondContact O-N 2.86Å; V181-L202 HydrophobicContact CG1-CD1 4.06Å; V181-F205 HydrophobicContact CG1-CD1 4.29Å; V181-F205 HydrophobicContact CG1-CE1 3.98Å; V181-V206 HydrophobicContact CB-CG2 4.26Å; V181-V206 HydrophobicContact CG1-CG2 4.32Å; V181-V206 HydrophobicContact CG2-CG2 4.26Å; V181-L210 HydrophobicContact CG2-CD2 4.26Å; V181-V234 HydrophobicContact CG1-CG1 4.25Å
182R86.3Confident77.5Confident62 Ų6277.9 Ų77.923%0.23440%0.396CS..Hα-helixtrans-56.9-39.8175.5-168.8-171.8-73.2133.2-1.6112.3I178 F180 R186 E199 L202I178-R182 VanDerWaalsContact O-CB 3.3Å; I178-R182 WeakPolarHBondContact O-CB 3.28Å; I178-R182 PolarHBondContact O-N 3.47Å; F180-R182 VanDerWaalsContact C-N 3.3Å; F180-R182 PolarHBondContact O-N 3.43Å; R182-R186 WeakPolarHBondContact O-CB 3.47Å; R182-R186 VanDerWaalsContact O-CG 3.27Å; R182-R186 WeakPolarHBondContact O-CG 3.25Å; R182-R186 PolarHBondContact O-N 3.23Å; R182-E199 IonicContact CZ-OE1 3.37Å; R182-E199 IonicContact CZ-OE2 3.69Å; R182-E199 IonicContact NE-OE1 2.99Å; R182-E199 PolarHBondContact NE-OE1 3.33Å; R182-E199 IonicContact NE-OE2 3.99Å; R182-E199 VanDerWaalsContact NH2-CD 3.27Å; R182-E199 IonicContact NH2-OE1 3.07Å; R182-E199 PolarHBondContact NH2-OE1 3.21Å; R182-E199 VanDerWaalsContact NH2-OE1 3.07Å; R182-E199 IonicContact NH2-OE2 2.66Å; R182-E199 PolarHBondContact NH2-OE2 3.49Å; R182-L202 HydrophobicContact CB-CD2 4.08Å; R182-L202 HydrophobicContact CG-CD2 4.23Å
183K85.6Confident76.1Confident131 Ų13178.1 Ų78.157%0.5741%0.407SS*.Hα-helixtrans-65.6-43178.9-174.7-174.6173.7-168.30111.6S179 F180 V181 M187S179-K183 PolarHBondContact O-N 2.99Å; S179-K183 VanDerWaalsContact O-N 3.13Å; F180-K183 WeakPolarHBondContact O-CB 3.28Å; F180-K183 PolarHBondContact O-N 3.44Å; V181-K183 VanDerWaalsContact C-N 3.27Å; V181-K183 PolarHBondContact O-N 2.82Å; K183-M187 PolarHBondContact O-N 2.87Å
184Y85.5Confident74.8Confident13 Ų1383.9 Ų83.95%0.05142%0.423CS..Hα-helixtrans-68.6-42.1178.8-78-82.4000112.3F180 V181 R186 M187 L188 E227 C230F180-Y184 HydrophobicContact CD1-CD2 4.05Å; F180-Y184 HydrophobicContact CD1-CE2 4.1Å; F180-Y184 HydrophobicContact CD2-CD2 4.35Å; F180-Y184 AromaticContact CD2-CE2 3.73Å; F180-Y184 HydrophobicContact CD2-CE2 3.73Å; F180-Y184 AromaticContact CE1-CD2 3.82Å; F180-Y184 HydrophobicContact CE1-CD2 3.82Å; F180-Y184 AromaticContact CE1-CE2 3.66Å; F180-Y184 HydrophobicContact CE1-CE2 3.66Å; F180-Y184 HydrophobicContact CE2-CD2 4.18Å; F180-Y184 AromaticContact CE2-CE2 3.29Å; F180-Y184 HydrophobicContact CE2-CE2 3.29Å; F180-Y184 HydrophobicContact CG-CD2 4.3Å; F180-Y184 HydrophobicContact CG-CE2 4.13Å; F180-Y184 AromaticContact CZ-CD2 3.89Å; F180-Y184 HydrophobicContact CZ-CD2 3.89Å; F180-Y184 AromaticContact CZ-CE2 3.22Å; F180-Y184 HydrophobicContact CZ-CE2 3.22Å; F180-Y184 AromaticContact CZ-CZ 3.89Å; F180-Y184 VanDerWaalsContact O-CD2 3.3Å; F180-Y184 WeakPolarHBondContact O-CD2 3.28Å; F180-Y184 PolarHBondContact O-N 3.34Å; V181-Y184 PolarHBondContact O-N 3.43Å; Y184-R186 PolarHBondContact O-N 2.78Å; Y184-M187 PolarHBondContact O-N 2.79Å; Y184-L188 PolarHBondContact O-N 2.98Å; Y184-E227 HydrophobicContact CE1-CB 4.28Å; Y184-C230 HydrophobicContact CE1-CB 4.37Å
185L83.4Confident73.9Confident2 Ų283 Ų831%0.0141%0.413CS..Hα-helixtrans-63.4-41.2176.1-71.3169.6000111.7V181 M187 L188 C189 M195 L202 V234 W238V181-L185 HydrophobicContact CG1-CD1 3.78Å; V181-L185 HydrophobicContact CG1-CG 4.36Å; V181-L185 PolarHBondContact O-N 2.86Å; L185-M187 VanDerWaalsContact C-N 3.27Å; L185-M187 PolarHBondContact O-N 3.05Å; L185-L188 PolarHBondContact O-N 3.35Å; L185-C189 VanDerWaalsContact O-CB 3.25Å; L185-C189 WeakPolarHBondContact O-CB 3.47Å; L185-C189 PolarHBondContact O-N 2.77Å; L185-M195 HydrophobicContact CB-CE 4.36Å; L185-M195 HydrophobicContact CD1-CE 3.91Å; L185-L202 HydrophobicContact CD1-CD1 3.81Å; L185-V234 HydrophobicContact CD2-CG1 3.8Å; L185-V234 HydrophobicContact CG-CG1 3.87Å; L185-W238 HydrophobicContact CD1-CD2 4.09Å; L185-W238 HydrophobicContact CD1-CE3 3.96Å; L185-W238 HydrophobicContact CD1-CG 4.5Å; L185-W238 HydrophobicContact CD1-CZ3 4.41Å; L185-W238 HydrophobicContact CD2-CB 3.91Å; L185-W238 HydrophobicContact CD2-CD2 4.26Å; L185-W238 HydrophobicContact CD2-CG 3.82Å
186R81.6Confident72.7Confident172 Ų17284 Ų8465%0.64942%0.423SS*.Hα-helixtrans-63-31.3175.8-77.2178.9-177.2-164.5-0.4113.6R182 Y184R182-R186 WeakPolarHBondContact O-CB 3.47Å; R182-R186 VanDerWaalsContact O-CG 3.27Å; R182-R186 WeakPolarHBondContact O-CG 3.25Å; R182-R186 PolarHBondContact O-N 3.23Å; Y184-R186 PolarHBondContact O-N 2.78Å
187M76.1Confident71.4Confident116 Ų11685.3 Ų85.357%0.57144%0.438SS*.Hα-helixtrans-71.5-31-178.6-169.9178.4-73.900112.5K183 Y184 L185K183-M187 PolarHBondContact O-N 2.87Å; Y184-M187 PolarHBondContact O-N 2.79Å; L185-M187 VanDerWaalsContact C-N 3.27Å; L185-M187 PolarHBondContact O-N 3.05Å
188L72.7Confident70.9Confident61 Ų6187.1 Ų87.132%0.31945%0.447SS..Hα-helixtrans-99.6-27.4-178.4-70.5171.1000113.6Y184 L185 D190 S231 L235Y184-L188 PolarHBondContact O-N 2.98Å; L185-L188 PolarHBondContact O-N 3.35Å; L188-D190 PolarHBondContact O-N 3.2Å; L188-S231 WeakPolarHBondContact CD1-O 3.42Å; L188-L235 HydrophobicContact CD1-CB 4.03Å; L188-L235 HydrophobicContact CD1-CD2 4.33Å
189C66.3Low70.7Confident38 Ų3889.6 Ų89.626%0.25746%0.458SS..  trans-91.221.9-174.9-67.60000115.2L185 Q191 S192L185-C189 VanDerWaalsContact O-CB 3.25Å; L185-C189 WeakPolarHBondContact O-CB 3.47Å; L185-C189 PolarHBondContact O-N 2.77Å; C189-Q191 PolarHBondContact O-N 2.94Å; C189-S192 PolarHBondContact O-N 2.82Å
190D62.1Low70.5Confident152 Ų15291.9 Ų91.981%0.81347%0.469SS*.THydrogen-bonded Turntrans-52.8-16.4178.6-165.148.8000113.7L188L188-D190 PolarHBondContact O-N 3.2Å
191Q55.7Low70.5Confident195 Ų19591.8 Ų91.891%0.91147%0.472SS*.THydrogen-bonded Turntrans-97.8-6.1179.2-69.9-170.6-30.600116.6C189C189-Q191 PolarHBondContact O-N 2.94Å
192S52.3Low70.5Confident82 Ų8291.9 Ų91.957%0.57347%0.472SS*.  trans-113.498.5-178.3-169.50000112.7C189 R194C189-S192 PolarHBondContact O-N 2.82Å; S192-R194 PolarHBondContact O-N 3.43Å
193S50.6Low70.4Confident124 Ų12494 Ų9487%0.86748%0.483SS*.THydrogen-bonded Turntrans-6742-179.554.70000115.6
