A0A087Y130_POEFO Loading...

VPS37C subunit of ESCRT-I

Component of the ESCRT-I complex, a regulator of vesicular trafficking process. Required for the sorting of endocytic ubiquitinated cargos into multivesicular bodies. May be involved in cell growth and differentiation.

AlphaFold DB , UniProt , Accession A0A087Y130, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 360 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
1M58.5Low77.6Confident182 Ų182115.2 Ų115.290%0.89759%0.589SS**  0-9.10-94.1-129.5-80.900115.2K3 L4M1-K3 VanDerWaalsContact C-N 3.29Å; M1-K3 PolarHBondContact O-N 2.9Å; M1-L4 HydrophobicContact CG-CD1 4.19Å; M1-L4 PolarHBondContact O-N 3.28Å; M1-L4 HydrophobicContact SD-CD1 3.69Å
2E68.6Low78.1Confident157 Ų157112.2 Ų112.273%0.73458%0.575SS**G310 helixtrans-59-36.1-179.4-63.4-177.615300113.6L4 Q5E2-L4 PolarHBondContact O-N 3.45Å; E2-Q5 WeakPolarHBondContact O-CB 3.45Å; E2-Q5 PolarHBondContact O-N 3.03Å
3K71.7Confident78.5Confident115 Ų115111.1 Ų111.150%0.557%0.566SS.*G310 helixtrans-49.2-18.8174-64.4-178.9177.8176.80115.7M1 E28M1-K3 VanDerWaalsContact C-N 3.29Å; M1-K3 PolarHBondContact O-N 2.9Å; K3-E28 PolarHBondContact NZ-O 2.8Å; K3-E28 IonicContact NZ-OE2 3.54Å; K3-E28 PolarHBondContact NZ-OE2 3.48Å
4L77.3Confident79Confident60 Ų60111.9 Ų111.931%0.31457%0.566SS.*G310 helixtrans-86.8-16.1177.2-76.1156.7000113.7M1 E2 L7 L15 M25M1-L4 HydrophobicContact CG-CD1 4.19Å; M1-L4 PolarHBondContact O-N 3.28Å; M1-L4 HydrophobicContact SD-CD1 3.69Å; E2-L4 PolarHBondContact O-N 3.45Å; L4-L7 HydrophobicContact CD2-CD1 4.38Å; L4-L15 HydrophobicContact CD2-CD2 3.95Å; L4-M25 HydrophobicContact CD2-CE 3.74Å; L4-M25 HydrophobicContact CG-CE 3.89Å
5Q77.9Confident79.3Confident159 Ų159105.9 Ų105.974%0.74354%0.536SS*.THydrogen-bonded Turntrans-82.7-22-178.6-58-176.931.500112.4E2E2-Q5 WeakPolarHBondContact O-CB 3.45Å; E2-Q5 PolarHBondContact O-N 3.03Å
6D80.6Confident79.6Confident142 Ų142107.9 Ų107.976%0.75955%0.548SS*.SBendtrans-88.9-4.5-178.1-58.4-47.5000113.8
7L83.4Confident80.2Confident54 Ų54108.1 Ų108.128%0.28355%0.551SS.*  trans-92.7142.4-175.3-68.2169.3000112.4L4 E11 L12L4-L7 HydrophobicContact CD2-CD1 4.38Å; L7-E11 HydrophobicContact CB-CB 4.32Å; L7-E11 HydrophobicContact CD2-CB 4.16Å; L7-L12 HydrophobicContact CB-CD1 3.49Å; L7-L12 VanDerWaalsContact CB-CD1 3.49Å; L7-L12 WeakPolarHBondContact O-CD1 3.1Å
8G86.8Confident80.7Confident31 Ų31105.5 Ų105.532%0.3254%0.538SS..  trans-77.2162.517700000113.8S10 E11 L12G8-S10 VanDerWaalsContact C-N 3.26Å; G8-S10 PolarHBondContact O-N 3.45Å; G8-E11 PolarHBondContact N-OE2 2.96Å; G8-E11 PolarHBondContact O-N 3.46Å; G8-L12 WeakPolarHBondContact O-CD1 3.33Å; G8-L12 PolarHBondContact O-N 3.19Å
9Q83.4Confident81.1Confident182 Ų182105.1 Ų105.185%0.8554%0.543SS*.Hα-helixtrans-55.9-37.5-178.2-175.6-179.1-3.500113.5Q13Q9-Q13 WeakPolarHBondContact O-CB 3.48Å; Q9-Q13 PolarHBondContact O-N 2.8Å; Q9-Q13 VanDerWaalsContact O-N 3.1Å
10S83.4Confident81.5Confident95 Ų95107.1 Ų107.166%0.66455%0.55SS**Hα-helixtrans-68.1-35.1175.946.20000112.9G8 Q13 E14G8-S10 VanDerWaalsContact C-N 3.26Å; G8-S10 PolarHBondContact O-N 3.45Å; S10-Q13 PolarHBondContact O-N 2.99Å; S10-E14 PolarHBondContact O-N 3.17Å
11E82Confident81.7Confident90 Ų90108 Ų10842%0.42155%0.546SS..Hα-helixtrans-76.5-36.5179.5-60.7172.6133.200111.1L7 G8 Q13 E14 L15L7-E11 HydrophobicContact CB-CB 4.32Å; L7-E11 HydrophobicContact CD2-CB 4.16Å; G8-E11 PolarHBondContact N-OE2 2.96Å; G8-E11 PolarHBondContact O-N 3.46Å; E11-Q13 VanDerWaalsContact C-N 3.32Å; E11-E14 PolarHBondContact O-N 3.31Å; E11-L15 WeakPolarHBondContact O-CB 3.45Å; E11-L15 PolarHBondContact O-N 3.24Å
12L83.3Confident83.1Confident79 Ų79102.6 Ų102.641%0.41452%0.524SS..Hα-helixtrans-62.7-39169.4-92.485.5000112L7 G8 L15 L16L7-L12 HydrophobicContact CB-CD1 3.49Å; L7-L12 VanDerWaalsContact CB-CD1 3.49Å; L7-L12 WeakPolarHBondContact O-CD1 3.1Å; G8-L12 WeakPolarHBondContact O-CD1 3.33Å; G8-L12 PolarHBondContact O-N 3.19Å; L12-L15 WeakPolarHBondContact O-CB 3.27Å; L12-L15 PolarHBondContact O-N 3.45Å; L12-L16 PolarHBondContact O-N 3.42Å
13Q83.9Confident84.1Confident98 Ų98100.8 Ų100.846%0.45852%0.515SS..Hα-helixtrans-66.7-45.4177.3-172.861.553.900110.8Q9 S10 E11 L15 L16 D17Q9-Q13 WeakPolarHBondContact O-CB 3.48Å; Q9-Q13 PolarHBondContact O-N 2.8Å; Q9-Q13 VanDerWaalsContact O-N 3.1Å; S10-Q13 PolarHBondContact O-N 2.99Å; E11-Q13 VanDerWaalsContact C-N 3.32Å; Q13-L15 VanDerWaalsContact C-N 3.28Å; Q13-L15 PolarHBondContact O-N 3.13Å; Q13-L16 PolarHBondContact O-N 2.94Å; Q13-L16 VanDerWaalsContact O-N 3.14Å; Q13-D17 VanDerWaalsContact NE2-CG 3.34Å; Q13-D17 PolarHBondContact NE2-OD1 2.97Å; Q13-D17 PolarHBondContact NE2-OD2 3.37Å; Q13-D17 WeakPolarHBondContact O-CB 3.37Å; Q13-D17 VanDerWaalsContact O-CG 3.26Å; Q13-D17 PolarHBondContact O-N 3.14Å
14E84.9Confident84.9Confident122 Ų12297.7 Ų97.757%0.5751%0.508SS*.Hα-helixtrans-59-38.3172.6-174.6-179.2177.700112.2S10 E11 D17 N18S10-E14 PolarHBondContact O-N 3.17Å; E11-E14 PolarHBondContact O-N 3.31Å; E14-D17 PolarHBondContact O-N 2.91Å; E14-N18 VanDerWaalsContact O-CB 3.27Å; E14-N18 WeakPolarHBondContact O-CB 3.45Å; E14-N18 PolarHBondContact O-N 3.37Å
15L84.2Confident85.3Confident22 Ų2296.7 Ų96.712%0.11550%0.502CS..Hα-helixtrans-63.9-42.8174.5-136.987.8000112L4 E11 L12 Q13 D17 N18 R21 V22 M25L4-L15 HydrophobicContact CD2-CD2 3.95Å; E11-L15 WeakPolarHBondContact O-CB 3.45Å; E11-L15 PolarHBondContact O-N 3.24Å; L12-L15 WeakPolarHBondContact O-CB 3.27Å; L12-L15 PolarHBondContact O-N 3.45Å; Q13-L15 VanDerWaalsContact C-N 3.28Å; Q13-L15 PolarHBondContact O-N 3.13Å; L15-D17 VanDerWaalsContact C-N 3.33Å; L15-N18 PolarHBondContact O-N 3.36Å; L15-R21 HydrophobicContact CD1-CB 4.3Å; L15-R21 HydrophobicContact CD1-CG 3.55Å; L15-R21 HydrophobicContact CG-CG 4.38Å; L15-V22 HydrophobicContact CD2-CG2 4.13Å; L15-V22 HydrophobicContact CG-CG2 4Å; L15-V22 WeakPolarHBondContact O-CG2 3.43Å; L15-M25 HydrophobicContact CD1-SD 3.6Å; L15-M25 VanDerWaalsContact CD1-SD 3.6Å; L15-M25 HydrophobicContact CD2-CE 3.96Å; L15-M25 HydrophobicContact CD2-SD 3.69Å; L15-M25 HydrophobicContact CG-SD 4.23Å
16L84.1Confident85.8Confident138 Ų13890.9 Ų90.972%0.72348%0.481SS*.Hα-helixtrans-67.3-36.1179.4-166.272.8000111.9L12 Q13L12-L16 PolarHBondContact O-N 3.42Å; Q13-L16 PolarHBondContact O-N 2.94Å; Q13-L16 VanDerWaalsContact O-N 3.14Å
17D89.8Confident86.2Confident112 Ų11288.6 Ų88.660%0.59947%0.466SS*.Hα-helixtrans-82.9-11.4-179-63.4-30.4000112.9Q13 E14 L15Q13-D17 VanDerWaalsContact NE2-CG 3.34Å; Q13-D17 PolarHBondContact NE2-OD1 2.97Å; Q13-D17 PolarHBondContact NE2-OD2 3.37Å; Q13-D17 WeakPolarHBondContact O-CB 3.37Å; Q13-D17 VanDerWaalsContact O-CG 3.26Å; Q13-D17 PolarHBondContact O-N 3.14Å; E14-D17 PolarHBondContact O-N 2.91Å; L15-D17 VanDerWaalsContact C-N 3.33Å
18N89.8Confident86.5Confident61 Ų6190.8 Ų90.833%0.32648%0.475SS..  trans-12596.3179.6-171.2-14.5000113.1E14 L15 E20 R21 V22E14-N18 VanDerWaalsContact O-CB 3.27Å; E14-N18 WeakPolarHBondContact O-CB 3.45Å; E14-N18 PolarHBondContact O-N 3.37Å; L15-N18 PolarHBondContact O-N 3.36Å; N18-E20 VanDerWaalsContact C-N 3.33Å; N18-E20 PolarHBondContact O-N 2.94Å; N18-E20 PolarHBondContact OD1-N 2.74Å; N18-R21 HydrophobicContact CB-CB 4.11Å; N18-R21 WeakPolarHBondContact O-CB 3.39Å; N18-R21 PolarHBondContact O-N 2.91Å; N18-R21 VanDerWaalsContact O-N 3.13Å; N18-V22 PolarHBondContact O-N 3.1Å
19P86.8Confident86.7Confident97 Ų9790.6 Ų90.663%0.6347%0.469SS*.Hα-helixtrans-66.2-29.6-175.527-34.9000113.9R21 V22 E23P19-R21 PolarHBondContact O-N 2.91Å; P19-V22 PolarHBondContact O-N 3.5Å; P19-E23 PolarHBondContact O-N 3.04Å
20E90.5Very high87.1Confident146 Ų14688.4 Ų88.468%0.68246%0.463SS*.Hα-helixtrans-66.7-29.6177.1-63.7-172.3-177.100111.5N18 S24N18-E20 VanDerWaalsContact C-N 3.33Å; N18-E20 PolarHBondContact O-N 2.94Å; N18-E20 PolarHBondContact OD1-N 2.74Å; E20-S24 WeakPolarHBondContact O-CB 3.35Å; E20-S24 PolarHBondContact O-N 3.2Å; E20-S24 PolarHBondContact O-OG 2.98Å
21R85.6Confident87.6Confident126 Ų12689.7 Ų89.748%0.47546%0.459SS..Hα-helixtrans-69.4-40.3175.1-160.572.5178.5125.24111.3L15 N18 P19 M25L15-R21 HydrophobicContact CD1-CB 4.3Å; L15-R21 HydrophobicContact CD1-CG 3.55Å; L15-R21 HydrophobicContact CG-CG 4.38Å; N18-R21 HydrophobicContact CB-CB 4.11Å; N18-R21 WeakPolarHBondContact O-CB 3.39Å; N18-R21 PolarHBondContact O-N 2.91Å; N18-R21 VanDerWaalsContact O-N 3.13Å; P19-R21 PolarHBondContact O-N 2.91Å; R21-M25 PolarHBondContact O-N 2.92Å
22V87.9Confident88.1Confident69 Ų6988.3 Ų88.342%0.41845%0.453SS..Hα-helixtrans-66.1-44.7174-178.20000110.9L15 N18 P19 S24 M25 A26L15-V22 HydrophobicContact CD2-CG2 4.13Å; L15-V22 HydrophobicContact CG-CG2 4Å; L15-V22 WeakPolarHBondContact O-CG2 3.43Å; N18-V22 PolarHBondContact O-N 3.1Å; P19-V22 PolarHBondContact O-N 3.5Å; V22-S24 PolarHBondContact O-N 2.88Å; V22-M25 PolarHBondContact O-N 3.19Å; V22-A26 WeakPolarHBondContact O-CB 3.37Å; V22-A26 PolarHBondContact O-N 3.35Å
23E88.6Confident88.7Confident119 Ų11989.1 Ų89.156%0.55646%0.455SS*.Hα-helixtrans-63.8-40.6177.4-176.9165.3-165.700111.7P19 A26 Q27P19-E23 PolarHBondContact O-N 3.04Å; E23-A26 WeakPolarHBondContact O-CB 3.19Å; E23-A26 PolarHBondContact O-N 3.27Å; E23-Q27 WeakPolarHBondContact O-CG 3.49Å; E23-Q27 PolarHBondContact O-N 2.83Å
24S88.2Confident89.3Confident50 Ų5088.1 Ų88.135%0.3545%0.453SS..Hα-helixtrans-59-48.3172.9-58.50000111.5E20 V22 A26 Q27 E28E20-S24 WeakPolarHBondContact O-CB 3.35Å; E20-S24 PolarHBondContact O-N 3.2Å; E20-S24 PolarHBondContact O-OG 2.98Å; V22-S24 PolarHBondContact O-N 2.88Å; S24-A26 VanDerWaalsContact C-N 3.28Å; S24-A26 PolarHBondContact O-N 3.29Å; S24-Q27 PolarHBondContact O-N 3.35Å; S24-E28 WeakPolarHBondContact O-CG 3.46Å; S24-E28 PolarHBondContact O-N 2.62Å
25M85.8Confident89.9Confident39 Ų3984.8 Ų84.819%0.19244%0.438CS..Hα-helixtrans-63.4-31.4176.1-84.9-177.651.100113.5L4 L15 R21 V22 E28 S29L4-M25 HydrophobicContact CD2-CE 3.74Å; L4-M25 HydrophobicContact CG-CE 3.89Å; L15-M25 HydrophobicContact CD1-SD 3.6Å; L15-M25 VanDerWaalsContact CD1-SD 3.6Å; L15-M25 HydrophobicContact CD2-CE 3.96Å; L15-M25 HydrophobicContact CD2-SD 3.69Å; L15-M25 HydrophobicContact CG-SD 4.23Å; R21-M25 PolarHBondContact O-N 2.92Å; V22-M25 PolarHBondContact O-N 3.19Å; M25-E28 CarbonylContact O-C 3.57Å; M25-S29 PolarHBondContact O-N 3.3Å
26A88.3Confident90.4Very high37 Ų3787.4 Ų87.431%0.30645%0.45SS..Hα-helixtrans-71.1-42.8172.800000111.3V22 E23 S24 E28 S29 I32V22-A26 WeakPolarHBondContact O-CB 3.37Å; V22-A26 PolarHBondContact O-N 3.35Å; E23-A26 WeakPolarHBondContact O-CB 3.19Å; E23-A26 PolarHBondContact O-N 3.27Å; S24-A26 VanDerWaalsContact C-N 3.28Å; S24-A26 PolarHBondContact O-N 3.29Å; A26-E28 PolarHBondContact O-N 2.85Å; A26-S29 VanDerWaalsContact O-CB 3.24Å; A26-S29 WeakPolarHBondContact O-CB 3.47Å; A26-S29 PolarHBondContact O-N 3.19Å; A26-S29 PolarHBondContact O-OG 2.86Å; A26-I32 HydrophobicContact CB-CD1 4.03Å; A26-I32 WeakPolarHBondContact O-CB 3.24Å; A26-I32 WeakPolarHBondContact O-CD1 3.42Å
27Q90Very high91.1Very high93 Ų9385.3 Ų85.344%0.43544%0.439SS..Hα-helixtrans-62.8-31.2173.7-69.1179.115.600112.2E23 S24 S29 Q33E23-Q27 WeakPolarHBondContact O-CG 3.49Å; E23-Q27 PolarHBondContact O-N 2.83Å; S24-Q27 PolarHBondContact O-N 3.35Å; Q27-S29 VanDerWaalsContact C-N 3.29Å; Q27-S29 PolarHBondContact O-N 3.26Å; Q27-Q33 PolarHBondContact O-NE2 2.92Å
28E88.8Confident91.5Very high100 Ų10082.4 Ų82.447%0.46742%0.422SS..THydrogen-bonded Turntrans-81.27.1170.5-68.5-179.1-152.900115K3 S24 M25 A26K3-E28 PolarHBondContact NZ-O 2.8Å; K3-E28 IonicContact NZ-OE2 3.54Å; K3-E28 PolarHBondContact NZ-OE2 3.48Å; S24-E28 WeakPolarHBondContact O-CG 3.46Å; S24-E28 PolarHBondContact O-N 2.62Å; M25-E28 CarbonylContact O-C 3.57Å; A26-E28 PolarHBondContact O-N 2.85Å
29S92Very high91.8Very high28 Ų2886 Ų8620%0.19643%0.431CS..SBendtrans-79141.8173.169.10000110.9M25 A26 Q27 E31 I32 Q33M25-S29 PolarHBondContact O-N 3.3Å; A26-S29 VanDerWaalsContact O-CB 3.24Å; A26-S29 WeakPolarHBondContact O-CB 3.47Å; A26-S29 PolarHBondContact O-N 3.19Å; A26-S29 PolarHBondContact O-OG 2.86Å; Q27-S29 VanDerWaalsContact C-N 3.29Å; Q27-S29 PolarHBondContact O-N 3.26Å; S29-E31 PolarHBondContact O-N 3.36Å; S29-I32 PolarHBondContact O-N 3.28Å; S29-I32 WeakPolarHBondContact OG-CB 3.43Å; S29-I32 PolarHBondContact OG-N 3.03Å; S29-Q33 WeakPolarHBondContact O-CB 3.46Å; S29-Q33 WeakPolarHBondContact O-CG 3.47Å; S29-Q33 PolarHBondContact O-N 2.91Å
30D91.6Very high92.4Very high135 Ų13587 Ų8772%0.72243%0.427SS*.Hα-helixtrans-61.4-32.9-179.1-58.4-47.9000111.3N34D30-N34 VanDerWaalsContact O-CB 3.24Å; D30-N34 WeakPolarHBondContact O-CB 3.38Å; D30-N34 PolarHBondContact O-N 3.28Å