194R54.9Low70.4Confident210 Ų21091.9 Ų91.979%0.79247%0.474SS*.THydrogen-bonded Turntrans-137.34-176.7-84-170.5160.1-179.2-5.7118.3S192 T196S192-R194 PolarHBondContact O-N 3.43Å; R194-T196 VanDerWaalsContact C-N 3.29Å; R194-T196 PolarHBondContact O-N 2.87Å
195M55.2Low70.4Confident59 Ų5991.3 Ų91.329%0.29147%0.472SS..G310 helixtrans-81.66.5-173.5-150.2167.7-17500115.9L185 T197 D198 W238L185-M195 HydrophobicContact CB-CE 4.36Å; L185-M195 HydrophobicContact CD1-CE 3.91Å; M195-T197 VanDerWaalsContact C-N 3.27Å; M195-T197 PolarHBondContact O-N 3.29Å; M195-D198 HydrophobicContact CG-CB 3.77Å; M195-W238 HydrophobicContact CE-CH2 4.28Å; M195-W238 HydrophobicContact CE-CZ2 4.05Å
196T52.3Low70.6Confident141 Ų14191.3 Ų91.387%0.86547%0.471SS*.G310 helixtrans-76.1-10.7177.846.70000113.8R194R194-T196 VanDerWaalsContact C-N 3.29Å; R194-T196 PolarHBondContact O-N 2.87Å
197T53.9Low70.6Confident119 Ų11987.3 Ų87.373%0.7346%0.463SS*.G310 helixtrans-100.9-2.3177-41.70000113.1M195M195-T197 VanDerWaalsContact C-N 3.27Å; M195-T197 PolarHBondContact O-N 3.29Å
198D72.3Confident70.7Confident41 Ų4185.9 Ų85.922%0.21946%0.458CS..THydrogen-bonded Turntrans-103.717.1-158.5-133.624.8000113.7M195 T200 T201 L202 W238M195-D198 HydrophobicContact CG-CB 3.77Å; D198-T200 VanDerWaalsContact C-N 3.3Å; D198-T200 PolarHBondContact O-N 3.39Å; D198-T201 VanDerWaalsContact C-OG1 3.25Å; D198-T201 VanDerWaalsContact CA-OG1 3.26Å; D198-T201 WeakPolarHBondContact CA-OG1 3.31Å; D198-T201 PolarHBondContact O-OG1 3.17Å; D198-T201 WeakPolarHBondContact OD1-CB 3.26Å; D198-T201 WeakPolarHBondContact OD1-CG2 3.45Å; D198-T201 PolarHBondContact OD1-OG1 2.87Å; D198-L202 WeakPolarHBondContact O-CB 3.14Å; D198-L202 PolarHBondContact O-N 3.39Å; D198-W238 WeakPolarHBondContact OD2-CZ2 3.49Å
199E80.2Confident71.2Confident73 Ų7383.6 Ų83.634%0.34145%0.445SS..Hα-helixtrans-70.3-29.5179.8-77.7-71.4146.600112.2R182 K203R182-E199 IonicContact CZ-OE1 3.37Å; R182-E199 IonicContact CZ-OE2 3.69Å; R182-E199 IonicContact NE-OE1 2.99Å; R182-E199 PolarHBondContact NE-OE1 3.33Å; R182-E199 IonicContact NE-OE2 3.99Å; R182-E199 VanDerWaalsContact NH2-CD 3.27Å; R182-E199 IonicContact NH2-OE1 3.07Å; R182-E199 PolarHBondContact NH2-OE1 3.21Å; R182-E199 VanDerWaalsContact NH2-OE1 3.07Å; R182-E199 IonicContact NH2-OE2 2.66Å; R182-E199 PolarHBondContact NH2-OE2 3.49Å; E199-K203 WeakPolarHBondContact O-CB 3.35Å; E199-K203 VanDerWaalsContact O-CG 3.23Å; E199-K203 WeakPolarHBondContact O-CG 3.37Å; E199-K203 PolarHBondContact O-N 3.44Å; E199-K203 VanDerWaalsContact O-N 3.13Å
200T82.7Confident71.9Confident107 Ų10781.8 Ų81.866%0.65643%0.433SS*.Hα-helixtrans-75-46.5176.646.80000111.6D198 K203 K204D198-T200 VanDerWaalsContact C-N 3.3Å; D198-T200 PolarHBondContact O-N 3.39Å; T200-K203 PolarHBondContact O-N 2.89Å; T200-K204 WeakPolarHBondContact O-CB 3.26Å; T200-K204 PolarHBondContact O-N 3.38Å
201T84.4Confident72.8Confident30 Ų3076.4 Ų76.418%0.18440%0.403CS..Hα-helixtrans-65.4-37.9174.351.60000111.5D198 K203 K204 F205D198-T201 VanDerWaalsContact C-OG1 3.25Å; D198-T201 VanDerWaalsContact CA-OG1 3.26Å; D198-T201 WeakPolarHBondContact CA-OG1 3.31Å; D198-T201 PolarHBondContact O-OG1 3.17Å; D198-T201 WeakPolarHBondContact OD1-CB 3.26Å; D198-T201 WeakPolarHBondContact OD1-CG2 3.45Å; D198-T201 PolarHBondContact OD1-OG1 2.87Å; T201-K203 PolarHBondContact O-N 2.94Å; T201-K204 CarbonylContact O-C 3.57Å; T201-K204 WeakPolarHBondContact O-CB 3.19Å; T201-K204 PolarHBondContact O-N 2.74Å; T201-F205 WeakPolarHBondContact O-CB 3.25Å; T201-F205 PolarHBondContact O-N 2.91Å
202L85.8Confident74Confident2 Ų273.4 Ų73.41%0.0139%0.387CS..Hα-helixtrans-62.2-43.7172.7-179.766.6000111.2I178 V181 R182 L185 D198 K204 F205 V206 W238I178-L202 HydrophobicContact CG2-CD2 4.13Å; I178-L202 HydrophobicContact CG2-CG 4.5Å; V181-L202 HydrophobicContact CG1-CD1 4.06Å; R182-L202 HydrophobicContact CB-CD2 4.08Å; R182-L202 HydrophobicContact CG-CD2 4.23Å; L185-L202 HydrophobicContact CD1-CD1 3.81Å; D198-L202 WeakPolarHBondContact O-CB 3.14Å; D198-L202 PolarHBondContact O-N 3.39Å; L202-K204 VanDerWaalsContact C-N 3.34Å; L202-F205 PolarHBondContact O-N 3.39Å; L202-V206 HydrophobicContact CD1-CG2 4.29Å; L202-V206 WeakPolarHBondContact O-CB 3.35Å; L202-V206 VanDerWaalsContact O-CG2 3.23Å; L202-V206 WeakPolarHBondContact O-CG2 3.48Å; L202-V206 PolarHBondContact O-N 3.48Å; L202-W238 HydrophobicContact CD1-CZ3 4.05Å
203K85.3Confident75.5Confident105 Ų10569.5 Ų69.546%0.45736%0.36SS..Hα-helixtrans-64-40.2174.2-76.6172.9-177.11770111.7I178 E199 T200 T201 V206 N207I178-K203 HydrophobicContact CD1-CG 4.33Å; E199-K203 WeakPolarHBondContact O-CB 3.35Å; E199-K203 VanDerWaalsContact O-CG 3.23Å; E199-K203 WeakPolarHBondContact O-CG 3.37Å; E199-K203 PolarHBondContact O-N 3.44Å; E199-K203 VanDerWaalsContact O-N 3.13Å; T200-K203 PolarHBondContact O-N 2.89Å; T201-K203 PolarHBondContact O-N 2.94Å; K203-V206 PolarHBondContact O-N 2.9Å; K203-N207 VanDerWaalsContact O-CB 3.25Å; K203-N207 WeakPolarHBondContact O-CB 3.47Å; K203-N207 PolarHBondContact O-N 2.93Å; K203-N207 PolarHBondContact O-ND2 2.92Å
204K85.2Confident77.1Confident88 Ų8863.6 Ų63.638%0.38332%0.318SS..Hα-helixtrans-61.9-46.6175.2-165.1-176178.8-172.80111.1T200 T201 L202 V206 D208 F209 F241 D245T200-K204 WeakPolarHBondContact O-CB 3.26Å; T200-K204 PolarHBondContact O-N 3.38Å; T201-K204 CarbonylContact O-C 3.57Å; T201-K204 WeakPolarHBondContact O-CB 3.19Å; T201-K204 PolarHBondContact O-N 2.74Å; L202-K204 VanDerWaalsContact C-N 3.34Å; K204-V206 PolarHBondContact O-N 3.48Å; K204-D208 HydrophobicContact CG-CB 4.41Å; K204-D208 VanDerWaalsContact CG-OD2 3.29Å; K204-D208 WeakPolarHBondContact CG-OD2 3.44Å; K204-D208 WeakPolarHBondContact O-CA 3.4Å; K204-D208 WeakPolarHBondContact O-CB 3.42Å; K204-D208 PolarHBondContact O-N 2.84Å; K204-F209 PolarHBondContact O-N 3.23Å; K204-F241 HydrophobicContact CB-CZ 4.29Å; K204-F241 HydrophobicContact CD-CZ 4.14Å; K204-F241 HydrophobicContact CG-CZ 4.11Å; K204-D245 IonicContact NZ-OD1 2.67Å; K204-D245 PolarHBondContact NZ-OD1 3.29Å