31E92.8Very high92.8Very high123 Ų12386 Ų8658%0.57542%0.424SS*.Hα-helixtrans-64.4-46176.2-60.389162.900112.2S29 I35S29-E31 PolarHBondContact O-N 3.36Å; E31-I35 WeakPolarHBondContact O-CD1 3.36Å; E31-I35 VanDerWaalsContact O-CG1 3.26Å; E31-I35 WeakPolarHBondContact O-CG1 3.37Å; E31-I35 PolarHBondContact O-N 2.92Å; E31-I35 VanDerWaalsContact O-N 3.1Å
32I94.3Very high93.3Very high60 Ų6083 Ų8331%0.30843%0.425SS..Hα-helixtrans-73.4-38.4178.5-74.1168.1000111.1A26 S29 I35 Q36A26-I32 HydrophobicContact CB-CD1 4.03Å; A26-I32 WeakPolarHBondContact O-CB 3.24Å; A26-I32 WeakPolarHBondContact O-CD1 3.42Å; S29-I32 PolarHBondContact O-N 3.28Å; S29-I32 WeakPolarHBondContact OG-CB 3.43Å; S29-I32 PolarHBondContact OG-N 3.03Å; I32-I35 PolarHBondContact O-N 3.22Å; I32-Q36 HydrophobicContact CG2-CG 4.46Å; I32-Q36 WeakPolarHBondContact O-CG 3.48Å; I32-Q36 PolarHBondContact O-N 3.49Å
33Q95.4Very high93.9Very high96 Ų9684.3 Ų84.345%0.44943%0.43SS..Hα-helixtrans-60-44.4173.2-72.7-66.4-42.600111.7Q27 S29 I35 Q36 L37Q27-Q33 PolarHBondContact O-NE2 2.92Å; S29-Q33 WeakPolarHBondContact O-CB 3.46Å; S29-Q33 WeakPolarHBondContact O-CG 3.47Å; S29-Q33 PolarHBondContact O-N 2.91Å; Q33-I35 PolarHBondContact O-N 3.33Å; Q33-Q36 PolarHBondContact O-N 2.88Å; Q33-L37 WeakPolarHBondContact O-CB 3.28Å; Q33-L37 PolarHBondContact O-N 3.3Å
34N96.3Very high94.3Very high77 Ų7781.6 Ų81.641%0.41243%0.428SS..Hα-helixtrans-64-40.5176.6-176.173.5000112.1D30 Q36 L37 E38D30-N34 VanDerWaalsContact O-CB 3.24Å; D30-N34 WeakPolarHBondContact O-CB 3.38Å; D30-N34 PolarHBondContact O-N 3.28Å; N34-Q36 PolarHBondContact O-N 3.48Å; N34-L37 PolarHBondContact O-N 3.19Å; N34-E38 PolarHBondContact ND2-OE1 2.76Å; N34-E38 WeakPolarHBondContact O-CB 3.44Å; N34-E38 WeakPolarHBondContact O-CG 3.44Å; N34-E38 PolarHBondContact O-N 3.26Å
35I96.8Very high94.8Very high53 Ų5382.1 Ų82.127%0.27244%0.435SS..Hα-helixtrans-64.5-38.5174.9-68.9164.3000111.7E31 I32 Q33 R39 A303 F304E31-I35 WeakPolarHBondContact O-CD1 3.36Å; E31-I35 VanDerWaalsContact O-CG1 3.26Å; E31-I35 WeakPolarHBondContact O-CG1 3.37Å; E31-I35 PolarHBondContact O-N 2.92Å; E31-I35 VanDerWaalsContact O-N 3.1Å; I32-I35 PolarHBondContact O-N 3.22Å; Q33-I35 PolarHBondContact O-N 3.33Å; I35-R39 WeakPolarHBondContact O-CB 3.29Å; I35-R39 PolarHBondContact O-N 3.41Å; I35-A303 HydrophobicContact CD1-CB 3.68Å; I35-A303 HydrophobicContact CG1-CB 4.08Å; I35-F304 HydrophobicContact CG2-CD2 4.14Å; I35-F304 HydrophobicContact CG2-CE2 3.82Å
36Q96.2Very high95.4Very high76 Ų7685.6 Ų85.636%0.35545%0.454SS..Hα-helixtrans-64.9-44174.7-71.9-17832.800111.3I32 Q33 N34 R39 E40I32-Q36 HydrophobicContact CG2-CG 4.46Å; I32-Q36 WeakPolarHBondContact O-CG 3.48Å; I32-Q36 PolarHBondContact O-N 3.49Å; Q33-Q36 PolarHBondContact O-N 2.88Å; N34-Q36 PolarHBondContact O-N 3.48Å; Q36-R39 WeakPolarHBondContact O-CB 3.38Å; Q36-R39 PolarHBondContact O-N 2.93Å; Q36-E40 WeakPolarHBondContact O-CG 3.35Å; Q36-E40 PolarHBondContact O-N 3.48Å
37L97.2Very high95.9Very high95 Ų9591.6 Ų91.650%0.49747%0.469SS..Hα-helixtrans-62.3-46.7175.8-178.163.5000112.2Q33 N34 R39 E40 M41Q33-L37 WeakPolarHBondContact O-CB 3.28Å; Q33-L37 PolarHBondContact O-N 3.3Å; N34-L37 PolarHBondContact O-N 3.19Å; L37-R39 VanDerWaalsContact C-N 3.29Å; L37-R39 PolarHBondContact O-N 2.88Å; L37-E40 PolarHBondContact O-N 3.35Å; L37-M41 HydrophobicContact CD1-CG 4.39Å; L37-M41 HydrophobicContact CG-SD 4.27Å; L37-M41 WeakPolarHBondContact O-CB 3.49Å; L37-M41 WeakPolarHBondContact O-CG 3.24Å; L37-M41 PolarHBondContact O-N 3.31Å
38E97.8Very high96.3Very high51 Ų5190.6 Ų90.624%0.23847%0.473CS..Hα-helixtrans-56.5-43.2174.6-78.2179.7-160.100111.3N34 A42 S302N34-E38 PolarHBondContact ND2-OE1 2.76Å; N34-E38 WeakPolarHBondContact O-CB 3.44Å; N34-E38 WeakPolarHBondContact O-CG 3.44Å; N34-E38 PolarHBondContact O-N 3.26Å; E38-A42 VanDerWaalsContact O-CB 3.32Å; E38-A42 WeakPolarHBondContact O-CB 3.45Å; E38-A42 PolarHBondContact O-N 3.26Å; E38-S302 WeakPolarHBondContact OE2-CB 3.39Å; E38-S302 PolarHBondContact OE2-OG 3.34Å
39R98.1Very high96.7Very high137 Ų13790 Ų9052%0.51747%0.472SS..Hα-helixtrans-62.9-46.1175.7172.1179.3174.3-98.92.5112.2I35 Q36 L37 A42 L43I35-R39 WeakPolarHBondContact O-CB 3.29Å; I35-R39 PolarHBondContact O-N 3.41Å; Q36-R39 WeakPolarHBondContact O-CB 3.38Å; Q36-R39 PolarHBondContact O-N 2.93Å; L37-R39 VanDerWaalsContact C-N 3.29Å; L37-R39 PolarHBondContact O-N 2.88Å; R39-A42 PolarHBondContact O-N 2.89Å; R39-L43 HydrophobicContact CG-CD1 3.99Å; R39-L43 WeakPolarHBondContact O-CB 3.43Å; R39-L43 VanDerWaalsContact O-CG 3.28Å; R39-L43 WeakPolarHBondContact O-CG 3.26Å; R39-L43 PolarHBondContact O-N 3.38Å
40E98.1Very high97Very high117 Ų11790.7 Ų90.755%0.54748%0.479SS..Hα-helixtrans-66.1-42.1179.4-73.4-172174.300112.1Q36 L37 A42 L43 A44Q36-E40 WeakPolarHBondContact O-CG 3.35Å; Q36-E40 PolarHBondContact O-N 3.48Å; L37-E40 PolarHBondContact O-N 3.35Å; E40-A42 PolarHBondContact O-N 2.94Å; E40-L43 PolarHBondContact O-N 3.03Å; E40-A44 WeakPolarHBondContact O-CB 3.31Å; E40-A44 PolarHBondContact O-N 3.37Å
41M98.2Very high97.3Very high126 Ų12688.4 Ų88.462%0.62146%0.464SS*.Hα-helixtrans-59.8-44.5173-72.9-17763.800111.8L37 A44 A45L37-M41 HydrophobicContact CD1-CG 4.39Å; L37-M41 HydrophobicContact CG-SD 4.27Å; L37-M41 WeakPolarHBondContact O-CB 3.49Å; L37-M41 WeakPolarHBondContact O-CG 3.24Å; L37-M41 PolarHBondContact O-N 3.31Å; M41-A44 PolarHBondContact O-N 2.95Å; M41-A45 WeakPolarHBondContact O-CB 3.47Å; M41-A45 PolarHBondContact O-N 2.82Å
42A98.1Very high97.5Very high61 Ų6187.5 Ų87.550%0.50446%0.46SS..Hα-helixtrans-64.6-40.3177.400000112.4E38 R39 E40 N46E38-A42 VanDerWaalsContact O-CB 3.32Å; E38-A42 WeakPolarHBondContact O-CB 3.45Å; E38-A42 PolarHBondContact O-N 3.26Å; R39-A42 PolarHBondContact O-N 2.89Å; E40-A42 PolarHBondContact O-N 2.94Å; A42-N46 VanDerWaalsContact O-CB 3.31Å; A42-N46 WeakPolarHBondContact O-CB 3.49Å; A42-N46 PolarHBondContact O-N 2.87Å
43L98.5Very high97.7Very high98 Ų9889.2 Ų89.251%0.51347%0.47SS..Hα-helixtrans-65.6-43.2175.4-73.7170.3000111.8R39 E40 N46 R47R39-L43 HydrophobicContact CG-CD1 3.99Å; R39-L43 WeakPolarHBondContact O-CB 3.43Å; R39-L43 VanDerWaalsContact O-CG 3.28Å; R39-L43 WeakPolarHBondContact O-CG 3.26Å; R39-L43 PolarHBondContact O-N 3.38Å; E40-L43 PolarHBondContact O-N 3.03Å; L43-N46 PolarHBondContact O-N 3Å; L43-R47 VanDerWaalsContact O-CB 3.29Å; L43-R47 WeakPolarHBondContact O-CB 3.33Å; L43-R47 PolarHBondContact O-N 3.42Å
44A98.3Very high97.8Very high62 Ų6290.1 Ų90.151%0.51248%0.477SS..Hα-helixtrans-63.4-43.417600000111.9E40 M41 R47 S48E40-A44 WeakPolarHBondContact O-CB 3.31Å; E40-A44 PolarHBondContact O-N 3.37Å; M41-A44 PolarHBondContact O-N 2.95Å; A44-R47 PolarHBondContact O-N 2.88Å; A44-S48 WeakPolarHBondContact O-CB 3.32Å; A44-S48 PolarHBondContact O-N 2.88Å
45A98.3Very high97.8Very high60 Ų6091.9 Ų91.950%0.49649%0.487SS..Hα-helixtrans-64.4-44.2176.100000112.2M41 S48 L49M41-A45 WeakPolarHBondContact O-CB 3.47Å; M41-A45 PolarHBondContact O-N 2.82Å; A45-S48 PolarHBondContact O-N 3.45Å; A45-L49 WeakPolarHBondContact O-CB 3.42Å; A45-L49 PolarHBondContact O-N 3.1Å
46N98.4Very high97.9Very high112 Ų11293.2 Ų93.260%0.59949%0.493SS*.Hα-helixtrans-62.1-43.6176.3-174.3-90.4000111.7A42 L43 L49 A50A42-N46 VanDerWaalsContact O-CB 3.31Å; A42-N46 WeakPolarHBondContact O-CB 3.49Å; A42-N46 PolarHBondContact O-N 2.87Å; L43-N46 PolarHBondContact O-N 3Å; N46-L49 PolarHBondContact O-N 3.11Å; N46-A50 WeakPolarHBondContact O-CB 3.48Å; N46-A50 PolarHBondContact O-N 3.4Å
47R98.4Very high97.9Very high163 Ų16396.2 Ų96.262%0.61551%0.505SS*.Hα-helixtrans-61.2-49.1176.7-178.6176.6179.4132.712.6112L43 A44 L49 A50 E51L43-R47 VanDerWaalsContact O-CB 3.29Å; L43-R47 WeakPolarHBondContact O-CB 3.33Å; L43-R47 PolarHBondContact O-N 3.42Å; A44-R47 PolarHBondContact O-N 2.88Å; R47-L49 VanDerWaalsContact C-N 3.31Å; R47-L49 PolarHBondContact O-N 3.31Å; R47-A50 WeakPolarHBondContact O-CB 3.4Å; R47-A50 PolarHBondContact O-N 3.37Å; R47-A50 VanDerWaalsContact O-N 3.12Å; R47-E51 HydrophobicContact CG-CG 4.48Å; R47-E51 IonicContact CZ-OE1 3.27Å; R47-E51 IonicContact NE-OE1 3.46Å; R47-E51 PolarHBondContact NE-OE1 3.03Å; R47-E51 IonicContact NH2-OE1 3.35Å; R47-E51 PolarHBondContact NH2-OE1 3.12Å; R47-E51 WeakPolarHBondContact O-CG 3.46Å; R47-E51 PolarHBondContact O-N 2.92Å
48S98.1Very high97.9Very high73 Ų7395.8 Ų95.851%0.5151%0.507SS..Hα-helixtrans-57-44.3176.9178.50000111.7A44 A45 E51 Q52A44-S48 WeakPolarHBondContact O-CB 3.32Å; A44-S48 PolarHBondContact O-N 2.88Å; A45-S48 PolarHBondContact O-N 3.45Å; S48-E51 PolarHBondContact O-N 3.44Å; S48-Q52 WeakPolarHBondContact O-CB 3.34Å; S48-Q52 PolarHBondContact O-N 2.92Å
49L98.4Very high97.9Very high87 Ų87100.8 Ų100.846%0.45552%0.524SS..Hα-helixtrans-67-36.4176.2-174.163.5000112.6A45 N46 R47 N53A45-L49 WeakPolarHBondContact O-CB 3.42Å; A45-L49 PolarHBondContact O-N 3.1Å; N46-L49 PolarHBondContact O-N 3.11Å; R47-L49 VanDerWaalsContact C-N 3.31Å; R47-L49 PolarHBondContact O-N 3.31Å; L49-N53 WeakPolarHBondContact O-CB 3.41Å; L49-N53 VanDerWaalsContact O-CG 3.25Å; L49-N53 PolarHBondContact O-N 2.95Å; L49-N53 PolarHBondContact O-ND2 3.21Å
50A98.3Very high97.9Very high42 Ų4299.7 Ų99.735%0.34753%0.528SS..Hα-helixtrans-66.3-44175.400000111.8N46 R47 N53 L54N46-A50 WeakPolarHBondContact O-CB 3.48Å; N46-A50 PolarHBondContact O-N 3.4Å; R47-A50 WeakPolarHBondContact O-CB 3.4Å; R47-A50 PolarHBondContact O-N 3.37Å; R47-A50 VanDerWaalsContact O-N 3.12Å; A50-N53 PolarHBondContact O-N 3.43Å; A50-L54 WeakPolarHBondContact O-CG 3.16Å; A50-L54 PolarHBondContact O-N 3.41Å
51E97.6Very high97.9Very high88 Ų8897.9 Ų97.941%0.41152%0.519SS..Hα-helixtrans-61.4-47.9175-71.5170.9177.600110.4R47 S48 N53 L54 D55R47-E51 HydrophobicContact CG-CG 4.48Å; R47-E51 IonicContact CZ-OE1 3.27Å; R47-E51 IonicContact NE-OE1 3.46Å; R47-E51 PolarHBondContact NE-OE1 3.03Å; R47-E51 IonicContact NH2-OE1 3.35Å; R47-E51 PolarHBondContact NH2-OE1 3.12Å; R47-E51 WeakPolarHBondContact O-CG 3.46Å; R47-E51 PolarHBondContact O-N 2.92Å; S48-E51 PolarHBondContact O-N 3.44Å; E51-N53 VanDerWaalsContact C-N 3.33Å; E51-N53 PolarHBondContact O-N 2.91Å; E51-L54 WeakPolarHBondContact O-CB 3.36Å; E51-L54 PolarHBondContact O-N 2.94Å; E51-L54 VanDerWaalsContact O-N 3.11Å; E51-D55 PolarHBondContact O-N 3.3Å
52Q97.8Very high97.9Very high104 Ų10494.8 Ų94.849%0.48651%0.51SS..Hα-helixtrans-59.2-39.3174.9-170.6-17620.800113.4S48 D55 M56S48-Q52 WeakPolarHBondContact O-CB 3.34Å; S48-Q52 PolarHBondContact O-N 2.92Å; Q52-D55 PolarHBondContact O-N 3.49Å; Q52-M56 WeakPolarHBondContact O-CG 3.45Å; Q52-M56 PolarHBondContact O-N 3.35Å; Q52-M56 VanDerWaalsContact O-N 3.11Å
53N97.7Very high98Very high96 Ų9696.5 Ų96.551%0.51351%0.51SS..Hα-helixtrans-67.2-37176.4-79.3-44.8000112.2L49 A50 E51 M56 K57L49-N53 WeakPolarHBondContact O-CB 3.41Å; L49-N53 VanDerWaalsContact O-CG 3.25Å; L49-N53 PolarHBondContact O-N 2.95Å; L49-N53 PolarHBondContact O-ND2 3.21Å; A50-N53 PolarHBondContact O-N 3.43Å; E51-N53 VanDerWaalsContact C-N 3.33Å; E51-N53 PolarHBondContact O-N 2.91Å; N53-M56 PolarHBondContact O-N 3.43Å; N53-K57 PolarHBondContact O-N 2.96Å
54L97.4Very high98Very high115 Ų11597.1 Ų97.160%0.60251%0.509SS*.Hα-helixtrans-66.7-40.5174.7-70.8170.6000111.4A50 E51 M56 K57 P58A50-L54 WeakPolarHBondContact O-CG 3.16Å; A50-L54 PolarHBondContact O-N 3.41Å; E51-L54 WeakPolarHBondContact O-CB 3.36Å; E51-L54 PolarHBondContact O-N 2.94Å; E51-L54 VanDerWaalsContact O-N 3.11Å; L54-M56 VanDerWaalsContact C-N 3.31Å; L54-M56 PolarHBondContact O-N 3.32Å; L54-K57 VanDerWaalsContact O-CB 3.3Å; L54-K57 WeakPolarHBondContact O-CB 3.44Å; L54-K57 PolarHBondContact O-N 3.27Å; L54-P58 WeakPolarHBondContact O-CD 3.38Å
55D97Very high98Very high113 Ų113100 Ų10060%0.60451%0.512SS*.Hα-helixtrans-65.1-31.2176-72-17.5000113.1E51 Q52 P58E51-D55 PolarHBondContact O-N 3.3Å; Q52-D55 PolarHBondContact O-N 3.49Å; D55-P58 WeakPolarHBondContact O-CD 3.42Å; D55-P58 WeakPolarHBondContact O-CG 3.3Å
56M97.6Very high98Very high82 Ų8299.7 Ų99.740%0.40451%0.509SS..Hα-helixtrans-76.8-24.9175.1-72.1-60.798.900113.7Q52 N53 L54 R59 L60Q52-M56 WeakPolarHBondContact O-CG 3.45Å; Q52-M56 PolarHBondContact O-N 3.35Å; Q52-M56 VanDerWaalsContact O-N 3.11Å; N53-M56 PolarHBondContact O-N 3.43Å; L54-M56 VanDerWaalsContact C-N 3.31Å; L54-M56 PolarHBondContact O-N 3.32Å; M56-R59 PolarHBondContact O-N 2.63Å; M56-L60 WeakPolarHBondContact O-CG 3.42Å; M56-L60 PolarHBondContact O-N 3.24Å
57K97.4Very high98Very high139 Ų13999.1 Ų99.160%0.60451%0.505SS*.Hα-helixtrans-54-51-179.9-171.6175178.5176.90114.6N53 L54 R59 L60 E61N53-K57 PolarHBondContact O-N 2.96Å; L54-K57 VanDerWaalsContact O-CB 3.3Å; L54-K57 WeakPolarHBondContact O-CB 3.44Å; L54-K57 PolarHBondContact O-N 3.27Å; K57-R59 VanDerWaalsContact C-N 3.29Å; K57-R59 PolarHBondContact O-N 3.17Å; K57-L60 PolarHBondContact O-N 3.44Å; K57-E61 PolarHBondContact O-N 2.9Å