205F86.1Confident78.7Confident1 Ų154.5 Ų54.50%0.00429%0.285CS..Iπ-helixtrans-58.7-49.5174.6175.1-109.3000112V181 T201 L202 F209 L210 L237 W238 F241V181-F205 HydrophobicContact CG1-CD1 4.29Å; V181-F205 HydrophobicContact CG1-CE1 3.98Å; T201-F205 WeakPolarHBondContact O-CB 3.25Å; T201-F205 PolarHBondContact O-N 2.91Å; L202-F205 PolarHBondContact O-N 3.39Å; F205-F209 HydrophobicContact CD2-CB 4.11Å; F205-F209 AromaticContact CD2-CD1 3.71Å; F205-F209 HydrophobicContact CD2-CD1 3.71Å; F205-F209 HydrophobicContact CD2-CE1 4.49Å; F205-F209 HydrophobicContact CD2-CG 4.19Å; F205-F209 AromaticContact CE2-CD1 3.4Å; F205-F209 HydrophobicContact CE2-CD1 3.4Å; F205-F209 AromaticContact CE2-CE1 3.84Å; F205-F209 HydrophobicContact CE2-CE1 3.84Å; F205-F209 HydrophobicContact CE2-CG 4.31Å; F205-F209 HydrophobicContact CZ-CD1 4.34Å; F205-F209 WeakPolarHBondContact O-CB 3.21Å; F205-F209 PolarHBondContact O-N 3.34Å; F205-L210 PolarHBondContact O-N 3.42Å; F205-L237 HydrophobicContact CE2-CB 4.33Å; F205-L237 HydrophobicContact CZ-CB 4.04Å; F205-W238 HydrophobicContact CB-CE3 4.06Å; F205-W238 HydrophobicContact CB-CZ3 3.55Å; F205-W238 AromaticContact CD1-CE3 3.61Å; F205-W238 HydrophobicContact CD1-CE3 3.61Å; F205-W238 AromaticContact CD1-CZ3 3.81Å; F205-W238 HydrophobicContact CD1-CZ3 3.81Å; F205-W238 AromaticContact CD2-CE3 3.97Å; F205-W238 HydrophobicContact CD2-CE3 3.97Å; F205-W238 HydrophobicContact CD2-CZ3 4.32Å; F205-W238 AromaticContact CE1-CE3 3.97Å; F205-W238 HydrophobicContact CE1-CE3 3.97Å; F205-W238 HydrophobicContact CE2-CE3 4.28Å; F205-W238 AromaticContact CG-CE3 3.6Å; F205-W238 HydrophobicContact CG-CE3 3.6Å; F205-W238 AromaticContact CG-CZ3 3.64Å; F205-W238 HydrophobicContact CG-CZ3 3.64Å; F205-W238 HydrophobicContact CZ-CB 4.48Å; F205-W238 HydrophobicContact CZ-CE3 4.29Å; F205-F241 HydrophobicContact CB-CD1 3.99Å; F205-F241 HydrophobicContact CB-CE1 3.85Å; F205-F241 HydrophobicContact CB-CG 4.44Å; F205-F241 HydrophobicContact CB-CZ 4.18Å; F205-F241 HydrophobicContact CD2-CB 3.6Å; F205-F241 AromaticContact CD2-CD1 3.73Å; F205-F241 HydrophobicContact CD2-CD1 3.73Å; F205-F241 HydrophobicContact CD2-CD2 4.01Å; F205-F241 HydrophobicContact CD2-CE1 4.4Å; F205-F241 AromaticContact CD2-CG 3.5Å; F205-F241 HydrophobicContact CD2-CG 3.5Å; F205-F241 VanDerWaalsContact CD2-CG 3.5Å; F205-F241 HydrophobicContact CE2-CB 3.82Å; F205-F241 HydrophobicContact CE2-CG 4.23Å; F205-F241 HydrophobicContact CG-CD1 4.28Å; F205-F241 HydrophobicContact CG-CG 4.43Å
206V86.2Confident80.2Confident1 Ų151.9 Ų51.91%0.00627%0.272CS..Iπ-helixtrans-68.7-41.3-177.1175.80000112I178 V181 L202 K203 K204 H211 I215I178-V206 HydrophobicContact CG1-CB 4.27Å; I178-V206 HydrophobicContact CG1-CG1 3.8Å; I178-V206 HydrophobicContact CG1-CG2 4.44Å; V181-V206 HydrophobicContact CB-CG2 4.26Å; V181-V206 HydrophobicContact CG1-CG2 4.32Å; V181-V206 HydrophobicContact CG2-CG2 4.26Å; L202-V206 HydrophobicContact CD1-CG2 4.29Å; L202-V206 WeakPolarHBondContact O-CB 3.35Å; L202-V206 VanDerWaalsContact O-CG2 3.23Å; L202-V206 WeakPolarHBondContact O-CG2 3.48Å; L202-V206 PolarHBondContact O-N 3.48Å; K203-V206 PolarHBondContact O-N 2.9Å; K204-V206 PolarHBondContact O-N 3.48Å; V206-H211 PolarHBondContact O-N 3.47Å; V206-I215 HydrophobicContact CG1-CD1 3.4Å; V206-I215 VanDerWaalsContact CG1-CD1 3.4Å; V206-I215 HydrophobicContact CG1-CG1 4.11Å
207N82.3Confident81.9Confident89 Ų8946.9 Ų46.948%0.47624%0.24SC..Iπ-helixtrans-86.5-40.9-175.3-68.7-27.1000113.6K203K203-N207 VanDerWaalsContact O-CB 3.25Å; K203-N207 WeakPolarHBondContact O-CB 3.47Å; K203-N207 PolarHBondContact O-N 2.93Å; K203-N207 PolarHBondContact O-ND2 2.92Å
208D79Confident83.5Confident86 Ų8641.2 Ų41.246%0.4621%0.205SC..Iπ-helixtrans-101.7-29.6-169.2-56.7-13.8000113.3K32 K204 H211K32-D208 WeakPolarHBondContact CE-O 3.36Å; K32-D208 PolarHBondContact NZ-O 3.11Å; K204-D208 HydrophobicContact CG-CB 4.41Å; K204-D208 VanDerWaalsContact CG-OD2 3.29Å; K204-D208 WeakPolarHBondContact CG-OD2 3.44Å; K204-D208 WeakPolarHBondContact O-CA 3.4Å; K204-D208 WeakPolarHBondContact O-CB 3.42Å; K204-D208 PolarHBondContact O-N 2.84Å; D208-H211 PolarHBondContact O-CE1 3Å
209F81.8Confident84.3Confident13 Ų1339.9 Ų39.96%0.05720%0.197CC..Iπ-helixtrans-93.3-62.2177.9-175.3-101.9000110.4E25 K204 F205 H211 L237 F241 M244E25-F209 HydrophobicContact CG-CZ 3.92Å; K204-F209 PolarHBondContact O-N 3.23Å; F205-F209 HydrophobicContact CD2-CB 4.11Å; F205-F209 AromaticContact CD2-CD1 3.71Å; F205-F209 HydrophobicContact CD2-CD1 3.71Å; F205-F209 HydrophobicContact CD2-CE1 4.49Å; F205-F209 HydrophobicContact CD2-CG 4.19Å; F205-F209 AromaticContact CE2-CD1 3.4Å; F205-F209 HydrophobicContact CE2-CD1 3.4Å; F205-F209 AromaticContact CE2-CE1 3.84Å; F205-F209 HydrophobicContact CE2-CE1 3.84Å; F205-F209 HydrophobicContact CE2-CG 4.31Å; F205-F209 HydrophobicContact CZ-CD1 4.34Å; F205-F209 WeakPolarHBondContact O-CB 3.21Å; F205-F209 PolarHBondContact O-N 3.34Å; F209-H211 PolarHBondContact O-ND1 2.85Å; F209-L237 HydrophobicContact CE1-CB 4.4Å; F209-L237 HydrophobicContact CE1-CD2 4.24Å; F209-F241 HydrophobicContact CB-CD2 3.62Å; F209-F241 HydrophobicContact CB-CE2 3.87Å; F209-F241 HydrophobicContact CD1-CB 4.35Å; F209-F241 HydrophobicContact CD1-CD2 4.38Å; F209-F241 AromaticContact CD2-CD2 3.77Å; F209-F241 HydrophobicContact CD2-CD2 3.77Å; F209-F241 HydrophobicContact CE1-CB 4.41Å; F209-F241 HydrophobicContact CG-CB 4.4Å; F209-F241 AromaticContact CG-CD2 3.68Å; F209-F241 HydrophobicContact CG-CD2 3.68Å; F209-F241 HydrophobicContact CG-CE2 4.41Å; F209-F241 HydrophobicContact CG-CG 4.39Å; F209-M244 HydrophobicContact CE2-SD 3.76Å
210L81.8Confident84.7Confident0 Ų039 Ų390%019%0.194CC..SBendtrans-77.5-28.4-171.4-170.966.4000113.8F28 V181 F205 G214 I215 L218 L237F28-L210 HydrophobicContact CE2-CD1 4.03Å; F28-L210 HydrophobicContact CZ-CD1 4.35Å; V181-L210 HydrophobicContact CG2-CD2 4.26Å; F205-L210 PolarHBondContact O-N 3.42Å; L210-G214 WeakPolarHBondContact O-CA 3.43Å; L210-G214 PolarHBondContact O-N 3.31Å; L210-I215 HydrophobicContact CD2-CB 4.34Å; L210-I215 HydrophobicContact CD2-CG1 3.49Å; L210-I215 VanDerWaalsContact CD2-CG1 3.49Å; L210-I215 HydrophobicContact CG-CG1 4.05Å; L210-L218 HydrophobicContact CD1-CD1 3.8Å; L210-L218 HydrophobicContact CD1-CG 4.43Å; L210-L218 HydrophobicContact CD2-CD1 3.59Å; L210-L218 HydrophobicContact CG-CD1 4.32Å; L210-L237 HydrophobicContact CD1-CD1 4.44Å
211H81.3Confident85Confident38 Ų3835.1 Ų35.118%0.17617%0.169CC..Hα-helixtrans53.9-176.3-173.6-61.483.3000113.3V206 D208 F209 I215V206-H211 PolarHBondContact O-N 3.47Å; D208-H211 PolarHBondContact O-CE1 3Å; F209-H211 PolarHBondContact O-ND1 2.85Å; H211-I215 WeakPolarHBondContact O-CD1 3.45Å; H211-I215 VanDerWaalsContact O-CG1 3.29Å; H211-I215 WeakPolarHBondContact O-CG1 3.2Å; H211-I215 PolarHBondContact O-N 3.11Å
212K80.6Confident85.2Confident133 Ų13334.5 Ų34.558%0.57817%0.166SC*.Hα-helixtrans-68.6-37.7178-66.1-176.1-175.81640111.9G55 S56 I215 F216G55-K212 PolarHBondContact O-N 3.27Å; S56-K212 WeakPolarHBondContact OG-CD 3.29Å; K212-I215 PolarHBondContact O-N 2.93Å; K212-F216 PolarHBondContact O-N 3.42Å
213D83.1Confident85.2Confident0 Ų040.3 Ų40.30%019%0.189CC..Hα-helixtrans-65.1-40.9179.3-79.4-19.9000112.3G55 S56 Y57 I58 T59 I215 F216 I217G55-D213 VanDerWaalsContact C-CG 3.48Å; G55-D213 PolarHBondContact O-N 3.38Å; G55-D213 VanDerWaalsContact O-N 3.13Å; S56-D213 VanDerWaalsContact CA-CG 3.41Å; S56-D213 WeakPolarHBondContact CA-OD1 3.46Å; S56-D213 WeakPolarHBondContact CA-OD2 3.35Å; S56-D213 PolarHBondContact N-OD2 2.96Å; Y57-D213 PolarHBondContact N-OD1 2.84Å; Y57-D213 PolarHBondContact N-OD2 3.42Å; I58-D213 PolarHBondContact N-OD1 2.88Å; I58-D213 PolarHBondContact N-OD2 3.15Å; T59-D213 VanDerWaalsContact CB-OD1 3.3Å; T59-D213 WeakPolarHBondContact CB-OD1 3.37Å; T59-D213 PolarHBondContact N-OD1 3.43Å; T59-D213 PolarHBondContact OG1-OD1 3.37Å; D213-I215 PolarHBondContact O-N 2.9Å; D213-F216 WeakPolarHBondContact O-CB 3.12Å; D213-F216 PolarHBondContact O-N 2.8Å; D213-F216 VanDerWaalsContact O-N 3.16Å; D213-I217 VanDerWaalsContact O-CG1 3.29Å; D213-I217 WeakPolarHBondContact O-CG1 3.34Å; D213-I217 PolarHBondContact O-N 3.44Å
214G85.1Confident85.2Confident0 Ų042.9 Ų42.90%020%0.196CC..Hα-helixtrans-67.2-38.4177.400000113.3L210 F216 I217 L218L210-G214 WeakPolarHBondContact O-CA 3.43Å; L210-G214 PolarHBondContact O-N 3.31Å; G214-F216 VanDerWaalsContact C-N 3.27Å; G214-F216 PolarHBondContact O-N 3.42Å; G214-I217 PolarHBondContact O-N 3Å; G214-L218 WeakPolarHBondContact O-CB 3.33Å; G214-L218 WeakPolarHBondContact O-CG 3.4Å; G214-L218 PolarHBondContact O-N 3.49Å
215I87.8Confident84.9Confident18 Ų1841.7 Ų41.79%0.09220%0.202CC..Hα-helixtrans-61.1-41.5172-59.7163.3000110.1V206 L210 H211 K212 D213 R219V206-I215 HydrophobicContact CG1-CD1 3.4Å; V206-I215 VanDerWaalsContact CG1-CD1 3.4Å; V206-I215 HydrophobicContact CG1-CG1 4.11Å; L210-I215 HydrophobicContact CD2-CB 4.34Å; L210-I215 HydrophobicContact CD2-CG1 3.49Å; L210-I215 VanDerWaalsContact CD2-CG1 3.49Å; L210-I215 HydrophobicContact CG-CG1 4.05Å; H211-I215 WeakPolarHBondContact O-CD1 3.45Å; H211-I215 VanDerWaalsContact O-CG1 3.29Å; H211-I215 WeakPolarHBondContact O-CG1 3.2Å; H211-I215 PolarHBondContact O-N 3.11Å; K212-I215 PolarHBondContact O-N 2.93Å; D213-I215 PolarHBondContact O-N 2.9Å; I215-R219 WeakPolarHBondContact O-CB 3.34Å; I215-R219 PolarHBondContact O-N 3.36Å
216F87.9Confident84.9Confident5 Ų543.7 Ų43.72%0.02222%0.216CC..Hα-helixtrans-61.8-47.3177.2170.7-115.7000111.8I58 T59 Y62 L171 K212 D213 G214 R219 L220I58-F216 HydrophobicContact CG2-CD1 3.97Å; I58-F216 HydrophobicContact CG2-CE1 3.86Å; T59-F216 HydrophobicContact CG2-CB 4.41Å; T59-F216 HydrophobicContact CG2-CG 4.43Å; T59-F216 WeakPolarHBondContact OG1-CB 3.4Å; Y62-F216 AromaticContact CD1-CE2 3.46Å; Y62-F216 HydrophobicContact CD1-CE2 3.46Å; Y62-F216 VanDerWaalsContact CD1-CE2 3.46Å; Y62-F216 AromaticContact CD1-CZ 3.5Å; Y62-F216 HydrophobicContact CD1-CZ 3.5Å; Y62-F216 HydrophobicContact CD2-CE2 4.33Å; Y62-F216 AromaticContact CD2-CZ 3.63Å; Y62-F216 HydrophobicContact CD2-CZ 3.63Å; Y62-F216 AromaticContact CE1-CE2 3.75Å; Y62-F216 HydrophobicContact CE1-CE2 3.75Å; Y62-F216 HydrophobicContact CE1-CZ 4.03Å; Y62-F216 HydrophobicContact CE2-CZ 4.15Å; Y62-F216 HydrophobicContact CG-CE1 4.17Å; Y62-F216 AromaticContact CG-CE2 3.77Å; Y62-F216 HydrophobicContact CG-CE2 3.77Å; Y62-F216 AromaticContact CG-CZ 3.26Å; Y62-F216 HydrophobicContact CG-CZ 3.26Å; L171-F216 HydrophobicContact CD1-CD2 4.08Å; L171-F216 HydrophobicContact CD1-CE2 4.18Å; L171-F216 HydrophobicContact CD2-CB 4.13Å; L171-F216 HydrophobicContact CD2-CD2 3.43Å; L171-F216 VanDerWaalsContact CD2-CD2 3.43Å; L171-F216 HydrophobicContact CD2-CE2 4.26Å; L171-F216 HydrophobicContact CD2-CG 4.18Å; L171-F216 HydrophobicContact CG-CD2 4.41Å; K212-F216 PolarHBondContact O-N 3.42Å; D213-F216 WeakPolarHBondContact O-CB 3.12Å; D213-F216 PolarHBondContact O-N 2.8Å; D213-F216 VanDerWaalsContact O-N 3.16Å; G214-F216 VanDerWaalsContact C-N 3.27Å; G214-F216 PolarHBondContact O-N 3.42Å; F216-R219 PolarHBondContact O-N 3.2Å; F216-L220 HydrophobicContact CZ-CD2 4.39Å; F216-L220 WeakPolarHBondContact O-CB 3.26Å; F216-L220 PolarHBondContact O-N 2.95Å
217I87.3Confident84.8Confident35 Ų3549 Ų4918%0.17924%0.241CC..Hα-helixtrans-67.7-42.5-178.5-54.5158.5000110.7M24 I58 D213 G214 R219 L220 I221M24-I217 HydrophobicContact CE-CB 3.62Å; M24-I217 HydrophobicContact CE-CD1 4.34Å; M24-I217 HydrophobicContact CE-CG2 3.07Å; I58-I217 HydrophobicContact CD1-CD1 4.26Å; D213-I217 VanDerWaalsContact O-CG1 3.29Å; D213-I217 WeakPolarHBondContact O-CG1 3.34Å; D213-I217 PolarHBondContact O-N 3.44Å; G214-I217 PolarHBondContact O-N 3Å; I217-R219 VanDerWaalsContact C-N 3.27Å; I217-R219 PolarHBondContact O-N 2.84Å; I217-L220 WeakPolarHBondContact O-CB 3.14Å; I217-L220 PolarHBondContact O-N 2.89Å; I217-I221 HydrophobicContact CG2-CD1 4.02Å; I217-I221 HydrophobicContact CG2-CG1 4.33Å; I217-I221 WeakPolarHBondContact O-CG1 2.98Å; I217-I221 PolarHBondContact O-N 3.41Å
218L88.4Confident84.9Confident1 Ų149.6 Ų49.61%0.00524%0.244CC..Hα-helixtrans-56.5-43.7174.4-74.1176.2000111.7F180 L210 G214 L220 I221 S222 C230 L233 V234 L237F180-L218 HydrophobicContact CE1-CB 4.36Å; L210-L218 HydrophobicContact CD1-CD1 3.8Å; L210-L218 HydrophobicContact CD1-CG 4.43Å; L210-L218 HydrophobicContact CD2-CD1 3.59Å; L210-L218 HydrophobicContact CG-CD1 4.32Å; G214-L218 WeakPolarHBondContact O-CB 3.33Å; G214-L218 WeakPolarHBondContact O-CG 3.4Å; G214-L218 PolarHBondContact O-N 3.49Å; L218-L220 VanDerWaalsContact C-N 3.34Å; L218-L220 PolarHBondContact O-N 3.12Å; L218-I221 PolarHBondContact O-N 3.5Å; L218-S222 PolarHBondContact O-N 2.77Å; L218-C230 PolarHBondContact O-SG 3.49Å; L218-C230 VanDerWaalsContact O-SG 3.37Å; L218-L233 HydrophobicContact CD2-CD2 3.6Å; L218-L233 HydrophobicContact CD2-CG 3.94Å; L218-V234 HydrophobicContact CD1-CG2 3.84Å; L218-V234 HydrophobicContact CD2-CG2 3.93Å; L218-V234 HydrophobicContact CG-CG2 4.45Å; L218-L237 HydrophobicContact CD1-CD1 4.49Å; L218-L237 HydrophobicContact CD2-CD1 4.14Å