58P97.3Very high98Very high85 Ų8595.7 Ų95.755%0.55250%0.503SS*.Hα-helixtrans-63.8-33.1179.224.8-35.1000112.9L54 D55 S62L54-P58 WeakPolarHBondContact O-CD 3.38Å; D55-P58 WeakPolarHBondContact O-CD 3.42Å; D55-P58 WeakPolarHBondContact O-CG 3.3Å; P58-S62 WeakPolarHBondContact O-CB 3.44Å; P58-S62 PolarHBondContact O-N 2.96Å; P58-S62 PolarHBondContact O-OG 3.41Å
59R97.3Very high98Very high156 Ų15694.2 Ų94.259%0.58949%0.494SS*.Hα-helixtrans-68.7-39.6175.3-175.9172.9176.8-113.3-2111.9M56 K57 S62 L63M56-R59 PolarHBondContact O-N 2.63Å; K57-R59 VanDerWaalsContact C-N 3.29Å; K57-R59 PolarHBondContact O-N 3.17Å; R59-S62 PolarHBondContact O-OG 3.11Å; R59-S62 VanDerWaalsContact O-OG 3.13Å; R59-L63 HydrophobicContact CG-CD1 4.21Å; R59-L63 WeakPolarHBondContact O-CB 3.4Å; R59-L63 WeakPolarHBondContact O-CD1 3.22Å; R59-L63 VanDerWaalsContact O-CG 3.22Å; R59-L63 WeakPolarHBondContact O-CG 3.46Å; R59-L63 PolarHBondContact O-N 2.66Å; R59-L63 VanDerWaalsContact O-N 3.16Å
60L98.3Very high98Very high114 Ų11498.1 Ų98.160%0.59750%0.503SS*.Hα-helixtrans-68.4-42.1176-69.7172.8000112M56 K57 L63 K64M56-L60 WeakPolarHBondContact O-CG 3.42Å; M56-L60 PolarHBondContact O-N 3.24Å; K57-L60 PolarHBondContact O-N 3.44Å; L60-L63 PolarHBondContact O-N 3.23Å; L60-K64 WeakPolarHBondContact O-CB 3.42Å; L60-K64 PolarHBondContact O-N 2.98Å
61E98.3Very high98.1Very high79 Ų79103.3 Ų103.337%0.36952%0.515SS..Hα-helixtrans-68.2-43.8-179.7-16362.1-152.800111.5K57 L63 K64 E65K57-E61 PolarHBondContact O-N 2.9Å; E61-L63 PolarHBondContact O-N 2.98Å; E61-K64 VanDerWaalsContact CD-NZ 3.3Å; E61-K64 WeakPolarHBondContact O-CB 3.41Å; E61-K64 PolarHBondContact O-N 3.03Å; E61-K64 VanDerWaalsContact O-N 3.13Å; E61-K64 WeakPolarHBondContact OE1-CE 3.41Å; E61-K64 IonicContact OE1-NZ 2.92Å; E61-K64 PolarHBondContact OE1-NZ 3.13Å; E61-K64 IonicContact OE2-NZ 3.05Å; E61-K64 PolarHBondContact OE2-NZ 3.4Å; E61-K64 VanDerWaalsContact OE2-NZ 3.11Å; E61-E65 WeakPolarHBondContact O-CG 3.35Å; E61-E65 PolarHBondContact O-N 2.83Å
62S98.3Very high98.1Very high61 Ų61102.6 Ų102.643%0.42752%0.519SS..Hα-helixtrans-62.8-36.9174.752.10000113.4P58 R59 A66P58-S62 WeakPolarHBondContact O-CB 3.44Å; P58-S62 PolarHBondContact O-N 2.96Å; P58-S62 PolarHBondContact O-OG 3.41Å; R59-S62 PolarHBondContact O-OG 3.11Å; R59-S62 VanDerWaalsContact O-OG 3.13Å; S62-A66 WeakPolarHBondContact O-CB 3.45Å; S62-A66 PolarHBondContact O-N 3.36Å
63L98.5Very high98.1Very high97 Ų97102.3 Ų102.351%0.50852%0.518SS..Hα-helixtrans-66.5-38.4172.6-75.2171.1000112.2R59 L60 E61 L67R59-L63 HydrophobicContact CG-CD1 4.21Å; R59-L63 WeakPolarHBondContact O-CB 3.4Å; R59-L63 WeakPolarHBondContact O-CD1 3.22Å; R59-L63 VanDerWaalsContact O-CG 3.22Å; R59-L63 WeakPolarHBondContact O-CG 3.46Å; R59-L63 PolarHBondContact O-N 2.66Å; R59-L63 VanDerWaalsContact O-N 3.16Å; L60-L63 PolarHBondContact O-N 3.23Å; E61-L63 PolarHBondContact O-N 2.98Å; L63-L67 VanDerWaalsContact O-CB 3.32Å; L63-L67 WeakPolarHBondContact O-CB 3.44Å; L63-L67 PolarHBondContact O-N 3.21Å
64K98.6Very high98.2Very high111 Ų111102.6 Ų102.648%0.48352%0.519SS..Hα-helixtrans-66-44.6175169.2-173.5159.3-148.40111.7L60 E61 L67 V68L60-K64 WeakPolarHBondContact O-CB 3.42Å; L60-K64 PolarHBondContact O-N 2.98Å; E61-K64 VanDerWaalsContact CD-NZ 3.3Å; E61-K64 WeakPolarHBondContact O-CB 3.41Å; E61-K64 PolarHBondContact O-N 3.03Å; E61-K64 VanDerWaalsContact O-N 3.13Å; E61-K64 WeakPolarHBondContact OE1-CE 3.41Å; E61-K64 IonicContact OE1-NZ 2.92Å; E61-K64 PolarHBondContact OE1-NZ 3.13Å; E61-K64 IonicContact OE2-NZ 3.05Å; E61-K64 PolarHBondContact OE2-NZ 3.4Å; E61-K64 VanDerWaalsContact OE2-NZ 3.11Å; K64-L67 WeakPolarHBondContact O-CB 3.49Å; K64-L67 PolarHBondContact O-N 2.76Å; K64-V68 WeakPolarHBondContact O-CG2 3.35Å; K64-V68 PolarHBondContact O-N 3.16Å
65E98.5Very high98.2Very high123 Ų123101.6 Ų101.658%0.57551%0.512SS*.Hα-helixtrans-59.6-47.3174-73.7176.1178.100111.4E61 L67 V68 A69E61-E65 WeakPolarHBondContact O-CG 3.35Å; E61-E65 PolarHBondContact O-N 2.83Å; E65-L67 VanDerWaalsContact C-N 3.31Å; E65-L67 PolarHBondContact O-N 3.11Å; E65-V68 PolarHBondContact O-N 3.13Å; E65-A69 WeakPolarHBondContact O-CB 3.4Å; E65-A69 PolarHBondContact O-N 3.47Å
66A98.5Very high98.3Very high53 Ų5399 Ų9944%0.43851%0.506SS..Hα-helixtrans-60.5-39.8175.700000112.2S62 A69 R70S62-A66 WeakPolarHBondContact O-CB 3.45Å; S62-A66 PolarHBondContact O-N 3.36Å; A66-A69 PolarHBondContact O-N 2.87Å; A66-R70 WeakPolarHBondContact O-CG 3.21Å; A66-R70 PolarHBondContact O-N 3.15Å
67L98.6Very high98.4Very high100 Ų10099.7 Ų99.752%0.52451%0.514SS..Hα-helixtrans-64.7-46.6176-174.862.7000111.6L63 K64 E65 A69 R70 Y71L63-L67 VanDerWaalsContact O-CB 3.32Å; L63-L67 WeakPolarHBondContact O-CB 3.44Å; L63-L67 PolarHBondContact O-N 3.21Å; K64-L67 WeakPolarHBondContact O-CB 3.49Å; K64-L67 PolarHBondContact O-N 2.76Å; E65-L67 VanDerWaalsContact C-N 3.31Å; E65-L67 PolarHBondContact O-N 3.11Å; L67-A69 VanDerWaalsContact C-N 3.34Å; L67-A69 PolarHBondContact O-N 2.74Å; L67-R70 PolarHBondContact O-N 3.1Å; L67-R70 VanDerWaalsContact O-N 3.16Å; L67-Y71 HydrophobicContact CD1-CD2 3.98Å; L67-Y71 HydrophobicContact CD1-CE2 3.62Å; L67-Y71 HydrophobicContact CD2-CE2 4.34Å; L67-Y71 HydrophobicContact CG-CD2 3.91Å; L67-Y71 HydrophobicContact CG-CE2 3.79Å; L67-Y71 WeakPolarHBondContact O-CD2 3.32Å; L67-Y71 PolarHBondContact O-N 3.08Å
68V98.7Very high98.4Very high92 Ų92100.3 Ų100.356%0.55851%0.513SS*.Hα-helixtrans-59.9-43.7175.8169.90000111K64 E65 R70 Y71 S72K64-V68 WeakPolarHBondContact O-CG2 3.35Å; K64-V68 PolarHBondContact O-N 3.16Å; E65-V68 PolarHBondContact O-N 3.13Å; V68-R70 VanDerWaalsContact C-N 3.31Å; V68-R70 PolarHBondContact O-N 3.25Å; V68-Y71 PolarHBondContact O-N 3.43Å; V68-S72 PolarHBondContact O-N 3.46Å; V68-S72 PolarHBondContact O-OG 3.4Å
69A98.5Very high98.5Very high41 Ų41100.3 Ų100.334%0.33951%0.505SS..Hα-helixtrans-64.2-32.4176.200000113.1E65 A66 L67 S72 Q73E65-A69 WeakPolarHBondContact O-CB 3.4Å; E65-A69 PolarHBondContact O-N 3.47Å; A66-A69 PolarHBondContact O-N 2.87Å; L67-A69 VanDerWaalsContact C-N 3.34Å; L67-A69 PolarHBondContact O-N 2.74Å; A69-S72 PolarHBondContact O-OG 3.25Å; A69-S72 VanDerWaalsContact O-OG 3.07Å; A69-Q73 WeakPolarHBondContact O-CG 3.35Å; A69-Q73 PolarHBondContact O-N 2.93Å
70R98.6Very high98.5Very high170 Ų17096.1 Ų96.164%0.64250%0.497SS*.Hα-helixtrans-73.4-37.9172.6-71.5-57.3-169.8-176.84.8112.6A66 L67 V68 Q73 L74A66-R70 WeakPolarHBondContact O-CG 3.21Å; A66-R70 PolarHBondContact O-N 3.15Å; L67-R70 PolarHBondContact O-N 3.1Å; L67-R70 VanDerWaalsContact O-N 3.16Å; V68-R70 VanDerWaalsContact C-N 3.31Å; V68-R70 PolarHBondContact O-N 3.25Å; R70-Q73 PolarHBondContact O-N 2.99Å; R70-L74 WeakPolarHBondContact O-CB 3.39Å; R70-L74 PolarHBondContact O-N 3.36Å
71Y98.8Very high98.5Very high151 Ų15198 Ų9859%0.59250%0.498SS*.Hα-helixtrans-66.1-39.6173.8-86.3-69.7000112.6L67 V68 L74 E75L67-Y71 HydrophobicContact CD1-CD2 3.98Å; L67-Y71 HydrophobicContact CD1-CE2 3.62Å; L67-Y71 HydrophobicContact CD2-CE2 4.34Å; L67-Y71 HydrophobicContact CG-CD2 3.91Å; L67-Y71 HydrophobicContact CG-CE2 3.79Å; L67-Y71 WeakPolarHBondContact O-CD2 3.32Å; L67-Y71 PolarHBondContact O-N 3.08Å; V68-Y71 PolarHBondContact O-N 3.43Å; Y71-L74 HydrophobicContact CD1-CD2 4.42Å; Y71-L74 PolarHBondContact O-N 2.9Å; Y71-E75 PolarHBondContact O-N 2.96Å
72S98.5Very high98.5Very high72 Ų72101 Ų10150%0.50351%0.506SS..Hα-helixtrans-67.3-37.4176.466.10000112.4V68 A69 A76V68-S72 PolarHBondContact O-N 3.46Å; V68-S72 PolarHBondContact O-OG 3.4Å; A69-S72 PolarHBondContact O-OG 3.25Å; A69-S72 VanDerWaalsContact O-OG 3.07Å; S72-A76 WeakPolarHBondContact O-CB 3.33Å; S72-A76 PolarHBondContact O-N 3.46Å
73Q98.5Very high98.5Very high98 Ų98103.1 Ų103.146%0.45851%0.509SS..Hα-helixtrans-61.6-45169.9-73.8167.518.900112A69 R70 A76 V77A69-Q73 WeakPolarHBondContact O-CG 3.35Å; A69-Q73 PolarHBondContact O-N 2.93Å; R70-Q73 PolarHBondContact O-N 2.99Å; Q73-A76 PolarHBondContact O-N 2.99Å; Q73-V77 WeakPolarHBondContact O-CG2 3.41Å; Q73-V77 PolarHBondContact O-N 3.07Å
74L98.6Very high98.5Very high103 Ų103103.9 Ų103.954%0.53951%0.509SS..Hα-helixtrans-61.6-46.5178.5176.961.7000111.7R70 Y71 V77 R78R70-L74 WeakPolarHBondContact O-CB 3.39Å; R70-L74 PolarHBondContact O-N 3.36Å; Y71-L74 HydrophobicContact CD1-CD2 4.42Å; Y71-L74 PolarHBondContact O-N 2.9Å; L74-V77 PolarHBondContact O-N 3.29Å; L74-R78 VanDerWaalsContact O-CB 3.31Å; L74-R78 WeakPolarHBondContact O-CB 3.42Å; L74-R78 PolarHBondContact O-N 2.89Å
75E98.5Very high98.4Very high94 Ų9499.7 Ų99.744%0.43949%0.494SS..Hα-helixtrans-68.3-35.7-179.3-163.262-158.600111.5Y71 R78 E79Y71-E75 PolarHBondContact O-N 2.96Å; E75-R78 WeakPolarHBondContact O-CB 3.37Å; E75-R78 PolarHBondContact O-N 3.43Å; E75-R78 IonicContact OE1-CZ 3.42Å; E75-R78 IonicContact OE1-NH1 3.17Å; E75-R78 PolarHBondContact OE1-NH1 3.16Å; E75-R78 VanDerWaalsContact OE2-CD 3.27Å; E75-R78 WeakPolarHBondContact OE2-CD 3.48Å; E75-R78 IonicContact OE2-CZ 3.42Å; E75-R78 IonicContact OE2-NH1 2.67Å; E75-R78 PolarHBondContact OE2-NH1 2.91Å; E75-E79 WeakPolarHBondContact O-CB 3.31Å; E75-E79 PolarHBondContact O-N 2.99Å
76A98.5Very high98.2Very high59 Ų5997.5 Ų97.549%0.48849%0.492SS..Hα-helixtrans-61.8-43.717200000112.5S72 Q73 E79 T80S72-A76 WeakPolarHBondContact O-CB 3.33Å; S72-A76 PolarHBondContact O-N 3.46Å; Q73-A76 PolarHBondContact O-N 2.99Å; A76-E79 PolarHBondContact O-N 3.04Å; A76-T80 WeakPolarHBondContact O-CG2 3.42Å; A76-T80 PolarHBondContact O-N 3.19Å; A76-T80 VanDerWaalsContact O-N 3.07Å; A76-T80 PolarHBondContact O-OG1 3.48Å
77V98.6Very high98.1Very high95 Ų9599.8 Ų99.858%0.57649%0.493SS*.Hα-helixtrans-68.1-35.6175.71720000111.8Q73 L74 T80 Y81Q73-V77 WeakPolarHBondContact O-CG2 3.41Å; Q73-V77 PolarHBondContact O-N 3.07Å; L74-V77 PolarHBondContact O-N 3.29Å; V77-T80 PolarHBondContact O-OG1 3.41Å; V77-T80 VanDerWaalsContact O-OG1 3.05Å; V77-Y81 VanDerWaalsContact O-CB 3.26Å; V77-Y81 WeakPolarHBondContact O-CB 3.27Å; V77-Y81 PolarHBondContact O-N 2.92Å
78R98.6Very high97.8Very high152 Ų152101.5 Ų101.557%0.57449%0.493SS*.Hα-helixtrans-65.1-41175.4-174.8-170.3-178.2-161.10.4111.6L74 E75 Y81 R82L74-R78 VanDerWaalsContact O-CB 3.31Å; L74-R78 WeakPolarHBondContact O-CB 3.42Å; L74-R78 PolarHBondContact O-N 2.89Å; E75-R78 WeakPolarHBondContact O-CB 3.37Å; E75-R78 PolarHBondContact O-N 3.43Å; E75-R78 IonicContact OE1-CZ 3.42Å; E75-R78 IonicContact OE1-NH1 3.17Å; E75-R78 PolarHBondContact OE1-NH1 3.16Å; E75-R78 VanDerWaalsContact OE2-CD 3.27Å; E75-R78 WeakPolarHBondContact OE2-CD 3.48Å; E75-R78 IonicContact OE2-CZ 3.42Å; E75-R78 IonicContact OE2-NH1 2.67Å; E75-R78 PolarHBondContact OE2-NH1 2.91Å; R78-Y81 PolarHBondContact O-N 3.44Å; R78-R82 WeakPolarHBondContact O-CB 3.5Å; R78-R82 PolarHBondContact O-N 3.16Å
79E98.4Very high97.4Very high85 Ų85100.9 Ų100.940%0.39749%0.487SS..Hα-helixtrans-71.4-41.6179.7-178.256.1-163.300112E75 A76 Y81 R82 Q83E75-E79 WeakPolarHBondContact O-CB 3.31Å; E75-E79 PolarHBondContact O-N 2.99Å; A76-E79 PolarHBondContact O-N 3.04Å; E79-Y81 PolarHBondContact O-N 3.23Å; E79-R82 WeakPolarHBondContact O-CB 3.38Å; E79-R82 PolarHBondContact O-N 3Å; E79-R82 IonicContact OE1-CZ 2.76Å; E79-R82 IonicContact OE1-NE 3.46Å; E79-R82 PolarHBondContact OE1-NE 3Å; E79-R82 IonicContact OE1-NH2 2.66Å; E79-R82 PolarHBondContact OE1-NH2 2.94Å; E79-R82 IonicContact OE2-CZ 3.03Å; E79-R82 IonicContact OE2-NE 3.5Å; E79-R82 PolarHBondContact OE2-NE 2.95Å; E79-R82 IonicContact OE2-NH2 3.11Å; E79-R82 PolarHBondContact OE2-NH2 3.07Å; E79-Q83 WeakPolarHBondContact O-CB 3.48Å; E79-Q83 PolarHBondContact O-N 3.33Å
80T98.4Very high96.9Very high68 Ų68101.1 Ų101.142%0.41749%0.493SS..Hα-helixtrans-63.7-41.1172.456.80000111.5A76 V77 R82 Q83 H84A76-T80 WeakPolarHBondContact O-CG2 3.42Å; A76-T80 PolarHBondContact O-N 3.19Å; A76-T80 VanDerWaalsContact O-N 3.07Å; A76-T80 PolarHBondContact O-OG1 3.48Å; V77-T80 PolarHBondContact O-OG1 3.41Å; V77-T80 VanDerWaalsContact O-OG1 3.05Å; T80-R82 PolarHBondContact O-N 2.78Å; T80-Q83 WeakPolarHBondContact O-CB 3.46Å; T80-Q83 PolarHBondContact O-N 3.43Å; T80-H84 PolarHBondContact O-CD2 2.84Å; T80-H84 PolarHBondContact O-N 2.9Å
81Y98.4Very high96.3Very high155 Ų15599.2 Ų99.261%0.60849%0.493SS*.Hα-helixtrans-58.8-46.5172.2177.1-98.1000112V77 R78 E79 Q83 H84 C85V77-Y81 VanDerWaalsContact O-CB 3.26Å; V77-Y81 WeakPolarHBondContact O-CB 3.27Å; V77-Y81 PolarHBondContact O-N 2.92Å; R78-Y81 PolarHBondContact O-N 3.44Å; E79-Y81 PolarHBondContact O-N 3.23Å; Y81-Q83 VanDerWaalsContact C-N 3.31Å; Y81-Q83 PolarHBondContact O-N 3.42Å; Y81-H84 PolarHBondContact O-N 3.31Å; Y81-C85 VanDerWaalsContact CE1-SG 3.57Å; Y81-C85 PolarHBondContact O-N 3.29Å