219R89.1Confident85.1Confident12 Ų1246.4 Ų46.45%0.04523%0.226CC..Hα-helixtrans-67.7-33.9176-175.1174.3-72.5166.3-4.7113W167 I170 Q176 F180 I215 F216 I217 S222 Y223W167-R219 HydrophobicContact CH2-CG 4.06Å; W167-R219 HydrophobicContact CZ3-CG 3.89Å; I170-R219 VanDerWaalsContact C-NH1 3.28Å; I170-R219 VanDerWaalsContact CD1-CZ 3.44Å; I170-R219 PolarHBondContact O-NH1 3.13Å; Q176-R219 PolarHBondContact O-NH2 2.84Å; F180-R219 HydrophobicContact CE2-CG 4.43Å; F180-R219 HydrophobicContact CZ-CB 4.27Å; I215-R219 WeakPolarHBondContact O-CB 3.34Å; I215-R219 PolarHBondContact O-N 3.36Å; F216-R219 PolarHBondContact O-N 3.2Å; I217-R219 VanDerWaalsContact C-N 3.27Å; I217-R219 PolarHBondContact O-N 2.84Å; R219-S222 PolarHBondContact O-OG 3.06Å; R219-Y223 WeakPolarHBondContact O-CB 3.4Å; R219-Y223 PolarHBondContact O-N 2.9Å; R219-Y223 VanDerWaalsContact O-N 3.07Å
220L88.4Confident85.3Confident54 Ų5445.8 Ų45.828%0.28322%0.224SC..Hα-helixtrans-66.5-42175.6-175.163.9000110.8F216 I217 L218 Y223 R224F216-L220 HydrophobicContact CZ-CD2 4.39Å; F216-L220 WeakPolarHBondContact O-CB 3.26Å; F216-L220 PolarHBondContact O-N 2.95Å; I217-L220 WeakPolarHBondContact O-CB 3.14Å; I217-L220 PolarHBondContact O-N 2.89Å; L218-L220 VanDerWaalsContact C-N 3.34Å; L218-L220 PolarHBondContact O-N 3.12Å; L220-Y223 PolarHBondContact O-N 3Å; L220-R224 HydrophobicContact CD1-CG 4.02Å; L220-R224 WeakPolarHBondContact O-CB 3.29Å; L220-R224 WeakPolarHBondContact O-CG 3.38Å; L220-R224 PolarHBondContact O-N 3.24Å
221I87.8Confident85.5Confident26 Ų2646 Ų4613%0.13323%0.225CC..Hα-helixtrans-63.3-47.1175.4-67168.6000110.2M24 I217 L218 Y223 R224 A225 I229 C230 L233M24-I221 HydrophobicContact CE-CD1 3.61Å; I217-I221 HydrophobicContact CG2-CD1 4.02Å; I217-I221 HydrophobicContact CG2-CG1 4.33Å; I217-I221 WeakPolarHBondContact O-CG1 2.98Å; I217-I221 PolarHBondContact O-N 3.41Å; L218-I221 PolarHBondContact O-N 3.5Å; I221-Y223 PolarHBondContact O-N 3.49Å; I221-R224 PolarHBondContact O-N 3.27Å; I221-A225 HydrophobicContact CG2-CB 4.26Å; I221-A225 WeakPolarHBondContact O-CB 3.39Å; I221-A225 PolarHBondContact O-N 3.5Å; I221-I229 HydrophobicContact CG2-CG2 4.37Å; I221-C230 HydrophobicContact CG2-CB 4.32Å; I221-L233 HydrophobicContact CD1-CD2 3.65Å
222S88.4Confident85.7Confident17 Ų1746.6 Ų46.612%0.11923%0.228CC..Hα-helixtrans-60.8-36179.378.60000112.2F180 L218 R219F180-S222 WeakPolarHBondContact CZ-OG 3.43Å; L218-S222 PolarHBondContact O-N 2.77Å; R219-S222 PolarHBondContact O-OG 3.06Å
223Y86.7Confident86.1Confident125 Ų12540.3 Ų40.349%0.4920%0.2SC..Hα-helixtrans-79.4-31.4-179.7-174.5-104.8000113.9W167 R219 L220 I221W167-Y223 HydrophobicContact CH2-CD1 4.45Å; W167-Y223 HydrophobicContact CH2-CG 4.24Å; W167-Y223 AromaticContact CZ2-CD1 3.84Å; W167-Y223 HydrophobicContact CZ2-CD1 3.84Å; W167-Y223 HydrophobicContact CZ2-CD2 4.25Å; W167-Y223 HydrophobicContact CZ2-CE1 4.21Å; W167-Y223 AromaticContact CZ2-CG 3.86Å; W167-Y223 HydrophobicContact CZ2-CG 3.86Å; R219-Y223 WeakPolarHBondContact O-CB 3.4Å; R219-Y223 PolarHBondContact O-N 2.9Å; R219-Y223 VanDerWaalsContact O-N 3.07Å; L220-Y223 PolarHBondContact O-N 3Å; I221-Y223 PolarHBondContact O-N 3.49Å
224R85Confident86.3Confident159 Ų15940.3 Ų40.360%0.620%0.201SC*.Hα-helixtrans-106.4-28-171.2-65.8-62.5-166.4-179.33.9115.4L220 I221L220-R224 HydrophobicContact CD1-CG 4.02Å; L220-R224 WeakPolarHBondContact O-CB 3.29Å; L220-R224 WeakPolarHBondContact O-CG 3.38Å; L220-R224 PolarHBondContact O-N 3.24Å; I221-R224 PolarHBondContact O-N 3.27Å
225A79.8Confident86.4Confident63 Ų6342.7 Ų42.752%0.52121%0.213SC..THydrogen-bonded Turntrans-105.4-83-17500000110.7I221I221-A225 HydrophobicContact CG2-CB 4.26Å; I221-A225 WeakPolarHBondContact O-CB 3.39Å; I221-A225 PolarHBondContact O-N 3.5Å
226S84.3Confident86.3Confident42 Ų4243.2 Ų43.229%0.29422%0.217SC..  trans-164.1150.9171.464.70000110L228 I229 C230S226-L228 PolarHBondContact O-N 3.33Å; S226-I229 PolarHBondContact O-N 3.25Å; S226-I229 VanDerWaalsContact OG-CD1 3.26Å; S226-I229 WeakPolarHBondContact OG-CD1 3.36Å; S226-I229 WeakPolarHBondContact OG-CG1 3.45Å; S226-I229 PolarHBondContact OG-N 3.31Å; S226-C230 PolarHBondContact O-N 2.85Å
227E85.1Confident86.3Confident114 Ų11443 Ų4353%0.53322%0.216SC..Hα-helixtrans-64.2-30.8176.3-63.3-171.2169.900112.1Y184 C230 S231Y184-E227 HydrophobicContact CE1-CB 4.28Å; E227-C230 PolarHBondContact O-N 2.94Å; E227-S231 PolarHBondContact O-N 2.77Å
228L83.8Confident86.2Confident101 Ų10142.1 Ų42.153%0.52921%0.211SC..Hα-helixtrans-67.2-41.3178.8-174.669.7000112.5S226 C230 S231 E232S226-L228 PolarHBondContact O-N 3.33Å; L228-C230 VanDerWaalsContact C-N 3.31Å; L228-S231 PolarHBondContact O-N 2.86Å; L228-S231 PolarHBondContact O-OG 3.37Å; L228-E232 WeakPolarHBondContact O-CG 3.31Å; L228-E232 PolarHBondContact O-N 3.32Å
229I83.6Confident86.1Confident19 Ų1945.7 Ų45.710%0.09723%0.233CC..Hα-helixtrans-66.3-40.7176.2-68.2166.8000109.8L7 K13 V17 I221 S226 S231 L233L7-I229 HydrophobicContact CD2-CD1 3.51Å; K13-I229 HydrophobicContact CD-CG1 4.33Å; K13-I229 HydrophobicContact CG-CG1 4.47Å; V17-I229 HydrophobicContact CG2-CG2 3.87Å; I221-I229 HydrophobicContact CG2-CG2 4.37Å; S226-I229 PolarHBondContact O-N 3.25Å; S226-I229 VanDerWaalsContact OG-CD1 3.26Å; S226-I229 WeakPolarHBondContact OG-CD1 3.36Å; S226-I229 WeakPolarHBondContact OG-CG1 3.45Å; S226-I229 PolarHBondContact OG-N 3.31Å; I229-S231 VanDerWaalsContact C-N 3.32Å; I229-S231 PolarHBondContact O-N 3.29Å; I229-L233 WeakPolarHBondContact O-CB 3.29Å; I229-L233 PolarHBondContact O-N 3.21Å
230C87Confident85.9Confident0 Ų047.7 Ų47.70%024%0.244CC..Hα-helixtrans-63.6-37.5177.2-171.80000112.1Y184 L218 I221 S226 E227 L228 L233 V234Y184-C230 HydrophobicContact CE1-CB 4.37Å; L218-C230 PolarHBondContact O-SG 3.49Å; L218-C230 VanDerWaalsContact O-SG 3.37Å; I221-C230 HydrophobicContact CG2-CB 4.32Å; S226-C230 PolarHBondContact O-N 2.85Å; E227-C230 PolarHBondContact O-N 2.94Å; L228-C230 VanDerWaalsContact C-N 3.31Å; C230-L233 PolarHBondContact O-N 3.49Å; C230-V234 WeakPolarHBondContact O-CB 3.36Å; C230-V234 WeakPolarHBondContact O-CG2 3.22Å; C230-V234 PolarHBondContact O-N 3.17Å
231S86Confident85.8Confident4 Ų445.7 Ų45.73%0.02823%0.233CC..Hα-helixtrans-66.2-47.2179.967.40000111.6L188 E227 L228 I229 L233 V234 L235L188-S231 WeakPolarHBondContact CD1-O 3.42Å; E227-S231 PolarHBondContact O-N 2.77Å; L228-S231 PolarHBondContact O-N 2.86Å; L228-S231 PolarHBondContact O-OG 3.37Å; I229-S231 VanDerWaalsContact C-N 3.32Å; I229-S231 PolarHBondContact O-N 3.29Å; S231-L233 PolarHBondContact O-N 3.05Å; S231-V234 PolarHBondContact O-N 3.25Å; S231-L235 PolarHBondContact O-N 3.33Å
232E85.6Confident85.6Confident50 Ų5046.1 Ų46.123%0.23424%0.236CC..Hα-helixtrans-60.5-44.6175.7-65.1-64.5156.300111.3L228 V234 L235 T236L228-E232 WeakPolarHBondContact O-CG 3.31Å; L228-E232 PolarHBondContact O-N 3.32Å; E232-V234 PolarHBondContact O-N 3.19Å; E232-L235 WeakPolarHBondContact O-CB 3.49Å; E232-L235 PolarHBondContact O-N 3Å; E232-L235 VanDerWaalsContact O-N 3.15Å; E232-T236 PolarHBondContact O-N 2.93Å; E232-T236 PolarHBondContact O-OG1 2.99Å
233L87.2Confident85.5Confident1 Ų147.6 Ų47.61%0.00525%0.246CC..Hα-helixtrans-60.5-44.6177.8-178.463.8000112.1V17 A21 M24 L218 I221 I229 C230 S231 L235 T236 L237V17-L233 HydrophobicContact CG1-CB 4Å; V17-L233 HydrophobicContact CG1-CD1 3.88Å; A21-L233 HydrophobicContact CB-CD1 3.71Å; M24-L233 HydrophobicContact CE-CD2 4.29Å; M24-L233 HydrophobicContact SD-CD2 4.13Å; L218-L233 HydrophobicContact CD2-CD2 3.6Å; L218-L233 HydrophobicContact CD2-CG 3.94Å; I221-L233 HydrophobicContact CD1-CD2 3.65Å; I229-L233 WeakPolarHBondContact O-CB 3.29Å; I229-L233 PolarHBondContact O-N 3.21Å; C230-L233 PolarHBondContact O-N 3.49Å; S231-L233 PolarHBondContact O-N 3.05Å; L233-L235 VanDerWaalsContact C-N 3.29Å; L233-L235 PolarHBondContact O-N 3.48Å; L233-T236 PolarHBondContact O-N 3.17Å; L233-L237 HydrophobicContact CD1-CD1 4.41Å; L233-L237 HydrophobicContact CD1-CG 4.48Å; L233-L237 HydrophobicContact CG-CD1 4.16Å; L233-L237 WeakPolarHBondContact O-CB 3.39Å; L233-L237 VanDerWaalsContact O-CG 3.27Å; L233-L237 WeakPolarHBondContact O-CG 3.01Å; L233-L237 PolarHBondContact O-N 3.16Å
234V88.4Confident85.3Confident1 Ų145.1 Ų45.11%0.00624%0.24CC..Hα-helixtrans-61.3-39.4175.7168.80000111.2V181 L185 L218 C230 S231 E232 W238V181-V234 HydrophobicContact CG1-CG1 4.25Å; L185-V234 HydrophobicContact CD2-CG1 3.8Å; L185-V234 HydrophobicContact CG-CG1 3.87Å; L218-V234 HydrophobicContact CD1-CG2 3.84Å; L218-V234 HydrophobicContact CD2-CG2 3.93Å; L218-V234 HydrophobicContact CG-CG2 4.45Å; C230-V234 WeakPolarHBondContact O-CB 3.36Å; C230-V234 WeakPolarHBondContact O-CG2 3.22Å; C230-V234 PolarHBondContact O-N 3.17Å; S231-V234 PolarHBondContact O-N 3.25Å; E232-V234 PolarHBondContact O-N 3.19Å; V234-W238 VanDerWaalsContact O-CB 3.23Å; V234-W238 WeakPolarHBondContact O-CB 3.11Å; V234-W238 PolarHBondContact O-N 3.03Å
235L86.6Confident85.2Confident50 Ų5039.3 Ų39.326%0.26222%0.22SC..Hα-helixtrans-66.1-46.1177.8-176.966.3000111.5L188 S231 E232 L233 W238 T239L188-L235 HydrophobicContact CD1-CB 4.03Å; L188-L235 HydrophobicContact CD1-CD2 4.33Å; S231-L235 PolarHBondContact O-N 3.33Å; E232-L235 WeakPolarHBondContact O-CB 3.49Å; E232-L235 PolarHBondContact O-N 3Å; E232-L235 VanDerWaalsContact O-N 3.15Å; L233-L235 VanDerWaalsContact C-N 3.29Å; L233-L235 PolarHBondContact O-N 3.48Å; L235-W238 PolarHBondContact O-N 2.87Å; L235-T239 WeakPolarHBondContact O-CG2 3.42Å; L235-T239 PolarHBondContact O-N 2.88Å; L235-T239 PolarHBondContact O-OG1 2.78Å
236T86.2Confident85.3Confident28 Ų2844.2 Ų44.217%0.17223%0.225CC..Hα-helixtrans-58.9-49.5176.8-56.70000111.4L18 E232 L233 W238 T239 D240L18-T236 HydrophobicContact CD2-CG2 3.94Å; E232-T236 PolarHBondContact O-N 2.93Å; E232-T236 PolarHBondContact O-OG1 2.99Å; L233-T236 PolarHBondContact O-N 3.17Å; T236-W238 VanDerWaalsContact C-N 3.28Å; T236-W238 PolarHBondContact O-N 2.89Å; T236-T239 WeakPolarHBondContact CA-OG1 3.41Å; T236-T239 PolarHBondContact O-N 3.18Å; T236-T239 PolarHBondContact O-OG1 3.34Å; T236-D240 PolarHBondContact O-N 3.47Å
237L87Confident85.4Confident0 Ų045.2 Ų45.20%023%0.232CC..Hα-helixtrans-60.1-38.3177-69.3170.8000112A21 E25 F205 F209 L210 L218 L233 F241A21-L237 HydrophobicContact CB-CD2 4.09Å; E25-L237 HydrophobicContact CG-CD2 4.07Å; E25-L237 WeakPolarHBondContact OE1-CD2 3.48Å; F205-L237 HydrophobicContact CE2-CB 4.33Å; F205-L237 HydrophobicContact CZ-CB 4.04Å; F209-L237 HydrophobicContact CE1-CB 4.4Å; F209-L237 HydrophobicContact CE1-CD2 4.24Å; L210-L237 HydrophobicContact CD1-CD1 4.44Å; L218-L237 HydrophobicContact CD1-CD1 4.49Å; L218-L237 HydrophobicContact CD2-CD1 4.14Å; L233-L237 HydrophobicContact CD1-CD1 4.41Å; L233-L237 HydrophobicContact CD1-CG 4.48Å; L233-L237 HydrophobicContact CG-CD1 4.16Å; L233-L237 WeakPolarHBondContact O-CB 3.39Å; L233-L237 VanDerWaalsContact O-CG 3.27Å; L233-L237 WeakPolarHBondContact O-CG 3.01Å; L233-L237 PolarHBondContact O-N 3.16Å; L237-F241 WeakPolarHBondContact O-CB 3.33Å; L237-F241 PolarHBondContact O-N 3.03Å
238W86.9Confident85.2Confident18 Ų1841.9 Ų41.97%0.06823%0.225CC..Hα-helixtrans-68.2-40.9177.1179.1-100.1000112.6L185 M195 D198 L202 F205 V234 L235 T236 N242L185-W238 HydrophobicContact CD1-CD2 4.09Å; L185-W238 HydrophobicContact CD1-CE3 3.96Å; L185-W238 HydrophobicContact CD1-CG 4.5Å; L185-W238 HydrophobicContact CD1-CZ3 4.41Å; L185-W238 HydrophobicContact CD2-CB 3.91Å; L185-W238 HydrophobicContact CD2-CD2 4.26Å; L185-W238 HydrophobicContact CD2-CG 3.82Å; M195-W238 HydrophobicContact CE-CH2 4.28Å; M195-W238 HydrophobicContact CE-CZ2 4.05Å; D198-W238 WeakPolarHBondContact OD2-CZ2 3.49Å; L202-W238 HydrophobicContact CD1-CZ3 4.05Å; F205-W238 HydrophobicContact CB-CE3 4.06Å; F205-W238 HydrophobicContact CB-CZ3 3.55Å; F205-W238 AromaticContact CD1-CE3 3.61Å; F205-W238 HydrophobicContact CD1-CE3 3.61Å; F205-W238 AromaticContact CD1-CZ3 3.81Å; F205-W238 HydrophobicContact CD1-CZ3 3.81Å; F205-W238 AromaticContact CD2-CE3 3.97Å; F205-W238 HydrophobicContact CD2-CE3 3.97Å; F205-W238 HydrophobicContact CD2-CZ3 4.32Å; F205-W238 AromaticContact CE1-CE3 3.97Å; F205-W238 HydrophobicContact CE1-CE3 3.97Å; F205-W238 HydrophobicContact CE2-CE3 4.28Å; F205-W238 AromaticContact CG-CE3 3.6Å; F205-W238 HydrophobicContact CG-CE3 3.6Å; F205-W238 AromaticContact CG-CZ3 3.64Å; F205-W238 HydrophobicContact CG-CZ3 3.64Å; F205-W238 HydrophobicContact CZ-CB 4.48Å; F205-W238 HydrophobicContact CZ-CE3 4.29Å; V234-W238 VanDerWaalsContact O-CB 3.23Å; V234-W238 WeakPolarHBondContact O-CB 3.11Å; V234-W238 PolarHBondContact O-N 3.03Å; L235-W238 PolarHBondContact O-N 2.87Å; T236-W238 VanDerWaalsContact C-N 3.28Å; T236-W238 PolarHBondContact O-N 2.89Å; W238-N242 PolarHBondContact NE1-ND2 3.2Å; W238-N242 PolarHBondContact O-N 3.16Å; W238-N242 VanDerWaalsContact O-N 3.1Å; W238-N242 PolarHBondContact O-ND2 3.49Å; W238-N242 VanDerWaalsContact O-ND2 3.07Å