82R98.3Very high95.7Very high142 Ų14296 Ų9654%0.53649%0.489SS..Hα-helixtrans-59.2-41.7176.3-169.1-173.573.984-0.1111.6R78 E79 T80 C85 S86R78-R82 WeakPolarHBondContact O-CB 3.5Å; R78-R82 PolarHBondContact O-N 3.16Å; E79-R82 WeakPolarHBondContact O-CB 3.38Å; E79-R82 PolarHBondContact O-N 3Å; E79-R82 IonicContact OE1-CZ 2.76Å; E79-R82 IonicContact OE1-NE 3.46Å; E79-R82 PolarHBondContact OE1-NE 3Å; E79-R82 IonicContact OE1-NH2 2.66Å; E79-R82 PolarHBondContact OE1-NH2 2.94Å; E79-R82 IonicContact OE2-CZ 3.03Å; E79-R82 IonicContact OE2-NE 3.5Å; E79-R82 PolarHBondContact OE2-NE 2.95Å; E79-R82 IonicContact OE2-NH2 3.11Å; E79-R82 PolarHBondContact OE2-NH2 3.07Å; T80-R82 PolarHBondContact O-N 2.78Å; R82-C85 PolarHBondContact O-N 3.12Å; R82-S86 WeakPolarHBondContact O-CB 3.37Å; R82-S86 PolarHBondContact O-N 3.27Å
83Q98.1Very high94.9Very high105 Ų10594.8 Ų94.849%0.49149%0.487SS..Hα-helixtrans-63.3-46.2175.9-168.4-176.618.400111.5E79 T80 Y81 S86 Q87E79-Q83 WeakPolarHBondContact O-CB 3.48Å; E79-Q83 PolarHBondContact O-N 3.33Å; T80-Q83 WeakPolarHBondContact O-CB 3.46Å; T80-Q83 PolarHBondContact O-N 3.43Å; Y81-Q83 VanDerWaalsContact C-N 3.31Å; Y81-Q83 PolarHBondContact O-N 3.42Å; Q83-S86 PolarHBondContact O-N 3.05Å; Q83-Q87 WeakPolarHBondContact O-CG 3.36Å; Q83-Q87 PolarHBondContact O-N 3Å
84H97.9Very high93.9Very high113 Ų11395.4 Ų95.452%0.52349%0.49SS..Hα-helixtrans-64.1-39.7176.2-71.6-55.3000112.7T80 Y81 Q87 R88T80-H84 PolarHBondContact O-CD2 2.84Å; T80-H84 PolarHBondContact O-N 2.9Å; Y81-H84 PolarHBondContact O-N 3.31Å; H84-Q87 PolarHBondContact O-N 2.84Å; H84-R88 WeakPolarHBondContact O-CB 3.49Å; H84-R88 PolarHBondContact O-N 3.47Å
85C96.5Very high93.1Very high22 Ų2294.9 Ų94.915%0.14949%0.491CS..Hα-helixtrans-61.2-46.6171.5-74.40000111.5Y81 R82 Q87 R88 D89Y81-C85 VanDerWaalsContact CE1-SG 3.57Å; Y81-C85 PolarHBondContact O-N 3.29Å; R82-C85 PolarHBondContact O-N 3.12Å; C85-Q87 VanDerWaalsContact C-N 3.34Å; C85-Q87 PolarHBondContact O-N 3.38Å; C85-R88 PolarHBondContact O-N 2.93Å; C85-D89 WeakPolarHBondContact O-CB 3.35Å; C85-D89 PolarHBondContact O-N 3Å
86S95.6Very high92.6Very high77 Ų7791.4 Ų91.454%0.53848%0.477SS..Hα-helixtrans-62.1-38.8177.9-176.40000112.8R82 Q83 G90R82-S86 WeakPolarHBondContact O-CB 3.37Å; R82-S86 PolarHBondContact O-N 3.27Å; Q83-S86 PolarHBondContact O-N 3.05Å; S86-G90 PolarHBondContact O-N 3.02Å
87Q94.9Very high92.2Very high101 Ų10191.2 Ų91.247%0.47247%0.471SS..Hα-helixtrans-64.2-49173.5-72.5171.89.600111.3Q83 H84 C85 D89 G90 M91Q83-Q87 WeakPolarHBondContact O-CG 3.36Å; Q83-Q87 PolarHBondContact O-N 3Å; H84-Q87 PolarHBondContact O-N 2.84Å; C85-Q87 VanDerWaalsContact C-N 3.34Å; C85-Q87 PolarHBondContact O-N 3.38Å; Q87-D89 VanDerWaalsContact C-N 3.34Å; Q87-D89 PolarHBondContact O-N 3.42Å; Q87-G90 PolarHBondContact O-N 2.67Å; Q87-M91 WeakPolarHBondContact O-CG 3.26Å; Q87-M91 PolarHBondContact O-N 2.74Å
88R93.6Very high91.8Very high136 Ų13690.9 Ų90.951%0.51346%0.463SS..Hα-helixtrans-56.5-48.2176-179.1-159.367.8-169.9-5.2111H84 C85 M91 V92H84-R88 WeakPolarHBondContact O-CB 3.49Å; H84-R88 PolarHBondContact O-N 3.47Å; C85-R88 PolarHBondContact O-N 2.93Å; R88-M91 PolarHBondContact O-N 3.4Å; R88-V92 HydrophobicContact CG-CG2 4.27Å; R88-V92 WeakPolarHBondContact O-CB 3.4Å; R88-V92 VanDerWaalsContact O-CG2 3.3Å; R88-V92 WeakPolarHBondContact O-CG2 3.44Å; R88-V92 PolarHBondContact O-N 3.25Å
89D90.6Very high91.4Very high80 Ų8085.1 Ų85.143%0.42845%0.448SS..Hα-helixtrans-70.4-34.9-174.5-63.2-15.1000111.1C85 Q87 V92 G93C85-D89 WeakPolarHBondContact O-CB 3.35Å; C85-D89 PolarHBondContact O-N 3Å; Q87-D89 VanDerWaalsContact C-N 3.34Å; Q87-D89 PolarHBondContact O-N 3.42Å; D89-V92 PolarHBondContact O-N 2.99Å; D89-G93 PolarHBondContact O-N 3.23Å
90G87.8Confident91.1Very high45 Ų4585.8 Ų85.846%0.46445%0.45SS..Hα-helixtrans-63.1-42.1168.700000113.1S86 Q87 G93 Q94S86-G90 PolarHBondContact O-N 3.02Å; Q87-G90 PolarHBondContact O-N 2.67Å; G90-G93 PolarHBondContact O-N 2.91Å; G90-Q94 PolarHBondContact O-N 2.88Å
91M86.1Confident90.9Very high130 Ų13084.2 Ų84.264%0.6444%0.437SS*.Hα-helixtrans-67.2-44.3174.5-71.5-176.772.800112Q87 R88 G93 Q94 V95Q87-M91 WeakPolarHBondContact O-CG 3.26Å; Q87-M91 PolarHBondContact O-N 2.74Å; R88-M91 PolarHBondContact O-N 3.4Å; M91-G93 VanDerWaalsContact C-N 3.3Å; M91-G93 PolarHBondContact O-N 3.49Å; M91-Q94 PolarHBondContact O-N 2.87Å; M91-Q94 VanDerWaalsContact O-N 3.12Å; M91-V95 WeakPolarHBondContact O-CB 3.34Å; M91-V95 WeakPolarHBondContact O-CG2 3.34Å; M91-V95 PolarHBondContact O-N 3.26Å
92V86.1Confident90.6Very high84 Ų8480 Ų8051%0.50943%0.431SS..Hα-helixtrans-61.3-39.5176.2170.10000110.4R88 D89 Q94 V95 S96R88-V92 HydrophobicContact CG-CG2 4.27Å; R88-V92 WeakPolarHBondContact O-CB 3.4Å; R88-V92 VanDerWaalsContact O-CG2 3.3Å; R88-V92 WeakPolarHBondContact O-CG2 3.44Å; R88-V92 PolarHBondContact O-N 3.25Å; D89-V92 PolarHBondContact O-N 2.99Å; V92-Q94 VanDerWaalsContact C-N 3.28Å; V92-Q94 PolarHBondContact O-N 3.49Å; V92-V95 PolarHBondContact O-N 3.49Å; V92-S96 WeakPolarHBondContact O-CA 3.35Å; V92-S96 WeakPolarHBondContact O-CB 3.3Å; V92-S96 PolarHBondContact O-N 3.05Å
93G80.3Confident90.4Very high46 Ų4679.9 Ų79.947%0.47443%0.43SS..Hα-helixtrans-63.4-28174.900000114.6D89 G90 M91 A99D89-G93 PolarHBondContact O-N 3.23Å; G90-G93 PolarHBondContact O-N 2.91Å; M91-G93 VanDerWaalsContact C-N 3.3Å; M91-G93 PolarHBondContact O-N 3.49Å; G93-A99 VanDerWaalsContact O-CB 3.27Å; G93-A99 WeakPolarHBondContact O-CB 3.47Å
94Q77.3Confident90.3Very high112 Ų11276.6 Ų76.652%0.52342%0.416SS..Hα-helixtrans-92.3-29.2177.2-68.8-65.8-29.500113.8G90 M91 V92G90-Q94 PolarHBondContact O-N 2.88Å; M91-Q94 PolarHBondContact O-N 2.87Å; M91-Q94 VanDerWaalsContact O-N 3.12Å; V92-Q94 VanDerWaalsContact C-N 3.28Å; V92-Q94 PolarHBondContact O-N 3.49Å
95V81.9Confident90.3Very high91 Ų9174.9 Ų74.955%0.55241%0.408SS*.Hα-helixtrans-109.60.7-171.8-170.50000111.9M91 V92 F100M91-V95 WeakPolarHBondContact O-CB 3.34Å; M91-V95 WeakPolarHBondContact O-CG2 3.34Å; M91-V95 PolarHBondContact O-N 3.26Å; V92-V95 PolarHBondContact O-N 3.49Å; V95-F100 VanDerWaalsContact CA-CE2 3.5Å; V95-F100 HydrophobicContact CB-CE2 4.26Å; V95-F100 HydrophobicContact CG1-CE2 3.95Å; V95-F100 HydrophobicContact CG1-CZ 4.4Å; V95-F100 WeakPolarHBondContact O-CE2 2.98Å
96S88.9Confident90.3Very high22 Ų2278 Ų7815%0.15443%0.427CS..  trans-56.5130.9172145.40000110.4V92 E98 A99 F100V92-S96 WeakPolarHBondContact O-CA 3.35Å; V92-S96 WeakPolarHBondContact O-CB 3.3Å; V92-S96 PolarHBondContact O-N 3.05Å; S96-E98 PolarHBondContact O-N 2.97Å; S96-E98 WeakPolarHBondContact OG-CB 3.27Å; S96-E98 PolarHBondContact OG-N 3.05Å; S96-E98 VanDerWaalsContact OG-N 3.14Å; S96-E98 PolarHBondContact OG-OE2 3.49Å; S96-A99 PolarHBondContact O-N 3.32Å; S96-A99 VanDerWaalsContact O-N 3.09Å; S96-A99 PolarHBondContact OG-N 2.95Å; S96-F100 VanDerWaalsContact O-CD2 3.29Å; S96-F100 WeakPolarHBondContact O-CD2 3.32Å; S96-F100 PolarHBondContact O-N 3.44Å
97P89.1Confident90.4Very high55 Ų5577.4 Ų77.436%0.35742%0.415SS..Hα-helixtrans-51.7-34.7171.2-31.639.5000113.7F101 L157P97-F101 VanDerWaalsContact O-CB 3.31Å; P97-F101 WeakPolarHBondContact O-CB 3.35Å; P97-F101 PolarHBondContact O-N 2.91Å; P97-L157 HydrophobicContact CB-CD2 3.6Å
98E90.6Very high90.5Very high88 Ų8873.1 Ų73.141%0.41140%0.396SS..Hα-helixtrans-74.1-36.9178.5-52.972.1-156.700112.1S96 F101 S102 L157S96-E98 PolarHBondContact O-N 2.97Å; S96-E98 WeakPolarHBondContact OG-CB 3.27Å; S96-E98 PolarHBondContact OG-N 3.05Å; S96-E98 VanDerWaalsContact OG-N 3.14Å; S96-E98 PolarHBondContact OG-OE2 3.49Å; E98-F101 PolarHBondContact O-N 3.38Å; E98-S102 PolarHBondContact O-N 3.4Å; E98-S102 PolarHBondContact O-OG 3.43Å; E98-L157 HydrophobicContact CG-CD2 4.4Å
99A91Very high90.7Very high30 Ų3071.7 Ų71.725%0.24840%0.395CS..Hα-helixtrans-68.2-40.7172.100000111.7G93 S96 R103G93-A99 VanDerWaalsContact O-CB 3.27Å; G93-A99 WeakPolarHBondContact O-CB 3.47Å; S96-A99 PolarHBondContact O-N 3.32Å; S96-A99 VanDerWaalsContact O-N 3.09Å; S96-A99 PolarHBondContact OG-N 2.95Å; A99-R103 WeakPolarHBondContact O-CB 3.45Å; A99-R103 PolarHBondContact O-N 3.39Å
100F91.4Very high91Very high100 Ų10072.7 Ų72.744%0.43940%0.396SS..Hα-helixtrans-63.1-43.6171.5-78.4-59.2000112.1V95 S96 R103 L104V95-F100 VanDerWaalsContact CA-CE2 3.5Å; V95-F100 HydrophobicContact CB-CE2 4.26Å; V95-F100 HydrophobicContact CG1-CE2 3.95Å; V95-F100 HydrophobicContact CG1-CZ 4.4Å; V95-F100 WeakPolarHBondContact O-CE2 2.98Å; S96-F100 VanDerWaalsContact O-CD2 3.29Å; S96-F100 WeakPolarHBondContact O-CD2 3.32Å; S96-F100 PolarHBondContact O-N 3.44Å; F100-R103 PolarHBondContact O-N 3.01Å; F100-L104 VanDerWaalsContact O-CB 3.29Å; F100-L104 WeakPolarHBondContact O-CB 3.29Å; F100-L104 PolarHBondContact O-N 2.91Å
101F93.6Very high91.5Very high34 Ų3470.7 Ų70.715%0.14938%0.375CS..Hα-helixtrans-58.5-51.6176.8179.7-95000111.5P97 E98 R103 L104 Q105 I150 L153 Q154 L157P97-F101 VanDerWaalsContact O-CB 3.31Å; P97-F101 WeakPolarHBondContact O-CB 3.35Å; P97-F101 PolarHBondContact O-N 2.91Å; E98-F101 PolarHBondContact O-N 3.38Å; F101-R103 PolarHBondContact O-N 3.26Å; F101-L104 PolarHBondContact O-N 3.45Å; F101-Q105 PolarHBondContact O-N 2.91Å; F101-I150 HydrophobicContact CE2-CB 4.43Å; F101-I150 HydrophobicContact CE2-CG2 3.58Å; F101-I150 HydrophobicContact CZ-CG2 3.87Å; F101-L153 HydrophobicContact CB-CD2 3.81Å; F101-L153 HydrophobicContact CB-CG 4.31Å; F101-L153 HydrophobicContact CD2-CB 4.18Å; F101-L153 HydrophobicContact CD2-CD2 3.99Å; F101-L153 HydrophobicContact CD2-CG 3.95Å; F101-L153 HydrophobicContact CG-CD2 4.43Å; F101-Q154 HydrophobicContact CE2-CB 3.76Å; F101-Q154 HydrophobicContact CE2-CG 4.4Å; F101-Q154 HydrophobicContact CZ-CB 4.21Å; F101-Q154 HydrophobicContact CZ-CG 4.38Å; F101-L157 HydrophobicContact CB-CD1 4.16Å; F101-L157 HydrophobicContact CD2-CD1 4.31Å; F101-L157 HydrophobicContact CG-CD1 4.19Å
102S93.9Very high92Very high68 Ų6867.3 Ų67.348%0.47636%0.357SS..Hα-helixtrans-58.1-45.2177.5-57.70000112.1E98 Q105 T106E98-S102 PolarHBondContact O-N 3.4Å; E98-S102 PolarHBondContact O-OG 3.43Å; S102-Q105 PolarHBondContact O-N 2.86Å; S102-T106 PolarHBondContact O-N 3.26Å; S102-T106 VanDerWaalsContact O-N 3.07Å; S102-T106 PolarHBondContact O-OG1 3.29Å; S102-T106 VanDerWaalsContact O-OG1 3.1Å
103R94.2Very high92.5Very high139 Ų13966.7 Ų66.753%0.52536%0.357SS..Hα-helixtrans-63.8-43.1177.5-173.3-178.9-61.9-174.35.5112A99 F100 F101 Q105 T106 E107A99-R103 WeakPolarHBondContact O-CB 3.45Å; A99-R103 PolarHBondContact O-N 3.39Å; F100-R103 PolarHBondContact O-N 3.01Å; F101-R103 PolarHBondContact O-N 3.26Å; R103-Q105 VanDerWaalsContact C-N 3.32Å; R103-T106 PolarHBondContact O-N 3.19Å; R103-E107 WeakPolarHBondContact O-CB 3.39Å; R103-E107 PolarHBondContact O-N 2.88Å
104L95.7Very high93.3Very high35 Ų3568.4 Ų68.418%0.18335%0.352CS..Hα-helixtrans-64.5-37.6178.6-179.263.9000111.5F100 F101 S108 R146 Q149 I150F100-L104 VanDerWaalsContact O-CB 3.29Å; F100-L104 WeakPolarHBondContact O-CB 3.29Å; F100-L104 PolarHBondContact O-N 2.91Å; F101-L104 PolarHBondContact O-N 3.45Å; L104-S108 WeakPolarHBondContact O-CB 3.47Å; L104-S108 PolarHBondContact O-N 2.99Å; L104-R146 HydrophobicContact CD1-CB 4.41Å; L104-R146 HydrophobicContact CD1-CG 4.12Å; L104-Q149 HydrophobicContact CD2-CB 3.91Å; L104-I150 HydrophobicContact CB-CG1 4.47Å; L104-I150 HydrophobicContact CD2-CG1 3.71Å; L104-I150 HydrophobicContact CG-CD1 4.28Å; L104-I150 HydrophobicContact CG-CG1 3.7Å
105Q96.6Very high94.3Very high78 Ų7863.1 Ų63.136%0.36433%0.328SS..Hα-helixtrans-62-53.5173.6-178.7177.7-13.300111.4F101 S102 R103 E107 S108 E109 I150F101-Q105 PolarHBondContact O-N 2.91Å; S102-Q105 PolarHBondContact O-N 2.86Å; R103-Q105 VanDerWaalsContact C-N 3.32Å; Q105-E107 VanDerWaalsContact C-N 3.28Å; Q105-E107 PolarHBondContact O-N 3.49Å; Q105-S108 WeakPolarHBondContact O-CA 3.01Å; Q105-S108 WeakPolarHBondContact O-CB 3.32Å; Q105-S108 PolarHBondContact O-N 3.01Å; Q105-E109 VanDerWaalsContact CG-OE1 3.25Å; Q105-E109 WeakPolarHBondContact CG-OE1 3.3Å; Q105-E109 PolarHBondContact NE2-OE1 2.95Å; Q105-E109 WeakPolarHBondContact O-CG 3.43Å; Q105-E109 PolarHBondContact O-N 3.23Å; Q105-I150 HydrophobicContact CB-CD1 4.4Å
106T97.3Very high95Very high88 Ų8864 Ų6454%0.5433%0.326SS..Hα-helixtrans-56.2-42.7177.8-530000112S102 R103 S108 K110S102-T106 PolarHBondContact O-N 3.26Å; S102-T106 VanDerWaalsContact O-N 3.07Å; S102-T106 PolarHBondContact O-OG1 3.29Å; S102-T106 VanDerWaalsContact O-OG1 3.1Å; R103-T106 PolarHBondContact O-N 3.19Å; T106-S108 VanDerWaalsContact C-N 3.35Å; T106-K110 VanDerWaalsContact O-CB 3.3Å; T106-K110 WeakPolarHBondContact O-CB 3.43Å; T106-K110 PolarHBondContact O-N 3.49Å
107E97Very high95.3Very high63 Ų6365.3 Ų65.329%0.29434%0.338SS..Hα-helixtrans-68.9-30.3176.6-85-71.2133.100112.9R103 Q105 K110 T111 R146R103-E107 WeakPolarHBondContact O-CB 3.39Å; R103-E107 PolarHBondContact O-N 2.88Å; Q105-E107 VanDerWaalsContact C-N 3.28Å; Q105-E107 PolarHBondContact O-N 3.49Å; E107-K110 IonicContact OE1-NZ 2.74Å; E107-T111 PolarHBondContact O-N 2.81Å; E107-T111 VanDerWaalsContact O-N 3.07Å; E107-T111 PolarHBondContact O-OG1 3.42Å; E107-T111 VanDerWaalsContact O-OG1 3.14Å; E107-R146 PolarHBondContact O-NH1 3.25Å; E107-R146 IonicContact OE2-CZ 2.7Å; E107-R146 IonicContact OE2-NH1 2.76Å; E107-R146 PolarHBondContact OE2-NH1 2.78Å; E107-R146 IonicContact OE2-NH2 3.35Å; E107-R146 PolarHBondContact OE2-NH2 2.84Å
108S97.4Very high95.7Very high11 Ų1163 Ų638%0.07732%0.323CS..Hα-helixtrans-71.4-46174.1-167.80000112L104 Q105 T106 K110 T111 E112L104-S108 WeakPolarHBondContact O-CB 3.47Å; L104-S108 PolarHBondContact O-N 2.99Å; Q105-S108 WeakPolarHBondContact O-CA 3.01Å; Q105-S108 WeakPolarHBondContact O-CB 3.32Å; Q105-S108 PolarHBondContact O-N 3.01Å; T106-S108 VanDerWaalsContact C-N 3.35Å; S108-K110 VanDerWaalsContact C-N 3.3Å; S108-K110 PolarHBondContact O-N 3.36Å; S108-T111 PolarHBondContact O-N 3.33Å; S108-E112 PolarHBondContact O-N 3.45Å
109E97.2Very high96Very high106 Ų10660 Ų6050%0.49531%0.313SS..Hα-helixtrans-59.7-42.5175.7-70.1167-173.700110.6Q105 E112 S113Q105-E109 VanDerWaalsContact CG-OE1 3.25Å; Q105-E109 WeakPolarHBondContact CG-OE1 3.3Å; Q105-E109 PolarHBondContact NE2-OE1 2.95Å; Q105-E109 WeakPolarHBondContact O-CG 3.43Å; Q105-E109 PolarHBondContact O-N 3.23Å; E109-E112 PolarHBondContact O-N 3.05Å; E109-S113 WeakPolarHBondContact O-CB 3.25Å; E109-S113 PolarHBondContact O-N 3.16Å
110K97.9Very high96.3Very high101 Ų10163 Ų6344%0.43933%0.325SS..Hα-helixtrans-59.7-49.2173.3179.8-177.6165.9-167.70112.8T106 E107 S108 E112 S113 E114T106-K110 VanDerWaalsContact O-CB 3.3Å; T106-K110 WeakPolarHBondContact O-CB 3.43Å; T106-K110 PolarHBondContact O-N 3.49Å; E107-K110 IonicContact OE1-NZ 2.74Å; S108-K110 VanDerWaalsContact C-N 3.3Å; S108-K110 PolarHBondContact O-N 3.36Å; K110-E112 VanDerWaalsContact C-N 3.31Å; K110-E112 PolarHBondContact O-N 2.92Å; K110-S113 PolarHBondContact O-N 3.04Å; K110-E114 WeakPolarHBondContact CE-OE1 3.36Å; K110-E114 HydrophobicContact CG-CG 4.48Å; K110-E114 WeakPolarHBondContact O-CB 3.44Å; K110-E114 WeakPolarHBondContact O-CG 3.41Å; K110-E114 PolarHBondContact O-N 3.2Å
111T97.7Very high96.5Very high3 Ų361.5 Ų61.52%0.01832%0.321CS..Hα-helixtrans-67.9-30.3178.8-62.40000112.8E107 S108 S115 L139 L142 A143 R146E107-T111 PolarHBondContact O-N 2.81Å; E107-T111 VanDerWaalsContact O-N 3.07Å; E107-T111 PolarHBondContact O-OG1 3.42Å; E107-T111 VanDerWaalsContact O-OG1 3.14Å; S108-T111 PolarHBondContact O-N 3.33Å; T111-S115 WeakPolarHBondContact O-CB 3.29Å; T111-S115 PolarHBondContact O-N 2.59Å; T111-S115 PolarHBondContact O-OG 3.12Å; T111-L139 HydrophobicContact CG2-CB 4.48Å; T111-L139 HydrophobicContact CG2-CD2 3.97Å; T111-L139 WeakPolarHBondContact CG2-O 3.17Å; T111-L142 HydrophobicContact CG2-CB 4.23Å; T111-L142 HydrophobicContact CG2-CD2 4.09Å; T111-L142 HydrophobicContact CG2-CG 4.17Å; T111-A143 HydrophobicContact CG2-CB 4.12Å; T111-R146 PolarHBondContact OG1-NH1 2.81Å
112E96.3Very high96.7Very high59 Ų5963 Ų6328%0.27633%0.328SS..Hα-helixtrans-65.2-50171.8-173.5141.7-125.900110.2S108 E109 K110 E114 S115 E116 R140S108-E112 PolarHBondContact O-N 3.45Å; E109-E112 PolarHBondContact O-N 3.05Å; K110-E112 VanDerWaalsContact C-N 3.31Å; K110-E112 PolarHBondContact O-N 2.92Å; E112-E114 PolarHBondContact O-N 3.14Å; E112-S115 WeakPolarHBondContact O-CA 3.34Å; E112-S115 WeakPolarHBondContact O-CB 3.46Å; E112-S115 PolarHBondContact O-N 3.49Å; E112-S115 PolarHBondContact O-OG 2.79Å; E112-E116 PolarHBondContact O-N 3.14Å; E112-R140 IonicContact OE1-CZ 3.47Å; E112-R140 IonicContact OE1-NH1 3Å; E112-R140 PolarHBondContact OE1-NH1 3.03Å; E112-R140 IonicContact OE1-NH2 3.84Å; E112-R140 PolarHBondContact OE1-NH2 3.32Å
113S97.4Very high96.8Very high72 Ų7266.3 Ų66.350%0.50334%0.34SS..Hα-helixtrans-61-39.8175-1790000113.5E109 K110 S115 E116 A117E109-S113 WeakPolarHBondContact O-CB 3.25Å; E109-S113 PolarHBondContact O-N 3.16Å; K110-S113 PolarHBondContact O-N 3.04Å; S113-S115 VanDerWaalsContact C-N 3.28Å; S113-S115 PolarHBondContact O-N 3.09Å; S113-E116 PolarHBondContact O-N 3Å; S113-A117 WeakPolarHBondContact O-CB 3.4Å; S113-A117 PolarHBondContact O-N 2.92Å
114E97.4Very high96.9Very high81 Ų8167.3 Ų67.338%0.37935%0.35SS..Hα-helixtrans-62-34.9172.2-75.1169.7175.100112K110 E112 L118 L139K110-E114 WeakPolarHBondContact CE-OE1 3.36Å; K110-E114 HydrophobicContact CG-CG 4.48Å; K110-E114 WeakPolarHBondContact O-CB 3.44Å; K110-E114 WeakPolarHBondContact O-CG 3.41Å; K110-E114 PolarHBondContact O-N 3.2Å; E112-E114 PolarHBondContact O-N 3.14Å; E114-L118 VanDerWaalsContact O-CB 3.31Å; E114-L118 WeakPolarHBondContact O-CB 3.31Å; E114-L118 PolarHBondContact O-N 3.07Å; E114-L139 HydrophobicContact CB-CD1 4.42Å; E114-L139 HydrophobicContact CB-CD2 4.38Å
115S97.1Very high96.8Very high2 Ų268.5 Ų68.51%0.01437%0.371CS..Hα-helixtrans-75.2-31176.3750000113.2T111 E112 S113 A119 F136T111-S115 WeakPolarHBondContact O-CB 3.29Å; T111-S115 PolarHBondContact O-N 2.59Å; T111-S115 PolarHBondContact O-OG 3.12Å; E112-S115 WeakPolarHBondContact O-CA 3.34Å; E112-S115 WeakPolarHBondContact O-CB 3.46Å; E112-S115 PolarHBondContact O-N 3.49Å; E112-S115 PolarHBondContact O-OG 2.79Å; S113-S115 VanDerWaalsContact C-N 3.28Å; S113-S115 PolarHBondContact O-N 3.09Å; S115-A119 PolarHBondContact O-N 3.29Å; S115-F136 WeakPolarHBondContact O-CD2 3.25Å; S115-F136 WeakPolarHBondContact O-CE2 3.48Å
116E96.4Very high96.6Very high108 Ų10868.6 Ų68.651%0.50538%0.381SS..Hα-helixtrans-71.7-49.8174.1-70.8176.5168.600110.9E112 S113 L118 A119 D120E112-E116 PolarHBondContact O-N 3.14Å; S113-E116 PolarHBondContact O-N 3Å; E116-L118 PolarHBondContact O-N 2.79Å; E116-A119 WeakPolarHBondContact O-CA 3.31Å; E116-A119 WeakPolarHBondContact O-CB 3.47Å; E116-A119 PolarHBondContact O-N 3Å; E116-D120 PolarHBondContact O-N 3.1Å
117A97Very high96.5Very high50 Ų5065.6 Ų65.641%0.41336%0.361SS..Hα-helixtrans-57.5-37.5175.800000112.5S113 A119 D120 D121S113-A117 WeakPolarHBondContact O-CB 3.4Å; S113-A117 PolarHBondContact O-N 2.92Å; A117-A119 VanDerWaalsContact C-N 3.3Å; A117-A119 PolarHBondContact O-N 3Å; A117-D120 PolarHBondContact O-N 3.43Å; A117-D121 WeakPolarHBondContact O-CB 3.45Å; A117-D121 PolarHBondContact O-N 2.89Å
118L96.8Very high96.4Very high8 Ų866 Ų664%0.04237%0.371CS..Hα-helixtrans-67.1-29.4174.5-173.272.6000113.2E114 E116 F122 L127 F132 R135 F136 L139E114-L118 VanDerWaalsContact O-CB 3.31Å; E114-L118 WeakPolarHBondContact O-CB 3.31Å; E114-L118 PolarHBondContact O-N 3.07Å; E116-L118 PolarHBondContact O-N 2.79Å; L118-F122 PolarHBondContact O-N 3.36Å; L118-L127 HydrophobicContact CD1-CD2 3.49Å; L118-L127 VanDerWaalsContact CD1-CD2 3.49Å; L118-L127 HydrophobicContact CG-CD2 4.17Å; L118-F132 HydrophobicContact CG-CD2 4.21Å; L118-F132 HydrophobicContact CG-CE2 4.49Å; L118-F132 WeakPolarHBondContact O-CD2 3.3Å; L118-R135 HydrophobicContact CD1-CB 4.44Å; L118-R135 VanDerWaalsContact CD1-CZ 3.44Å; L118-R135 VanDerWaalsContact CD1-NH2 3.35Å; L118-R135 HydrophobicContact CD2-CB 3.58Å; L118-F136 HydrophobicContact CD2-CB 3.83Å; L118-F136 HydrophobicContact CD2-CD2 4.48Å; L118-F136 VanDerWaalsContact CD2-N 3.34Å; L118-L139 HydrophobicContact CD2-CD1 3.88Å
119A96.5Very high96.3Very high23 Ų2369.7 Ų69.719%0.1939%0.389CS..Hα-helixtrans-74.8-40.1173.400000111.2S115 E116 A117 F122 L123 F132 F136S115-A119 PolarHBondContact O-N 3.29Å; E116-A119 WeakPolarHBondContact O-CA 3.31Å; E116-A119 WeakPolarHBondContact O-CB 3.47Å; E116-A119 PolarHBondContact O-N 3Å; A117-A119 VanDerWaalsContact C-N 3.3Å; A117-A119 PolarHBondContact O-N 3Å; A119-F122 PolarHBondContact O-N 2.91Å; A119-L123 WeakPolarHBondContact O-CG 3.15Å; A119-L123 PolarHBondContact O-N 3.23Å; A119-F132 HydrophobicContact CB-CE2 4.19Å; A119-F136 HydrophobicContact CB-CE2 4.18Å
120D96.9Very high96.2Very high93 Ų9370.9 Ų70.950%0.49740%0.399SS..Hα-helixtrans-62.2-47.3174.4-65.5-27.5000111E116 A117 F122 L123 E124E116-D120 PolarHBondContact O-N 3.1Å; A117-D120 PolarHBondContact O-N 3.43Å; D120-F122 PolarHBondContact O-N 3.07Å; D120-L123 PolarHBondContact O-N 3.39Å; D120-E124 WeakPolarHBondContact O-CG 3.4Å; D120-E124 PolarHBondContact O-N 2.87Å
121D96.3Very high96Very high69 Ų6967.8 Ų67.837%0.36939%0.39SS..Hα-helixtrans-49.4-44.5172-87.4-20.6000112.3A117 G125 S126 L127A117-D121 WeakPolarHBondContact O-CB 3.45Å; A117-D121 PolarHBondContact O-N 2.89Å; D121-G125 PolarHBondContact O-N 3.41Å; D121-S126 WeakPolarHBondContact CA-OG 3.5Å; D121-S126 WeakPolarHBondContact CB-OG 3.44Å; D121-S126 PolarHBondContact O-N 2.99Å; D121-S126 PolarHBondContact O-OG 3.47Å; D121-S126 PolarHBondContact OD1-OG 2.89Å; D121-L127 HydrophobicContact CB-CB 4.48Å
122F97.1Very high95.9Very high66 Ų6668.8 Ų68.829%0.28939%0.394SS..Hα-helixtrans-70.7-38.3178.8173.9-105.3000112.6L118 A119 D120 G125 L127 L129 F132L118-F122 PolarHBondContact O-N 3.36Å; A119-F122 PolarHBondContact O-N 2.91Å; D120-F122 PolarHBondContact O-N 3.07Å; F122-G125 PolarHBondContact O-N 3.38Å; F122-G125 VanDerWaalsContact O-N 3.11Å; F122-L127 HydrophobicContact CB-CB 4.43Å; F122-L129 HydrophobicContact CE2-CB 4.26Å; F122-L129 HydrophobicContact CE2-CD1 3.83Å; F122-L129 HydrophobicContact CZ-CD1 3.61Å; F122-F132 HydrophobicContact CB-CB 4.2Å; F122-F132 HydrophobicContact CB-CD2 3.52Å; F122-F132 HydrophobicContact CB-CE2 4.04Å; F122-F132 HydrophobicContact CB-CG 3.82Å; F122-F132 HydrophobicContact CD1-CD1 4.02Å; F122-F132 HydrophobicContact CD1-CD2 4.35Å; F122-F132 HydrophobicContact CD1-CE1 4.16Å; F122-F132 HydrophobicContact CD1-CE2 4.5Å; F122-F132 HydrophobicContact CD1-CG 4.12Å; F122-F132 HydrophobicContact CD1-CZ 4.4Å; F122-F132 HydrophobicContact CD2-CB 3.72Å; F122-F132 HydrophobicContact CD2-CD1 4.26Å; F122-F132 HydrophobicContact CD2-CD2 4.47Å; F122-F132 AromaticContact CD2-CG 3.89Å; F122-F132 HydrophobicContact CD2-CG 3.89Å; F122-F132 HydrophobicContact CE1-CD1 4.33Å; F122-F132 HydrophobicContact CE2-CB 4.38Å; F122-F132 HydrophobicContact CG-CB 3.98Å; F122-F132 AromaticContact CG-CD1 3.99Å; F122-F132 HydrophobicContact CG-CD1 3.99Å; F122-F132 AromaticContact CG-CD2 3.86Å; F122-F132 HydrophobicContact CG-CD2 3.86Å; F122-F132 HydrophobicContact CG-CE1 4.5Å; F122-F132 HydrophobicContact CG-CE2 4.4Å; F122-F132 AromaticContact CG-CG 3.64Å; F122-F132 HydrophobicContact CG-CG 3.64Å
123L96.1Very high95.9Very high137 Ų13771.1 Ų71.172%0.71740%0.404SS*.Hα-helixtrans-69.2-32.1175.9-69.2173000112.6A119 D120 G125A119-L123 WeakPolarHBondContact O-CG 3.15Å; A119-L123 PolarHBondContact O-N 3.23Å; D120-L123 PolarHBondContact O-N 3.39Å; L123-G125 PolarHBondContact O-N 2.92Å
124E96.3Very high95.8Very high160 Ų16074.1 Ų74.175%0.74841%0.41SS*.THydrogen-bonded Turntrans-73.3-11.7170.6-69-171.817600113D120 S126D120-E124 WeakPolarHBondContact O-CG 3.4Å; D120-E124 PolarHBondContact O-N 2.87Å; E124-S126 VanDerWaalsContact C-N 3.31Å
125G93.9Very high95.7Very high60 Ų6075.3 Ų75.362%0.61941%0.411SS*.THydrogen-bonded Turntrans76.414.6-178.400000114.1D121 F122 L123 L127D121-G125 PolarHBondContact O-N 3.41Å; F122-G125 PolarHBondContact O-N 3.38Å; F122-G125 VanDerWaalsContact O-N 3.11Å; L123-G125 PolarHBondContact O-N 2.92Å; G125-L127 PolarHBondContact O-N 2.95Å
126S93.6Very high95.8Very high81 Ų8177.6 Ų77.657%0.56642%0.42SS*.  trans-73.6-14.2174.880.10000112.4D121 E124D121-S126 WeakPolarHBondContact CA-OG 3.5Å; D121-S126 WeakPolarHBondContact CB-OG 3.44Å; D121-S126 PolarHBondContact O-N 2.99Å; D121-S126 PolarHBondContact O-OG 3.47Å; D121-S126 PolarHBondContact OD1-OG 2.89Å; E124-S126 VanDerWaalsContact C-N 3.31Å
127L93.7Very high95.7Very high25 Ų2577.2 Ų77.213%0.13142%0.421CS..SBendtrans-126.3140.6-175.1-174.156.4000113.3L118 D121 F122 G125 F132L118-L127 HydrophobicContact CD1-CD2 3.49Å; L118-L127 VanDerWaalsContact CD1-CD2 3.49Å; L118-L127 HydrophobicContact CG-CD2 4.17Å; D121-L127 HydrophobicContact CB-CB 4.48Å; F122-L127 HydrophobicContact CB-CB 4.43Å; G125-L127 PolarHBondContact O-N 2.95Å; L127-F132 HydrophobicContact CD2-CB 3.8Å; L127-F132 HydrophobicContact CD2-CD2 4.22Å; L127-F132 HydrophobicContact CG-CB 4.12Å
128S95.4Very high95.7Very high71 Ų7180.4 Ų80.450%0.49743%0.431SS..  trans-76.5150.6174.266.50000112.8D130 S131 F132S128-D130 PolarHBondContact O-N 3.33Å; S128-S131 PolarHBondContact O-N 3.35Å; S128-S131 WeakPolarHBondContact OG-CB 3.31Å; S128-F132 WeakPolarHBondContact O-CB 3.47Å; S128-F132 PolarHBondContact O-N 2.73Å