239T85.7Confident85.1Confident76 Ų7639.3 Ų39.347%0.46622%0.215SC..Hα-helixtrans-66.2-39.6176.150.50000112.1L235 T236 N242 S243L235-T239 WeakPolarHBondContact O-CG2 3.42Å; L235-T239 PolarHBondContact O-N 2.88Å; L235-T239 PolarHBondContact O-OG1 2.78Å; T236-T239 WeakPolarHBondContact CA-OG1 3.41Å; T236-T239 PolarHBondContact O-N 3.18Å; T236-T239 PolarHBondContact O-OG1 3.34Å; T239-N242 PolarHBondContact O-N 3.03Å; T239-S243 PolarHBondContact O-N 3.42Å
240D84.6Confident85Confident53 Ų5343.8 Ų43.828%0.28324%0.236SC..Hα-helixtrans-66.8-47.3178.2-168.965.1000111.1T236 N242 S243 M244T236-D240 PolarHBondContact O-N 3.47Å; D240-N242 VanDerWaalsContact C-N 3.33Å; D240-N242 PolarHBondContact O-N 2.8Å; D240-S243 WeakPolarHBondContact O-CA 3.37Å; D240-S243 VanDerWaalsContact O-CB 3.29Å; D240-S243 WeakPolarHBondContact O-CB 3.22Å; D240-S243 PolarHBondContact O-N 3.36Å; D240-S243 PolarHBondContact O-OG 3.24Å; D240-M244 WeakPolarHBondContact O-CG 2.94Å; D240-M244 PolarHBondContact O-N 3.46Å
241F85.9Confident84.7Confident13 Ų1350 Ų506%0.05727%0.265CS..Hα-helixtrans-54.9-45.1173.9173.9-103.7000113.1K204 F205 F209 L237 S243 M244 D245K204-F241 HydrophobicContact CB-CZ 4.29Å; K204-F241 HydrophobicContact CD-CZ 4.14Å; K204-F241 HydrophobicContact CG-CZ 4.11Å; F205-F241 HydrophobicContact CB-CD1 3.99Å; F205-F241 HydrophobicContact CB-CE1 3.85Å; F205-F241 HydrophobicContact CB-CG 4.44Å; F205-F241 HydrophobicContact CB-CZ 4.18Å; F205-F241 HydrophobicContact CD2-CB 3.6Å; F205-F241 AromaticContact CD2-CD1 3.73Å; F205-F241 HydrophobicContact CD2-CD1 3.73Å; F205-F241 HydrophobicContact CD2-CD2 4.01Å; F205-F241 HydrophobicContact CD2-CE1 4.4Å; F205-F241 AromaticContact CD2-CG 3.5Å; F205-F241 HydrophobicContact CD2-CG 3.5Å; F205-F241 VanDerWaalsContact CD2-CG 3.5Å; F205-F241 HydrophobicContact CE2-CB 3.82Å; F205-F241 HydrophobicContact CE2-CG 4.23Å; F205-F241 HydrophobicContact CG-CD1 4.28Å; F205-F241 HydrophobicContact CG-CG 4.43Å; F209-F241 HydrophobicContact CB-CD2 3.62Å; F209-F241 HydrophobicContact CB-CE2 3.87Å; F209-F241 HydrophobicContact CD1-CB 4.35Å; F209-F241 HydrophobicContact CD1-CD2 4.38Å; F209-F241 AromaticContact CD2-CD2 3.77Å; F209-F241 HydrophobicContact CD2-CD2 3.77Å; F209-F241 HydrophobicContact CE1-CB 4.41Å; F209-F241 HydrophobicContact CG-CB 4.4Å; F209-F241 AromaticContact CG-CD2 3.68Å; F209-F241 HydrophobicContact CG-CD2 3.68Å; F209-F241 HydrophobicContact CG-CE2 4.41Å; F209-F241 HydrophobicContact CG-CG 4.39Å; L237-F241 WeakPolarHBondContact O-CB 3.33Å; L237-F241 PolarHBondContact O-N 3.03Å; F241-S243 PolarHBondContact O-N 2.93Å; F241-M244 PolarHBondContact O-N 3.3Å; F241-D245 WeakPolarHBondContact O-CB 3.49Å; F241-D245 PolarHBondContact O-N 3.2Å
242N84.4Confident84.5Confident34 Ų3455.8 Ų55.818%0.18229%0.294CS..Hα-helixtrans-67.5-27176.8-75.8-39.9000112.7W238 T239 D240 R246W238-N242 PolarHBondContact NE1-ND2 3.2Å; W238-N242 PolarHBondContact O-N 3.16Å; W238-N242 VanDerWaalsContact O-N 3.1Å; W238-N242 PolarHBondContact O-ND2 3.49Å; W238-N242 VanDerWaalsContact O-ND2 3.07Å; T239-N242 PolarHBondContact O-N 3.03Å; D240-N242 VanDerWaalsContact C-N 3.33Å; D240-N242 PolarHBondContact O-N 2.8Å; N242-R246 WeakPolarHBondContact O-CB 3.47Å; N242-R246 WeakPolarHBondContact O-CG 3.42Å; N242-R246 PolarHBondContact O-N 3.2Å; N242-R246 PolarHBondContact O-NE 3.24Å
243S84.8Confident84.1Confident48 Ų4862.3 Ų62.334%0.33632%0.317SS..Hα-helixtrans-69.5-47172.689.10000110.2T239 D240 F241 R246 S247T239-S243 PolarHBondContact O-N 3.42Å; D240-S243 WeakPolarHBondContact O-CA 3.37Å; D240-S243 VanDerWaalsContact O-CB 3.29Å; D240-S243 WeakPolarHBondContact O-CB 3.22Å; D240-S243 PolarHBondContact O-N 3.36Å; D240-S243 PolarHBondContact O-OG 3.24Å; F241-S243 PolarHBondContact O-N 2.93Å; S243-R246 PolarHBondContact O-N 3.29Å; S243-S247 PolarHBondContact O-N 3.03Å; S243-S247 PolarHBondContact O-OG 3.35Å
244M83.3Confident84Confident73 Ų7367 Ų6736%0.3634%0.339SS..Hα-helixtrans-63.7-44.5177.6-63.8-178.981.700112.5F209 D240 F241 R246 S247 A248F209-M244 HydrophobicContact CE2-SD 3.76Å; D240-M244 WeakPolarHBondContact O-CG 2.94Å; D240-M244 PolarHBondContact O-N 3.46Å; F241-M244 PolarHBondContact O-N 3.3Å; M244-R246 VanDerWaalsContact C-N 3.3Å; M244-R246 PolarHBondContact O-N 2.94Å; M244-S247 PolarHBondContact O-N 3.26Å; M244-A248 WeakPolarHBondContact O-CB 3.48Å; M244-A248 PolarHBondContact O-N 3.13Å
245D82.8Confident83.6Confident37 Ų3769.8 Ų69.820%0.19836%0.362CS..Hα-helixtrans-65.6-35.4-179.2-166.168.8000111.4K204 F241 S249K204-D245 IonicContact NZ-OD1 2.67Å; K204-D245 PolarHBondContact NZ-OD1 3.29Å; F241-D245 WeakPolarHBondContact O-CB 3.49Å; F241-D245 PolarHBondContact O-N 3.2Å; D245-S249 VanDerWaalsContact O-CB 3.31Å; D245-S249 WeakPolarHBondContact O-CB 3.39Å; D245-S249 PolarHBondContact O-N 3.42Å; D245-S249 PolarHBondContact O-OG 3.42Å
246R83Confident83.4Confident166 Ų16674 Ų7463%0.62638%0.381SS*.Hα-helixtrans-67.5-44.9171.7-80.6-179.5-74.2-154.8-0.2112.1N242 S243 M244 S249 Q250N242-R246 WeakPolarHBondContact O-CB 3.47Å; N242-R246 WeakPolarHBondContact O-CG 3.42Å; N242-R246 PolarHBondContact O-N 3.2Å; N242-R246 PolarHBondContact O-NE 3.24Å; S243-R246 PolarHBondContact O-N 3.29Å; M244-R246 VanDerWaalsContact C-N 3.3Å; M244-R246 PolarHBondContact O-N 2.94Å; R246-S249 PolarHBondContact O-N 3.44Å; R246-Q250 WeakPolarHBondContact O-CB 3.47Å; R246-Q250 PolarHBondContact O-N 2.88Å