129L95.6Very high95.8Very high88 Ų8881.8 Ų81.846%0.46144%0.438SS..Hα-helixtrans-55.6-45.5-176.9-175.663.9000113.3F122 F132 F133F122-L129 HydrophobicContact CE2-CB 4.26Å; F122-L129 HydrophobicContact CE2-CD1 3.83Å; F122-L129 HydrophobicContact CZ-CD1 3.61Å; L129-F132 PolarHBondContact O-N 3.21Å; L129-F133 HydrophobicContact CD1-CD2 3.84Å; L129-F133 HydrophobicContact CD1-CE2 3.55Å; L129-F133 HydrophobicContact CD2-CE2 4.34Å; L129-F133 HydrophobicContact CG-CD2 3.87Å; L129-F133 HydrophobicContact CG-CE2 3.83Å; L129-F133 WeakPolarHBondContact O-CD2 3.44Å; L129-F133 PolarHBondContact O-N 3.46Å
130D94.5Very high95.8Very high131 Ų13184 Ų8470%0.70144%0.441SS*.Hα-helixtrans-66.3-40.9-178.2-56.6-51.9000111.8S128 F133 E134S128-D130 PolarHBondContact O-N 3.33Å; D130-F133 PolarHBondContact O-N 2.87Å; D130-E134 PolarHBondContact O-N 3.39Å; D130-E134 VanDerWaalsContact O-N 3.07Å
131S93.8Very high95.8Very high37 Ų3782.2 Ų82.226%0.25944%0.437SS..Hα-helixtrans-73.5-31.7178-172.40000112.5S128 R135S128-S131 PolarHBondContact O-N 3.35Å; S128-S131 WeakPolarHBondContact OG-CB 3.31Å; S131-R135 WeakPolarHBondContact O-CB 3.45Å; S131-R135 WeakPolarHBondContact O-CG 3.47Å; S131-R135 PolarHBondContact O-N 3.14Å; S131-R135 PolarHBondContact OG-NE 3.38Å
132F96.4Very high95.9Very high23 Ų2382.2 Ų82.210%0.10144%0.436CS..Hα-helixtrans-61.9-53.8168.3173-105.7000110.5L118 A119 F122 L127 S128 L129 E134 R135 F136L118-F132 HydrophobicContact CG-CD2 4.21Å; L118-F132 HydrophobicContact CG-CE2 4.49Å; L118-F132 WeakPolarHBondContact O-CD2 3.3Å; A119-F132 HydrophobicContact CB-CE2 4.19Å; F122-F132 HydrophobicContact CB-CB 4.2Å; F122-F132 HydrophobicContact CB-CD2 3.52Å; F122-F132 HydrophobicContact CB-CE2 4.04Å; F122-F132 HydrophobicContact CB-CG 3.82Å; F122-F132 HydrophobicContact CD1-CD1 4.02Å; F122-F132 HydrophobicContact CD1-CD2 4.35Å; F122-F132 HydrophobicContact CD1-CE1 4.16Å; F122-F132 HydrophobicContact CD1-CE2 4.5Å; F122-F132 HydrophobicContact CD1-CG 4.12Å; F122-F132 HydrophobicContact CD1-CZ 4.4Å; F122-F132 HydrophobicContact CD2-CB 3.72Å; F122-F132 HydrophobicContact CD2-CD1 4.26Å; F122-F132 HydrophobicContact CD2-CD2 4.47Å; F122-F132 AromaticContact CD2-CG 3.89Å; F122-F132 HydrophobicContact CD2-CG 3.89Å; F122-F132 HydrophobicContact CE1-CD1 4.33Å; F122-F132 HydrophobicContact CE2-CB 4.38Å; F122-F132 HydrophobicContact CG-CB 3.98Å; F122-F132 AromaticContact CG-CD1 3.99Å; F122-F132 HydrophobicContact CG-CD1 3.99Å; F122-F132 AromaticContact CG-CD2 3.86Å; F122-F132 HydrophobicContact CG-CD2 3.86Å; F122-F132 HydrophobicContact CG-CE1 4.5Å; F122-F132 HydrophobicContact CG-CE2 4.4Å; F122-F132 AromaticContact CG-CG 3.64Å; F122-F132 HydrophobicContact CG-CG 3.64Å; L127-F132 HydrophobicContact CD2-CB 3.8Å; L127-F132 HydrophobicContact CD2-CD2 4.22Å; L127-F132 HydrophobicContact CG-CB 4.12Å; S128-F132 WeakPolarHBondContact O-CB 3.47Å; S128-F132 PolarHBondContact O-N 2.73Å; L129-F132 PolarHBondContact O-N 3.21Å; F132-E134 PolarHBondContact O-N 3.05Å; F132-R135 PolarHBondContact O-N 3.42Å; F132-F136 HydrophobicContact CD2-CB 4.01Å; F132-F136 HydrophobicContact CD2-CG 4.49Å; F132-F136 HydrophobicContact CE1-CB 4.32Å; F132-F136 HydrophobicContact CE1-CD1 4.4Å; F132-F136 HydrophobicContact CE1-CG 4.3Å; F132-F136 HydrophobicContact CE2-CB 3.62Å; F132-F136 HydrophobicContact CE2-CD1 4.44Å; F132-F136 AromaticContact CE2-CD2 3.58Å; F132-F136 HydrophobicContact CE2-CD2 3.58Å; F132-F136 HydrophobicContact CE2-CE2 4.35Å; F132-F136 AromaticContact CE2-CG 3.63Å; F132-F136 HydrophobicContact CE2-CG 3.63Å; F132-F136 HydrophobicContact CG-CB 4.49Å; F132-F136 HydrophobicContact CZ-CB 3.8Å; F132-F136 AromaticContact CZ-CD1 3.87Å; F132-F136 HydrophobicContact CZ-CD1 3.87Å; F132-F136 AromaticContact CZ-CD2 3.72Å; F132-F136 HydrophobicContact CZ-CD2 3.72Å; F132-F136 HydrophobicContact CZ-CE1 4.38Å; F132-F136 HydrophobicContact CZ-CE2 4.24Å; F132-F136 AromaticContact CZ-CG 3.52Å; F132-F136 HydrophobicContact CZ-CG 3.52Å; F132-F136 WeakPolarHBondContact O-CB 3.5Å; F132-F136 PolarHBondContact O-N 2.96Å
133F96Very high95.9Very high109 Ų10979.2 Ų79.248%0.47842%0.424SS..Hα-helixtrans-56.1-48.5-179.3-92.4-61.9000112.7L129 D130 L137L129-F133 HydrophobicContact CD1-CD2 3.84Å; L129-F133 HydrophobicContact CD1-CE2 3.55Å; L129-F133 HydrophobicContact CD2-CE2 4.34Å; L129-F133 HydrophobicContact CG-CD2 3.87Å; L129-F133 HydrophobicContact CG-CE2 3.83Å; L129-F133 WeakPolarHBondContact O-CD2 3.44Å; L129-F133 PolarHBondContact O-N 3.46Å; D130-F133 PolarHBondContact O-N 2.87Å; F133-L137 HydrophobicContact CD1-CD1 4.27Å; F133-L137 VanDerWaalsContact O-CB 3.22Å; F133-L137 WeakPolarHBondContact O-CB 3.06Å; F133-L137 WeakPolarHBondContact O-CD1 3.5Å; F133-L137 WeakPolarHBondContact O-CG 3.49Å; F133-L137 PolarHBondContact O-N 3.24Å; F133-L137 VanDerWaalsContact O-N 3.08Å
134E94.4Very high96Very high134 Ų13477.4 Ų77.463%0.62641%0.411SS*.Hα-helixtrans-60-52.5-179.9-173.5178.3-163.100111.7D130 F132 L138D130-E134 PolarHBondContact O-N 3.39Å; D130-E134 VanDerWaalsContact O-N 3.07Å; F132-E134 PolarHBondContact O-N 3.05Å; E134-L138 HydrophobicContact CG-CD1 4.41Å; E134-L138 WeakPolarHBondContact O-CD1 3.43Å; E134-L138 VanDerWaalsContact O-CG 3.25Å; E134-L138 WeakPolarHBondContact O-CG 3.49Å; E134-L138 PolarHBondContact O-N 2.9Å
135R96.9Very high96Very high106 Ų10676.2 Ų76.240%0.440%0.404SS..Hα-helixtrans-73.3-39.8-175-63.7-167.2-66.3150.5-1.6112.7L118 S131 F132 L138 L139L118-R135 HydrophobicContact CD1-CB 4.44Å; L118-R135 VanDerWaalsContact CD1-CZ 3.44Å; L118-R135 VanDerWaalsContact CD1-NH2 3.35Å; L118-R135 HydrophobicContact CD2-CB 3.58Å; S131-R135 WeakPolarHBondContact O-CB 3.45Å; S131-R135 WeakPolarHBondContact O-CG 3.47Å; S131-R135 PolarHBondContact O-N 3.14Å; S131-R135 PolarHBondContact OG-NE 3.38Å; F132-R135 PolarHBondContact O-N 3.42Å; R135-L138 PolarHBondContact O-N 3.28Å; R135-L139 WeakPolarHBondContact O-CG 3.22Å; R135-L139 PolarHBondContact O-N 3.33Å
136F97.3Very high96.2Very high50 Ų5075.4 Ų75.422%0.21938%0.382CS..Hα-helixtrans-69.5-42.7-178.6-175.8-96.9000111.7S115 L118 A119 F132 L138 L139 R140S115-F136 WeakPolarHBondContact O-CD2 3.25Å; S115-F136 WeakPolarHBondContact O-CE2 3.48Å; L118-F136 HydrophobicContact CD2-CB 3.83Å; L118-F136 HydrophobicContact CD2-CD2 4.48Å; L118-F136 VanDerWaalsContact CD2-N 3.34Å; A119-F136 HydrophobicContact CB-CE2 4.18Å; F132-F136 HydrophobicContact CD2-CB 4.01Å; F132-F136 HydrophobicContact CD2-CG 4.49Å; F132-F136 HydrophobicContact CE1-CB 4.32Å; F132-F136 HydrophobicContact CE1-CD1 4.4Å; F132-F136 HydrophobicContact CE1-CG 4.3Å; F132-F136 HydrophobicContact CE2-CB 3.62Å; F132-F136 HydrophobicContact CE2-CD1 4.44Å; F132-F136 AromaticContact CE2-CD2 3.58Å; F132-F136 HydrophobicContact CE2-CD2 3.58Å; F132-F136 HydrophobicContact CE2-CE2 4.35Å; F132-F136 AromaticContact CE2-CG 3.63Å; F132-F136 HydrophobicContact CE2-CG 3.63Å; F132-F136 HydrophobicContact CG-CB 4.49Å; F132-F136 HydrophobicContact CZ-CB 3.8Å; F132-F136 AromaticContact CZ-CD1 3.87Å; F132-F136 HydrophobicContact CZ-CD1 3.87Å; F132-F136 AromaticContact CZ-CD2 3.72Å; F132-F136 HydrophobicContact CZ-CD2 3.72Å; F132-F136 HydrophobicContact CZ-CE1 4.38Å; F132-F136 HydrophobicContact CZ-CE2 4.24Å; F132-F136 AromaticContact CZ-CG 3.52Å; F132-F136 HydrophobicContact CZ-CG 3.52Å; F132-F136 WeakPolarHBondContact O-CB 3.5Å; F132-F136 PolarHBondContact O-N 2.96Å; F136-L138 VanDerWaalsContact C-N 3.3Å; F136-L138 PolarHBondContact O-N 3.42Å; F136-L139 PolarHBondContact O-N 3.18Å; F136-R140 HydrophobicContact CE1-CB 4.29Å; F136-R140 HydrophobicContact CE1-CG 4.36Å; F136-R140 HydrophobicContact CZ-CB 4.48Å; F136-R140 HydrophobicContact CZ-CG 4.35Å; F136-R140 WeakPolarHBondContact O-CB 3.46Å; F136-R140 PolarHBondContact O-N 3.24Å
137L96.2Very high96.4Very high100 Ų10078.2 Ų78.252%0.52438%0.38SS..Hα-helixtrans-62-39.1175.8-71.9172.7000111.6F133 S141F133-L137 HydrophobicContact CD1-CD1 4.27Å; F133-L137 VanDerWaalsContact O-CB 3.22Å; F133-L137 WeakPolarHBondContact O-CB 3.06Å; F133-L137 WeakPolarHBondContact O-CD1 3.5Å; F133-L137 WeakPolarHBondContact O-CG 3.49Å; F133-L137 PolarHBondContact O-N 3.24Å; F133-L137 VanDerWaalsContact O-N 3.08Å; L137-S141 WeakPolarHBondContact O-CB 3.41Å; L137-S141 PolarHBondContact O-N 3.43Å; L137-S141 PolarHBondContact O-OG 2.83Å
138L96.7Very high96.5Very high117 Ų11780.8 Ų80.861%0.61340%0.396SS*.Hα-helixtrans-64.9-52.2175.9-72170.8000112E134 R135 F136 S141 L142E134-L138 HydrophobicContact CG-CD1 4.41Å; E134-L138 WeakPolarHBondContact O-CD1 3.43Å; E134-L138 VanDerWaalsContact O-CG 3.25Å; E134-L138 WeakPolarHBondContact O-CG 3.49Å; E134-L138 PolarHBondContact O-N 2.9Å; R135-L138 PolarHBondContact O-N 3.28Å; F136-L138 VanDerWaalsContact C-N 3.3Å; F136-L138 PolarHBondContact O-N 3.42Å; L138-S141 PolarHBondContact O-N 3.43Å; L138-L142 WeakPolarHBondContact O-CB 3.46Å; L138-L142 PolarHBondContact O-N 2.92Å
139L97.4Very high96.6Very high38 Ų3882.7 Ų82.720%0.19940%0.398CS..Hα-helixtrans-62.9-47.4179.5-74.8168.2000112.1T111 E114 L118 R135 F136 S141 L142 A143T111-L139 HydrophobicContact CG2-CB 4.48Å; T111-L139 HydrophobicContact CG2-CD2 3.97Å; T111-L139 WeakPolarHBondContact CG2-O 3.17Å; E114-L139 HydrophobicContact CB-CD1 4.42Å; E114-L139 HydrophobicContact CB-CD2 4.38Å; L118-L139 HydrophobicContact CD2-CD1 3.88Å; R135-L139 WeakPolarHBondContact O-CG 3.22Å; R135-L139 PolarHBondContact O-N 3.33Å; F136-L139 PolarHBondContact O-N 3.18Å; L139-S141 PolarHBondContact O-N 3.37Å; L139-L142 WeakPolarHBondContact O-CB 3.23Å; L139-L142 PolarHBondContact O-N 2.8Å; L139-L142 VanDerWaalsContact O-N 3.11Å; L139-A143 PolarHBondContact O-N 3.36Å
140R97Very high96.7Very high68 Ų6879.6 Ų79.626%0.25738%0.381SS..Hα-helixtrans-67.3-37.2-179.1-157.273-176.8135.9-3.6111.8E112 F136 L142 A143 H144E112-R140 IonicContact OE1-CZ 3.47Å; E112-R140 IonicContact OE1-NH1 3Å; E112-R140 PolarHBondContact OE1-NH1 3.03Å; E112-R140 IonicContact OE1-NH2 3.84Å; E112-R140 PolarHBondContact OE1-NH2 3.32Å; F136-R140 HydrophobicContact CE1-CB 4.29Å; F136-R140 HydrophobicContact CE1-CG 4.36Å; F136-R140 HydrophobicContact CZ-CB 4.48Å; F136-R140 HydrophobicContact CZ-CG 4.35Å; F136-R140 WeakPolarHBondContact O-CB 3.46Å; F136-R140 PolarHBondContact O-N 3.24Å; R140-L142 VanDerWaalsContact C-N 3.33Å; R140-L142 PolarHBondContact O-N 3.39Å; R140-A143 PolarHBondContact O-N 3.21Å; R140-H144 PolarHBondContact O-CD2 3.02Å; R140-H144 VanDerWaalsContact O-CD2 3.23Å; R140-H144 PolarHBondContact O-N 3.07Å
141S97.5Very high96.8Very high57 Ų5777.7 Ų77.740%0.39937%0.368SS..Hα-helixtrans-63.2-37.6170.8-65.20000112.6L137 L138 L139 K145L137-S141 WeakPolarHBondContact O-CB 3.41Å; L137-S141 PolarHBondContact O-N 3.43Å; L137-S141 PolarHBondContact O-OG 2.83Å; L138-S141 PolarHBondContact O-N 3.43Å; L139-S141 PolarHBondContact O-N 3.37Å; S141-K145 WeakPolarHBondContact O-CB 3.08Å; S141-K145 WeakPolarHBondContact O-CD 3.46Å; S141-K145 VanDerWaalsContact O-CG 3.23Å; S141-K145 WeakPolarHBondContact O-CG 3.21Å; S141-K145 PolarHBondContact O-N 2.96Å; S141-K145 VanDerWaalsContact O-N 3.13Å
142L97.8Very high96.9Very high69 Ų6982.4 Ų82.436%0.36138%0.384SS..Hα-helixtrans-68.9-45.1175.8-179.461.3000111.4T111 L138 L139 R140 H144 K145 R146T111-L142 HydrophobicContact CG2-CB 4.23Å; T111-L142 HydrophobicContact CG2-CD2 4.09Å; T111-L142 HydrophobicContact CG2-CG 4.17Å; L138-L142 WeakPolarHBondContact O-CB 3.46Å; L138-L142 PolarHBondContact O-N 2.92Å; L139-L142 WeakPolarHBondContact O-CB 3.23Å; L139-L142 PolarHBondContact O-N 2.8Å; L139-L142 VanDerWaalsContact O-N 3.11Å; R140-L142 VanDerWaalsContact C-N 3.33Å; R140-L142 PolarHBondContact O-N 3.39Å; L142-H144 PolarHBondContact O-N 3.37Å; L142-K145 PolarHBondContact O-N 3.46Å; L142-R146 HydrophobicContact CD1-CG 4.3Å; L142-R146 HydrophobicContact CG-CG 4.49Å; L142-R146 WeakPolarHBondContact O-CB 3.49Å; L142-R146 WeakPolarHBondContact O-CG 3.31Å; L142-R146 PolarHBondContact O-N 2.92Å
143A97.2Very high96.8Very high3 Ų383.2 Ų83.23%0.02539%0.389CS..Hα-helixtrans-57.5-48.3175.900000111.7T111 L139 R140 K145 R146 R147T111-A143 HydrophobicContact CG2-CB 4.12Å; L139-A143 PolarHBondContact O-N 3.36Å; R140-A143 PolarHBondContact O-N 3.21Å; A143-K145 PolarHBondContact O-N 3.28Å; A143-R146 PolarHBondContact O-N 2.8Å; A143-R147 WeakPolarHBondContact O-CB 3.46Å; A143-R147 PolarHBondContact O-N 3.45Å
144H97.6Very high96.8Very high98 Ų9883.4 Ų83.445%0.45439%0.392SS..Hα-helixtrans-63.3-38.8177-66.9-34.1000112.9R140 L142 V148R140-H144 PolarHBondContact O-CD2 3.02Å; R140-H144 VanDerWaalsContact O-CD2 3.23Å; R140-H144 PolarHBondContact O-N 3.07Å; L142-H144 PolarHBondContact O-N 3.37Å; H144-V148 WeakPolarHBondContact O-CG2 3.48Å; H144-V148 PolarHBondContact O-N 2.93Å; H144-V148 VanDerWaalsContact O-N 3.15Å
145K97.7Very high96.8Very high136 Ų13680 Ų8059%0.59138%0.375SS*.Hα-helixtrans-62.9-46.1172.8-74.2168.3-174.8174.30111.8S141 L142 A143 V148 Q149S141-K145 WeakPolarHBondContact O-CB 3.08Å; S141-K145 WeakPolarHBondContact O-CD 3.46Å; S141-K145 VanDerWaalsContact O-CG 3.23Å; S141-K145 WeakPolarHBondContact O-CG 3.21Å; S141-K145 PolarHBondContact O-N 2.96Å; S141-K145 VanDerWaalsContact O-N 3.13Å; L142-K145 PolarHBondContact O-N 3.46Å; A143-K145 PolarHBondContact O-N 3.28Å; K145-V148 PolarHBondContact O-N 3.34Å; K145-Q149 VanDerWaalsContact O-CG 3.3Å; K145-Q149 WeakPolarHBondContact O-CG 3.49Å; K145-Q149 PolarHBondContact O-N 3.46Å
146R97.6Very high96.7Very high43 Ų4380 Ų8016%0.16238%0.382CS..Hα-helixtrans-60.7-44.7177.6-74.7178.4169.3-168.1-14.8111L104 E107 T111 L142 A143 V148 Q149 I150L104-R146 HydrophobicContact CD1-CB 4.41Å; L104-R146 HydrophobicContact CD1-CG 4.12Å; E107-R146 PolarHBondContact O-NH1 3.25Å; E107-R146 IonicContact OE2-CZ 2.7Å; E107-R146 IonicContact OE2-NH1 2.76Å; E107-R146 PolarHBondContact OE2-NH1 2.78Å; E107-R146 IonicContact OE2-NH2 3.35Å; E107-R146 PolarHBondContact OE2-NH2 2.84Å; T111-R146 PolarHBondContact OG1-NH1 2.81Å; L142-R146 HydrophobicContact CD1-CG 4.3Å; L142-R146 HydrophobicContact CG-CG 4.49Å; L142-R146 WeakPolarHBondContact O-CB 3.49Å; L142-R146 WeakPolarHBondContact O-CG 3.31Å; L142-R146 PolarHBondContact O-N 2.92Å; A143-R146 PolarHBondContact O-N 2.8Å; R146-V148 PolarHBondContact O-N 2.68Å; R146-Q149 WeakPolarHBondContact O-CB 3.47Å; R146-Q149 PolarHBondContact O-N 2.99Å; R146-Q149 VanDerWaalsContact O-N 3.15Å; R146-I150 VanDerWaalsContact O-CG1 3.31Å; R146-I150 WeakPolarHBondContact O-CG1 3.45Å; R146-I150 PolarHBondContact O-N 3.27Å
147R96.9Very high96.4Very high140 Ų14078.7 Ų78.753%0.52838%0.378SS..Hα-helixtrans-56-49.7175.1-172.7-179.1-176.6114.32112.9A143 Q149 I150 E151A143-R147 WeakPolarHBondContact O-CB 3.46Å; A143-R147 PolarHBondContact O-N 3.45Å; R147-Q149 VanDerWaalsContact C-N 3.31Å; R147-Q149 PolarHBondContact O-N 3.08Å; R147-I150 WeakPolarHBondContact O-CB 3.3Å; R147-I150 PolarHBondContact O-N 3.4Å; R147-E151 IonicContact NE-OE1 3.79Å; R147-E151 PolarHBondContact NE-OE1 3Å; R147-E151 WeakPolarHBondContact O-CG 3.38Å; R147-E151 PolarHBondContact O-N 3.41Å
148V97.8Very high96.2Very high78 Ų7879.6 Ų79.647%0.47337%0.374SS..Hα-helixtrans-63.7-38.3177.51750000111.2H144 K145 R146 E151 K152H144-V148 WeakPolarHBondContact O-CG2 3.48Å; H144-V148 PolarHBondContact O-N 2.93Å; H144-V148 VanDerWaalsContact O-N 3.15Å; K145-V148 PolarHBondContact O-N 3.34Å; R146-V148 PolarHBondContact O-N 2.68Å; V148-E151 PolarHBondContact O-N 3.23Å; V148-K152 HydrophobicContact CG1-CG 4.41Å; V148-K152 WeakPolarHBondContact O-CG 3.34Å; V148-K152 PolarHBondContact O-N 3Å
149Q96.7Very high96Very high111 Ų11179 Ų7952%0.51937%0.368SS..Hα-helixtrans-63.6-40.1175.4-72.5171.6-11.500112.4L104 K145 R146 R147 K152 L153L104-Q149 HydrophobicContact CD2-CB 3.91Å; K145-Q149 VanDerWaalsContact O-CG 3.3Å; K145-Q149 WeakPolarHBondContact O-CG 3.49Å; K145-Q149 PolarHBondContact O-N 3.46Å; R146-Q149 WeakPolarHBondContact O-CB 3.47Å; R146-Q149 PolarHBondContact O-N 2.99Å; R146-Q149 VanDerWaalsContact O-N 3.15Å; R147-Q149 VanDerWaalsContact C-N 3.31Å; R147-Q149 PolarHBondContact O-N 3.08Å; Q149-K152 PolarHBondContact O-N 3.42Å; Q149-L153 VanDerWaalsContact O-CB 3.3Å; Q149-L153 WeakPolarHBondContact O-CB 3.29Å; Q149-L153 PolarHBondContact O-N 2.83Å
150I97.3Very high95.5Very high24 Ų2484.9 Ų84.912%0.12339%0.388CS..Hα-helixtrans-60.3-53.1173.7-69.6165.2000110.1F101 L104 Q105 R146 R147 K152 L153 Q154F101-I150 HydrophobicContact CE2-CB 4.43Å; F101-I150 HydrophobicContact CE2-CG2 3.58Å; F101-I150 HydrophobicContact CZ-CG2 3.87Å; L104-I150 HydrophobicContact CB-CG1 4.47Å; L104-I150 HydrophobicContact CD2-CG1 3.71Å; L104-I150 HydrophobicContact CG-CD1 4.28Å; L104-I150 HydrophobicContact CG-CG1 3.7Å; Q105-I150 HydrophobicContact CB-CD1 4.4Å; R146-I150 VanDerWaalsContact O-CG1 3.31Å; R146-I150 WeakPolarHBondContact O-CG1 3.45Å; R146-I150 PolarHBondContact O-N 3.27Å; R147-I150 WeakPolarHBondContact O-CB 3.3Å; R147-I150 PolarHBondContact O-N 3.4Å; I150-K152 VanDerWaalsContact C-N 3.29Å; I150-K152 PolarHBondContact O-N 2.83Å; I150-L153 PolarHBondContact O-N 3.42Å; I150-Q154 WeakPolarHBondContact O-CB 3.5Å; I150-Q154 PolarHBondContact O-N 2.99Å
151E96.1Very high94.9Very high91 Ų9187.2 Ų87.243%0.42541%0.406SS..Hα-helixtrans-57.7-40.1179.7-70.3171.8-167.600112.2R147 V148 E155R147-E151 IonicContact NE-OE1 3.79Å; R147-E151 PolarHBondContact NE-OE1 3Å; R147-E151 WeakPolarHBondContact O-CG 3.38Å; R147-E151 PolarHBondContact O-N 3.41Å; V148-E151 PolarHBondContact O-N 3.23Å; E151-E155 PolarHBondContact O-N 3.48Å; E151-E155 VanDerWaalsContact O-N 3.16Å
152K96.9Very high94.2Very high136 Ų13691 Ų9159%0.59142%0.415SS*.Hα-helixtrans-72.1-39.7176.4-64.8-51.2178.8-1660113.2V148 Q149 I150 E155 I156V148-K152 HydrophobicContact CG1-CG 4.41Å; V148-K152 WeakPolarHBondContact O-CG 3.34Å; V148-K152 PolarHBondContact O-N 3Å; Q149-K152 PolarHBondContact O-N 3.42Å; I150-K152 VanDerWaalsContact C-N 3.29Å; I150-K152 PolarHBondContact O-N 2.83Å; K152-E155 PolarHBondContact O-N 3.11Å; K152-I156 WeakPolarHBondContact O-CD1 3.34Å; K152-I156 VanDerWaalsContact O-CG1 3.3Å; K152-I156 WeakPolarHBondContact O-CG1 3.3Å; K152-I156 PolarHBondContact O-N 3.46Å
153L94.7Very high92.8Very high40 Ų4092 Ų9221%0.20943%0.427CS..Hα-helixtrans-66.7-42.3176.9-177.655.3000111.1F101 Q149 I150 E155 I156 L157F101-L153 HydrophobicContact CB-CD2 3.81Å; F101-L153 HydrophobicContact CB-CG 4.31Å; F101-L153 HydrophobicContact CD2-CB 4.18Å; F101-L153 HydrophobicContact CD2-CD2 3.99Å; F101-L153 HydrophobicContact CD2-CG 3.95Å; F101-L153 HydrophobicContact CG-CD2 4.43Å; Q149-L153 VanDerWaalsContact O-CB 3.3Å; Q149-L153 WeakPolarHBondContact O-CB 3.29Å; Q149-L153 PolarHBondContact O-N 2.83Å; I150-L153 PolarHBondContact O-N 3.42Å; L153-E155 VanDerWaalsContact C-N 3.3Å; L153-E155 PolarHBondContact O-N 3.49Å; L153-I156 PolarHBondContact O-N 3.43Å; L153-L157 HydrophobicContact CD1-CG 4.49Å; L153-L157 HydrophobicContact CG-CD1 4.4Å; L153-L157 VanDerWaalsContact O-CG 3.31Å; L153-L157 WeakPolarHBondContact O-CG 3.33Å; L153-L157 PolarHBondContact O-N 3.49Å
154Q95.3Very high91Very high113 Ų11397.3 Ų97.353%0.52846%0.455SS..Hα-helixtrans-57.7-42.3173.8-168.5179.19.400112F101 I150 L157 R158F101-Q154 HydrophobicContact CE2-CB 3.76Å; F101-Q154 HydrophobicContact CE2-CG 4.4Å; F101-Q154 HydrophobicContact CZ-CB 4.21Å; F101-Q154 HydrophobicContact CZ-CG 4.38Å; I150-Q154 WeakPolarHBondContact O-CB 3.5Å; I150-Q154 PolarHBondContact O-N 2.99Å; Q154-L157 PolarHBondContact O-N 2.87Å; Q154-R158 WeakPolarHBondContact O-CB 3.29Å; Q154-R158 PolarHBondContact O-N 2.97Å
155E94.7Very high88.8Confident61 Ų6197.7 Ų97.729%0.28547%0.466SS..Hα-helixtrans-66-41.3177179.455-159.900112.3E151 K152 L153 R158 Q159E151-E155 PolarHBondContact O-N 3.48Å; E151-E155 VanDerWaalsContact O-N 3.16Å; K152-E155 PolarHBondContact O-N 3.11Å; L153-E155 VanDerWaalsContact C-N 3.3Å; L153-E155 PolarHBondContact O-N 3.49Å; E155-R158 PolarHBondContact O-N 3.01Å; E155-R158 IonicContact OE1-CZ 3.69Å; E155-R158 IonicContact OE1-NE 2.99Å; E155-R158 IonicContact OE1-NH2 2.76Å; E155-R158 PolarHBondContact OE1-NH2 3.25Å; E155-R158 IonicContact OE2-CZ 3.08Å; E155-R158 IonicContact OE2-NE 3.93Å; E155-R158 PolarHBondContact OE2-NE 3.15Å; E155-R158 IonicContact OE2-NH2 2.77Å; E155-R158 PolarHBondContact OE2-NH2 2.86Å; E155-Q159 WeakPolarHBondContact O-CB 3.48Å; E155-Q159 VanDerWaalsContact O-CG 3.29Å; E155-Q159 WeakPolarHBondContact O-CG 3.49Å; E155-Q159 PolarHBondContact O-N 3.13Å; E155-Q159 WeakPolarHBondContact OE1-CG 3.4Å; E155-Q159 PolarHBondContact OE1-NE2 3.43Å
156I93.4Very high86.5Confident106 Ų10697.5 Ų97.554%0.54448%0.477SS..Hα-helixtrans-62.4-43.8175.9-68.8163.3000111K152 L153 Q159 R160K152-I156 WeakPolarHBondContact O-CD1 3.34Å; K152-I156 VanDerWaalsContact O-CG1 3.3Å; K152-I156 WeakPolarHBondContact O-CG1 3.3Å; K152-I156 PolarHBondContact O-N 3.46Å; L153-I156 PolarHBondContact O-N 3.43Å; I156-Q159 PolarHBondContact O-N 3.24Å; I156-R160 PolarHBondContact O-N 3.15Å
157L91.6Very high84.2Confident23 Ų2399.8 Ų99.812%0.1251%0.505CS..Hα-helixtrans-59.8-50.2175.1-68.2172.9000111P97 E98 F101 L153 Q154 Q159 R160 D161P97-L157 HydrophobicContact CB-CD2 3.6Å; E98-L157 HydrophobicContact CG-CD2 4.4Å; F101-L157 HydrophobicContact CB-CD1 4.16Å; F101-L157 HydrophobicContact CD2-CD1 4.31Å; F101-L157 HydrophobicContact CG-CD1 4.19Å; L153-L157 HydrophobicContact CD1-CG 4.49Å; L153-L157 HydrophobicContact CG-CD1 4.4Å; L153-L157 VanDerWaalsContact O-CG 3.31Å; L153-L157 WeakPolarHBondContact O-CG 3.33Å; L153-L157 PolarHBondContact O-N 3.49Å; Q154-L157 PolarHBondContact O-N 2.87Å; L157-Q159 VanDerWaalsContact C-N 3.27Å; L157-Q159 PolarHBondContact O-N 3.45Å; L157-R160 VanDerWaalsContact O-CB 3.29Å; L157-R160 WeakPolarHBondContact O-CB 3.38Å; L157-R160 PolarHBondContact O-N 3.39Å; L157-D161 PolarHBondContact O-N 3.43Å
158R92.7Very high81.5Confident120 Ų120101.5 Ų101.545%0.45352%0.521SS..Hα-helixtrans-60.7-33.1178-169.9-17473.6116.76.4113.2Q154 E155 K162Q154-R158 WeakPolarHBondContact O-CB 3.29Å; Q154-R158 PolarHBondContact O-N 2.97Å; E155-R158 PolarHBondContact O-N 3.01Å; E155-R158 IonicContact OE1-CZ 3.69Å; E155-R158 IonicContact OE1-NE 2.99Å; E155-R158 IonicContact OE1-NH2 2.76Å; E155-R158 PolarHBondContact OE1-NH2 3.25Å; E155-R158 IonicContact OE2-CZ 3.08Å; E155-R158 IonicContact OE2-NE 3.93Å; E155-R158 PolarHBondContact OE2-NE 3.15Å; E155-R158 IonicContact OE2-NH2 2.77Å; E155-R158 PolarHBondContact OE2-NH2 2.86Å; R158-K162 VanDerWaalsContact NH1-NZ 3.17Å; R158-K162 WeakPolarHBondContact O-CG 3.46Å; R158-K162 PolarHBondContact O-N 3.24Å
159Q91.7Very high78.8Confident105 Ų105103.8 Ų103.849%0.49154%0.535SS..Hα-helixtrans-72.2-40.7173.9-74.4177.718.400111.8E155 I156 L157 D161 K162 S163E155-Q159 WeakPolarHBondContact O-CB 3.48Å; E155-Q159 VanDerWaalsContact O-CG 3.29Å; E155-Q159 WeakPolarHBondContact O-CG 3.49Å; E155-Q159 PolarHBondContact O-N 3.13Å; E155-Q159 WeakPolarHBondContact OE1-CG 3.4Å; E155-Q159 PolarHBondContact OE1-NE2 3.43Å; I156-Q159 PolarHBondContact O-N 3.24Å; L157-Q159 VanDerWaalsContact C-N 3.27Å; L157-Q159 PolarHBondContact O-N 3.45Å; Q159-D161 VanDerWaalsContact C-N 3.35Å; Q159-D161 PolarHBondContact O-N 2.85Å; Q159-K162 PolarHBondContact O-N 2.88Å; Q159-S163 WeakPolarHBondContact O-CB 3.32Å; Q159-S163 PolarHBondContact O-N 3.01Å; Q159-S163 PolarHBondContact O-OG 3.01Å
160R87.6Confident76Confident160 Ų160105 Ų10560%0.60456%0.556SS**Hα-helixtrans-55.7-49.1174.5-178.9-175.917979.90.2111I156 L157 K162 S163I156-R160 PolarHBondContact O-N 3.15Å; L157-R160 VanDerWaalsContact O-CB 3.29Å; L157-R160 WeakPolarHBondContact O-CB 3.38Å; L157-R160 PolarHBondContact O-N 3.39Å; R160-K162 VanDerWaalsContact C-N 3.32Å; R160-K162 PolarHBondContact O-N 3.18Å; R160-S163 WeakPolarHBondContact CA-OG 3.49Å; R160-S163 PolarHBondContact O-N 3.29Å; R160-S163 VanDerWaalsContact O-N 3.14Å; R160-S163 PolarHBondContact O-OG 2.89Å
161D84.6Confident73.6Confident118 Ų118109.5 Ų109.563%0.63159%0.59SS**Hα-helixtrans-60.7-40.2179.5-61.9-28.9000112.3L157 Q159L157-D161 PolarHBondContact O-N 3.43Å; Q159-D161 VanDerWaalsContact C-N 3.35Å; Q159-D161 PolarHBondContact O-N 2.85Å
162K82.6Confident70.9Confident137 Ų137110.2 Ų110.260%0.59661%0.611SS**Hα-helixtrans-71.9-29.1176.5-71.5175178.3-174.70113.8R158 Q159 R160 N164R158-K162 VanDerWaalsContact NH1-NZ 3.17Å; R158-K162 WeakPolarHBondContact O-CG 3.46Å; R158-K162 PolarHBondContact O-N 3.24Å; Q159-K162 PolarHBondContact O-N 2.88Å; R160-K162 VanDerWaalsContact C-N 3.32Å; R160-K162 PolarHBondContact O-N 3.18Å; K162-N164 PolarHBondContact O-N 3.05Å
163S68.8Low67.7Low89 Ų89107.4 Ų107.462%0.62262%0.621SS**THydrogen-bonded Turntrans-77.1-3.3-179.571.30000114Q159 R160 P165Q159-S163 WeakPolarHBondContact O-CB 3.32Å; Q159-S163 PolarHBondContact O-N 3.01Å; Q159-S163 PolarHBondContact O-OG 3.01Å; R160-S163 WeakPolarHBondContact CA-OG 3.49Å; R160-S163 PolarHBondContact O-N 3.29Å; R160-S163 VanDerWaalsContact O-N 3.14Å; R160-S163 PolarHBondContact O-OG 2.89Å; S163-P165 WeakPolarHBondContact O-CD 3.34Å
164N58.1Low65.1Low115 Ų115112.6 Ų112.662%0.61565%0.654SS**  trans-117.765.2-172.3-152.417.2000112.4K162 T166K162-N164 PolarHBondContact O-N 3.05Å; N164-T166 VanDerWaalsContact C-N 3.27Å; N164-T166 PolarHBondContact O-N 3.37Å
165P52.5Low62.3Low105 Ų105111.3 Ų111.368%0.68266%0.663SS**  trans-76.60.9-170.332.7-38.2000115.4S163 A167S163-P165 WeakPolarHBondContact O-CD 3.34Å; P165-A167 PolarHBondContact O-N 3.46Å
166T49.1Very low60Low132 Ų132114.3 Ų114.381%0.8169%0.687SS**  trans-86.440.4-173.7-36.90000113.2N164N164-T166 VanDerWaalsContact C-N 3.27Å; N164-T166 PolarHBondContact O-N 3.37Å