247S85.3Confident83.1Confident63 Ų6377.8 Ų77.844%0.44140%0.4SS..Hα-helixtrans-63.5-42.9176.6-64.50000112.4S243 M244 Q250 Q251S243-S247 PolarHBondContact O-N 3.03Å; S243-S247 PolarHBondContact O-OG 3.35Å; M244-S247 PolarHBondContact O-N 3.26Å; S247-Q250 PolarHBondContact O-N 3.18Å; S247-Q251 WeakPolarHBondContact O-CG 3.5Å; S247-Q251 PolarHBondContact O-N 2.92Å
248A81.5Confident82.8Confident45 Ų4583.8 Ų83.837%0.37243%0.432SS..Hα-helixtrans-64.6-41.2176.400000111.6M244 Q251 L252M244-A248 WeakPolarHBondContact O-CB 3.48Å; M244-A248 PolarHBondContact O-N 3.13Å; A248-Q251 PolarHBondContact O-N 2.93Å; A248-L252 WeakPolarHBondContact O-CG 3.48Å; A248-L252 PolarHBondContact O-N 2.88Å; A248-L252 VanDerWaalsContact O-N 3.17Å
249S80.8Confident82.1Confident46 Ų4687.1 Ų87.132%0.32246%0.458SS..Hα-helixtrans-59.7-50.4172.9-61.60000110.2D245 R246 Q251 L252 W253D245-S249 VanDerWaalsContact O-CB 3.31Å; D245-S249 WeakPolarHBondContact O-CB 3.39Å; D245-S249 PolarHBondContact O-N 3.42Å; D245-S249 PolarHBondContact O-OG 3.42Å; R246-S249 PolarHBondContact O-N 3.44Å; S249-Q251 VanDerWaalsContact C-N 3.34Å; S249-Q251 PolarHBondContact O-N 2.88Å; S249-L252 WeakPolarHBondContact O-CB 3.25Å; S249-L252 PolarHBondContact O-N 3.46Å; S249-L252 VanDerWaalsContact O-N 3.09Å; S249-W253 VanDerWaalsContact C-CD1 3.49Å; S249-W253 PolarHBondContact O-N 2.84Å; S249-W253 VanDerWaalsContact O-N 3.11Å
250Q82.4Confident81.4Confident114 Ų11488.9 Ų88.953%0.53347%0.469SS..Hα-helixtrans-56.9-43.9-179.7-172.6178.4-25.500112.7R246 S247 L252 W253 E254R246-Q250 WeakPolarHBondContact O-CB 3.47Å; R246-Q250 PolarHBondContact O-N 2.88Å; S247-Q250 PolarHBondContact O-N 3.18Å; Q250-L252 VanDerWaalsContact C-N 3.32Å; Q250-L252 PolarHBondContact O-N 2.91Å; Q250-W253 PolarHBondContact O-N 3.44Å; Q250-E254 WeakPolarHBondContact CG-OE1 3.35Å; Q250-E254 PolarHBondContact NE2-OE1 2.92Å; Q250-E254 WeakPolarHBondContact O-CG 3.43Å; Q250-E254 PolarHBondContact O-N 3.02Å
251Q80.9Confident80.1Confident130 Ų13096.2 Ų96.261%0.60751%0.507SS*.Hα-helixtrans-62.7-36.4176.5-73174.2-11.300112.9S247 A248 S249 E254 A255S247-Q251 WeakPolarHBondContact O-CG 3.5Å; S247-Q251 PolarHBondContact O-N 2.92Å; A248-Q251 PolarHBondContact O-N 2.93Å; S249-Q251 VanDerWaalsContact C-N 3.34Å; S249-Q251 PolarHBondContact O-N 2.88Å; Q251-E254 PolarHBondContact O-N 2.81Å; Q251-A255 WeakPolarHBondContact O-CB 3.25Å; Q251-A255 PolarHBondContact O-N 3.47Å
252L82.2Confident79.8Confident125 Ų125100.4 Ų100.465%0.65453%0.53SS*.Hα-helixtrans-66.4-40.4175.2-71.4165.2000111.8A248 S249 Q250 A255 E256A248-L252 WeakPolarHBondContact O-CG 3.48Å; A248-L252 PolarHBondContact O-N 2.88Å; A248-L252 VanDerWaalsContact O-N 3.17Å; S249-L252 WeakPolarHBondContact O-CB 3.25Å; S249-L252 PolarHBondContact O-N 3.46Å; S249-L252 VanDerWaalsContact O-N 3.09Å; Q250-L252 VanDerWaalsContact C-N 3.32Å; Q250-L252 PolarHBondContact O-N 2.91Å; L252-A255 PolarHBondContact O-N 3.34Å; L252-E256 PolarHBondContact O-N 3.07Å; L252-E256 VanDerWaalsContact O-N 3.08Å
253W76.8Confident79.6Confident187 Ų187103.9 Ų103.971%0.70855%0.548SS*.Hα-helixtrans-64-39.6174.9-65.2102.3000112.2S249 Q250 N257S249-W253 VanDerWaalsContact C-CD1 3.49Å; S249-W253 PolarHBondContact O-N 2.84Å; S249-W253 VanDerWaalsContact O-N 3.11Å; Q250-W253 PolarHBondContact O-N 3.44Å; W253-N257 PolarHBondContact O-N 3.36Å; W253-N257 PolarHBondContact O-ND2 2.96Å
254E84.3Confident79.3Confident99 Ų99107 Ų10746%0.46356%0.56SS.*Hα-helixtrans-66.1-43.3176.8-71.4168.5-172.300111.4Q250 Q251 E256 N257 D258Q250-E254 WeakPolarHBondContact CG-OE1 3.35Å; Q250-E254 PolarHBondContact NE2-OE1 2.92Å; Q250-E254 WeakPolarHBondContact O-CG 3.43Å; Q250-E254 PolarHBondContact O-N 3.02Å; Q251-E254 PolarHBondContact O-N 2.81Å; E254-E256 PolarHBondContact O-N 3.42Å; E254-N257 PolarHBondContact O-N 2.97Å; E254-D258 PolarHBondContact O-N 3.25Å
255A81.2Confident79.1Confident60 Ų60109 Ų10950%0.49657%0.571SS.*Hα-helixtrans-65.5-36.6178.300000113.4Q251 L252 S259Q251-A255 WeakPolarHBondContact O-CB 3.25Å; Q251-A255 PolarHBondContact O-N 3.47Å; L252-A255 PolarHBondContact O-N 3.34Å; A255-S259 WeakPolarHBondContact O-CB 3.43Å; A255-S259 PolarHBondContact O-N 3.2Å; A255-S259 VanDerWaalsContact O-N 3.14Å; A255-S259 PolarHBondContact O-OG 3.44Å
256E81.2Confident78.8Confident140 Ų140113.5 Ų113.565%0.65460%0.595SS**Hα-helixtrans-69.5-38.3177.9-166.1134.7140.600111.6L252 E254 S259 T260L252-E256 PolarHBondContact O-N 3.07Å; L252-E256 VanDerWaalsContact O-N 3.08Å; E254-E256 PolarHBondContact O-N 3.42Å; E256-S259 PolarHBondContact O-N 2.96Å; E256-S259 PolarHBondContact O-OG 3.46Å; E256-T260 PolarHBondContact O-N 3.44Å; E256-T260 PolarHBondContact O-OG1 3.12Å
257N81Confident78.6Confident106 Ų106110 Ų11057%0.56759%0.593SS**Hα-helixtrans-68.8-34.5175.9-75-18.3000113W253 E254 T260W253-N257 PolarHBondContact O-N 3.36Å; W253-N257 PolarHBondContact O-ND2 2.96Å; E254-N257 PolarHBondContact O-N 2.97Å; N257-T260 PolarHBondContact O-OG1 3.27Å; N257-T260 VanDerWaalsContact O-OG1 3.09Å
258D78.9Confident78.1Confident126 Ų126113.4 Ų113.467%0.67460%0.603SS**Hα-helixtrans-73-28174.9-82.7-6000112.7E254 T260E254-D258 PolarHBondContact O-N 3.25Å; D258-T260 VanDerWaalsContact C-N 3.32Å
259S73.5Confident77.8Confident88 Ų88118.6 Ų118.662%0.61562%0.621SS**Hα-helixtrans-78.8-14.517971.50000114.5A255 E256A255-S259 WeakPolarHBondContact O-CB 3.43Å; A255-S259 PolarHBondContact O-N 3.2Å; A255-S259 VanDerWaalsContact O-N 3.14Å; A255-S259 PolarHBondContact O-OG 3.44Å; E256-S259 PolarHBondContact O-N 2.96Å; E256-S259 PolarHBondContact O-OG 3.46Å
260T70.4Confident77.6Confident114 Ų114124.7 Ų124.770%0.69965%0.646SS**THydrogen-bonded Turntrans-96.22.2-179.841.40000113.3E256 N257 D258E256-T260 PolarHBondContact O-N 3.44Å; E256-T260 PolarHBondContact O-OG1 3.12Å; N257-T260 PolarHBondContact O-OG1 3.27Å; N257-T260 VanDerWaalsContact O-OG1 3.09Å; D258-T260 VanDerWaalsContact C-N 3.32Å
261L58Low77.1Confident207 Ų207125.6 Ų125.6100%1.08466%0.657SS**  trans-112.10-179.5-136.7154.6000110.7

Retrieved 261 of 261 residues in 825 ms (Link to these results)

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