167A48.9Very low57.2Low92 Ų92116.7 Ų116.776%0.7670%0.701SS**  trans-134.931.8178.300000113.3P165P165-A167 PolarHBondContact O-N 3.46Å
168M41.3Very low54.9Low175 Ų175120.7 Ų120.786%0.86273%0.729SS**  trans-143.7136.2164.2-66.4-165.8-178.800106.6
169T40.3Very low52.7Low126 Ų126121.7 Ų121.777%0.77375%0.748SS**  cis-143.1150.319.450.60000111.8
170S38.3Very low49.9Very low136 Ų136121.3 Ų121.395%0.95176%0.763SS**  trans-141.963.1156.6-83.60000109.2
171S46.7Very low47.4Very low119 Ų119119.9 Ų119.983%0.83277%0.772SS**  trans-148.181.5174-174.80000110
172A38.5Very low45Very low106 Ų106118.6 Ų118.688%0.87678%0.778SS**  trans-164106.6162.900000107.9
173G31.1Very low42.6Very low77 Ų77116.3 Ų116.379%0.79478%0.784SS**  trans159.929.2-177.200000117.1A175G173-A175 PolarHBondContact O-N 3.16Å; G173-A175 VanDerWaalsContact O-N 3.09Å
174V39.8Very low40.7Very low150 Ų150116.7 Ų116.791%0.90979%0.787SS**  trans-77.195168179.40000108.5
175A35.4Very low39.3Very low86 Ų86122.3 Ų122.371%0.71180%0.8SS**  trans-101.9123.8159.900000108.1G173 N177G173-A175 PolarHBondContact O-N 3.16Å; G173-A175 VanDerWaalsContact O-N 3.09Å; A175-N177 PolarHBondContact O-N 3.46Å
176P47.3Very low38.8Very low123 Ų123124 Ų12480%0.79980%0.803SS**  trans-76.2122.6175.630.7-31.5000109.2
177N35.4Very low38.2Very low157 Ų157124.9 Ų124.984%0.8480%0.802SS**  trans-127.9151.9167.6-118.7-6.6000110A175A175-N177 PolarHBondContact O-N 3.46Å
178P43.2Very low37.5Very low107 Ų107126.2 Ų126.270%0.69580%0.803SS**  trans-81.6161.8-153.331.8-37.4000114.4A180P178-A180 PolarHBondContact O-N 2.95Å
179V45.4Very low37Very low140 Ų140124.2 Ų124.285%0.84880%0.801SS**  trans-10.1106.2165.4177.90000114.5
180A32.6Very low36.5Very low98 Ų98124.5 Ų124.581%0.8180%0.803SS**  trans-97.4114.4163.500000109.4P178 A182P178-A180 PolarHBondContact O-N 2.95Å; A180-A182 PolarHBondContact O-N 3.2Å
181T36.6Very low36.2Very low129 Ų129124.4 Ų124.479%0.79180%0.796SS**  trans-60.6125.4174.5-46.50000110.3A183T181-A183 PolarHBondContact O-N 3.38Å; T181-A183 VanDerWaalsContact O-N 3.16Å
182A33.3Very low35.4Very low92 Ų92125.4 Ų125.476%0.7680%0.797SS**  trans-70110.517700000110.9A180A180-A182 PolarHBondContact O-N 3.2Å
183A32.5Very low35Very low88 Ų88126.4 Ų126.473%0.72779%0.793SS**  trans-103.989.9169.100000109.6T181 W185T181-A183 PolarHBondContact O-N 3.38Å; T181-A183 VanDerWaalsContact O-N 3.16Å; A183-W185 PolarHBondContact O-N 2.97Å
184S28.3Very low34.8Very low97 Ų97129 Ų12968%0.67879%0.793SS**  trans-75.5111.8177.1-56.90000110.7N186S184-N186 VanDerWaalsContact C-N 3.32Å; S184-N186 PolarHBondContact O-N 3.37Å
185W29.9Very low34.4Very low234 Ų234126.5 Ų126.589%0.88678%0.778SS**  trans-7286.4168.2-78.395.2000110.6A183A183-W185 PolarHBondContact O-N 2.97Å
186N40.8Very low34.2Very low140 Ų140129 Ų12975%0.74978%0.78SS**  trans-106.3119.4164.5-76.8-40.9000108.9S184S184-N186 VanDerWaalsContact C-N 3.32Å; S184-N186 PolarHBondContact O-N 3.37Å
187L36.1Very low33.6Very low150 Ų150130.5 Ų130.579%0.78578%0.78SS**PPolyproline II helixtrans-79.2135.7167.5-82.673.1000109.1
188P35Very low33.6Very low121 Ų121128.2 Ų128.279%0.78677%0.774SS**PPolyproline II helixtrans-81.5129.6175.131.4-32.3000111.5
189T31.5Very low32.9Very low132 Ų132131.9 Ų131.981%0.8178%0.782SS**PPolyproline II helixtrans-102.6121.4159.5-61.40000108.8T191T189-T191 PolarHBondContact O-N 3.06Å
190T29.3Very low33Very low133 Ų133130.2 Ų130.282%0.81677%0.774SS**PPolyproline II helixtrans-71.7122.6-177-430000111.6
191T31.6Very low32.8Very low133 Ų133133 Ų13382%0.81678%0.775SS**  trans-147.8136.8153.9-6.70000112.5T189T189-T191 PolarHBondContact O-N 3.06Å
192V30.2Very low32.4Very low140 Ų140132.4 Ų132.485%0.84878%0.776SS**  trans-59.8145.5-163.2-1760000115.9
193T29.1Very low32.3Very low128 Ų128135.6 Ų135.679%0.78578%0.78SS**  trans-86.3147.8177.3-37.60000113.7
194T27.6Very low33.2Very low130 Ų130136.6 Ų136.680%0.79878%0.78SS**  trans-167.1138.2153.8-79.90000108.1
195T30.7Very low33.8Very low98 Ų98137.5 Ų137.560%0.60178%0.783SS**  cis-167.5133.1-20.7-80.90000106.9
196N32.8Very low33.7Very low139 Ų139131.5 Ų131.574%0.74378%0.777SS**  trans160.5115.3136.1-92.2-64.7000115.4
197L34.3Very low33.1Very low155 Ų155130.4 Ų130.481%0.81278%0.78SS**  trans42.3156.9136.8-82.175.9000124.4
198P34.4Very low32.7Very low109 Ų109127.2 Ų127.271%0.70877%0.77SS**  trans-133.3160.2-149.240.5-22.2000119
199Q29.8Very low32.5Very low183 Ų183131.4 Ų131.486%0.85577%0.772SS**  trans68.5166.6146.5-97.3-167.7-1.800120.6
200P46.3Very low32.5Very low105 Ų105133.1 Ų133.168%0.68277%0.771SS**  cis-137.7174-13.538.9-20.6000116.9
201N28.4Very low32.4Very low156 Ų156133.4 Ų133.483%0.83477%0.767SS**  trans52.4131.8145.8-119.12.6000123.8
202S29.7Very low32.3Very low118 Ų118131.2 Ų131.283%0.82576%0.758SS**  -179.3163.1113.1370000113.8
203N31.1Very low32.4Very low158 Ų158129.4 Ų129.485%0.84575%0.751SS**  trans-104.3173.9-166-112.8-8.4000113.6
204P50.4Low32.8Very low109 Ų109131.7 Ų131.771%0.70875%0.753SS**  trans-96.8172.8-166.239.5-38.5000115.9
205P41.7Very low32.9Very low116 Ų116131 Ų13175%0.75375%0.754SS**  trans-137.3137.9131.731.8-16.2000112
206S28.2Very low33Very low109 Ų109131.1 Ų131.176%0.76276%0.764SS**  102148.159.9-68.30000112.9
207S28Very low33Very low116 Ų116130.4 Ų130.481%0.81177%0.77SS**  trans70144.7170.873.40000119.2
208S27.3Very low32.8Very low83 Ų83128 Ų12858%0.5877%0.767SS**  cis-175.8140-18.952.30000112.4
209Y30.1Very low32.7Very low210 Ų210128.3 Ų128.382%0.82477%0.771SS**  trans58.6164.1167.2-47.8-64.5000114.8
210Q31.9Very low32.7Very low168 Ų168123.8 Ų123.879%0.78577%0.765SS**  cis-165.2160.1-19.1-113.7175200105.4
211N28.3Very low32.4Very low138 Ų138126.1 Ų126.174%0.73878%0.777SS**  cis-159.8-175.1-0.4-167.714.2000108.9
212S28.4Very low32.4Very low88 Ų88122.6 Ų122.662%0.61578%0.777SS**  trans74.299.4151-64.10000121.3
213S32.9Very low32.9Very low102 Ų102121.6 Ų121.671%0.71378%0.777SS**  77.9127.6119.966.60000122.5
214Q37.1Very low33.1Very low175 Ų175119.8 Ų119.882%0.81878%0.776SS**  trans80.176.8151.3-65.9175.429.500118.6A216Q214-A216 PolarHBondContact O-N 3.26Å
215S30.1Very low32.4Very low117 Ų117118.4 Ų118.482%0.81878%0.781SS**  25.994.1123.356.90000118
216A33.1Very low32.8Very low99 Ų99120.6 Ų120.682%0.81879%0.786SS**  trans-108.9127.9148.800000108.5Q214Q214-A216 PolarHBondContact O-N 3.26Å
217S31Very low33.5Very low124 Ų124121.3 Ų121.387%0.86779%0.788SS**  trans-133.4117.4169.6-69.60000109.5
218S31.6Very low33.7Very low106 Ų106125.9 Ų125.974%0.74179%0.789SS**  trans-85.7154.4-179.5540000113.2
219S32Very low34.2Very low114 Ų114126.1 Ų126.180%0.79779%0.791SS**  trans81.5144.3143-610000121.9
220A29.8Very low34.8Very low89 Ų89122.1 Ų122.174%0.73679%0.791SS**  trans93.2107.8143.300000120.5
221V38.8Very low35.1Very low154 Ų154123.6 Ų123.693%0.93379%0.79SS**  40.8108.7126.5-168.20000117.9
222G29.6Very low35.7Very low81 Ų81122.9 Ų122.984%0.83579%0.793SS**  trans-152.5123.6163.300000111
223A39.5Very low36.3Very low98 Ų98125.3 Ų125.381%0.8180%0.804SS**  trans-89.5156.5-178.100000112.5
224S34.6Very low37Very low120 Ų120125.6 Ų125.684%0.83981%0.806SS**  trans-159.2117.2155.9-79.90000110.3
225G37.5Very low37.7Very low79 Ų79122.8 Ų122.881%0.81480%0.803SS**  trans-85.2140.6171.200000110.8
226L49.7Very low38.5Very low162 Ų162123.3 Ų123.385%0.84880%0.803SS**  trans-107.9140.8174.9-64.9176.5000110.5
227P41.8Very low39.3Very low124 Ų124126.1 Ų126.181%0.80581%0.805SS**  trans-77.3141.8170.232.6-32.9000110.4
228Y33.7Very low40.4Very low212 Ų212125.5 Ų125.583%0.83180%0.798SS**  trans-125.3131.2168.9-145.8-88.8000109.6
229S36.3Very low41.1Very low88 Ų88126.4 Ų126.462%0.61580%0.801SS**PPolyproline II helixtrans-86.9140.3178.737.10000111.1
230P43.3Very low41.2Very low127 Ų127125.9 Ų125.983%0.82580%0.804SS**PPolyproline II helixtrans-81.3134.8177.231.9-32.9000111.5
231Y38.6Very low41.5Very low198 Ų198128.6 Ų128.678%0.77681%0.811SS**PPolyproline II helixtrans-78146.4165-77.5-92.2000110.5
232P40.6Very low41.6Very low124 Ų124128.4 Ų128.481%0.80581%0.81SS**PPolyproline II helixtrans-75.4135.1176.330.7-33.5000111.5
233V40.7Very low41.8Very low139 Ų139129.7 Ų129.784%0.84281%0.813SS**  trans-105.8126.6173.6178.60000109
234S48.1Very low41.5Very low107 Ų107129.8 Ų129.875%0.74881%0.813SS**PPolyproline II helixtrans-74.7143.4174.2-59.10000111.6
235P51.7Low41.5Very low117 Ų117129.2 Ų129.276%0.7682%0.816SS**PPolyproline II helixtrans-74.8154.1-179.531-35.4000112.9
236P46.8Very low41.4Very low127 Ų127129 Ų12983%0.82581%0.813SS**PPolyproline II helixtrans-81.3146.5178.632.9-34.6000113.1
237N50.1Low41.3Very low159 Ų159127.4 Ų127.485%0.8581%0.813SS**PPolyproline II helixtrans-70.5145.9173.2-86.9-9.9000112.4
238P54.3Low41.3Very low111 Ų111129 Ų12972%0.72181%0.813SS**PPolyproline II helixtrans-75160.3168.632.4-34.7000112.5
239P46.5Very low42.2Very low125 Ų125124.2 Ų124.281%0.81281%0.808SS**PPolyproline II helixtrans-78.1161.7-173.532.3-36.4000114
240A33.7Very low42Very low103 Ų103127 Ų12785%0.85182%0.816SS**PPolyproline II helixtrans-70.6139.6-174.900000113.9
241V36.4Very low41.6Very low145 Ų145128.1 Ų128.188%0.87982%0.815SS**PPolyproline II helixtrans-97.3137.3165.6-73.70000110.6
242V40.4Very low42Very low151 Ų151123.9 Ų123.992%0.91581%0.812SS**PPolyproline II helixtrans-88.6131.6176.5-79.60000111.3
243A33Very low42.4Very low108 Ų108123.3 Ų123.389%0.89381%0.808SS**  trans-152150.5163.700000109.6
244A33.7Very low42.9Very low100 Ų100122.2 Ų122.283%0.82680%0.804SS**  trans-118.8174.7-167.100000113.8
245A34.5Very low42.3Very low107 Ų107126.9 Ų126.988%0.88481%0.814SS**  trans81.7136.4174.500000117.5
246G35.6Very low41.6Very low74 Ų74131.2 Ų131.276%0.76382%0.821SS**  trans-95.6-147.6-179.200000113.5
247P47.9Very low41.3Very low129 Ų129131.7 Ų131.784%0.83882%0.822SS**  cis-123.1-1778.341-25.8000115.6
248I41.8Very low41.1Very low157 Ų157129.8 Ų129.881%0.80582%0.818SS**  trans-89.1158.7-174-51.3159.8000111.8
249P51.6Low40.2Very low113 Ų113135.5 Ų135.573%0.73483%0.827SS**  -142.2136.311832.1-15.6000117.5
250N33.9Very low40.3Very low146 Ų146135.2 Ų135.278%0.78183%0.825SS**  trans60.7105.5144.3-64.9-6.1000125
251N34.5Very low40.5Very low150 Ų150135.8 Ų135.880%0.80282%0.823SS**  53.6158.5117.5-118.93000122.3
252P47Very low40.5Very low109 Ų109134.9 Ų134.971%0.70882%0.823SS**  cis-130.6-173.4-9.440.6-20.7000114.9
253P48.2Very low40.3Very low113 Ų113131.5 Ų131.573%0.73482%0.819SS**  trans-110.2-160.4-17239.9-28.2000114.6
254P51.7Low40.3Very low115 Ų115132.3 Ų132.375%0.74782%0.817SS**  -128.3162.3-70.439.3-24.8000113.8
255Q34.6Very low40.5Very low205 Ų205132.3 Ų132.396%0.95881%0.812SS**  trans-147.2146.2160.2-75.4-159.2-24.900114.5
256F36.8Very low40.2Very low208 Ų208137.3 Ų137.391%0.91281%0.814SS**  trans-114.7143.6178.4-110.3-92.9000109.9
257T40.8Very low40.4Very low138 Ų138139.5 Ų139.585%0.84781%0.813SS**  trans-146.4152.2156.341.80000111.9
258P46.4Very low40.1Very low119 Ų119139.2 Ų139.277%0.77381%0.811SS**  trans-106.2162.9-169.839.4-33000114.8
259Y35.8Very low39.6Very low231 Ų231136.5 Ų136.591%0.90681%0.812SS**PPolyproline II helixtrans-83.4136.5171.7-81.5-90.2000112.7
260P47.6Very low38.7Very low119 Ų119136.2 Ų136.277%0.77382%0.819SS**PPolyproline II helixtrans-93.1147.2163.634.9-30.5000112
261S38.7Very low38.7Very low115 Ų115132.4 Ų132.480%0.80481%0.814SS**PPolyproline II helixtrans-96.2151.8164.376.50000110.5
262S36.3Very low38.7Very low126 Ų126136.6 Ų136.688%0.88182%0.821SS**  trans-152.8126.1164.1-75.50000108.9
263G35.9Very low38.4Very low80 Ų80137.7 Ų137.783%0.82583%0.831SS**  trans-102.3152.2167.800000111
264S32.3Very low37.8Very low124 Ų124135.4 Ų135.487%0.86783%0.827SS**  trans-162140.4150.5-167.30000110.2
265S39.1Very low37.5Very low101 Ų101136.5 Ų136.571%0.70684%0.835SS**  trans-98.4141.7171.735.60000109.9
266F28.1Very low37.8Very low211 Ų211137.2 Ų137.293%0.92583%0.829SS**  trans-168.1139.8142.2-120.9-85.8000110.7
267T39Very low37.8Very low121 Ų121132.9 Ų132.974%0.74282%0.821SS**  trans-101155.4172.355.50000109
268P41.3Very low37.7Very low122 Ų122130.7 Ų130.779%0.79282%0.817SS**  -154.3160.585.138.4-18000118.3
269A32.9Very low37.3Very low100 Ų100135.1 Ų135.183%0.82683%0.825SS**  trans51.294.7143.200000122.6
270A31.4Very low37.7Very low108 Ų108126.8 Ų126.889%0.89381%0.808SS**  -177.5141.412900000107.3
271G33.7Very low37.7Very low66 Ų66126.9 Ų126.968%0.6881%0.809SS**  cis137.668.913.900000109.4
272Y35.8Very low38Very low238 Ų238127.6 Ų127.693%0.93381%0.811SS**  trans-137.2122173.7-84.3-75.7000111.9
273S39.2Very low38Very low131 Ų131126.7 Ų126.792%0.91681%0.805SS**  trans-85.2133.7175.1-58.70000110.8
274G37.6Very low38.3Very low65 Ų65127.7 Ų127.767%0.6780%0.799SS**  trans-152.2132.1169.900000109.9R276G274-R276 PolarHBondContact O-N 3.05Å
275P43.9Very low38.7Very low138 Ų138128.3 Ų128.390%0.89680%0.797SS**PPolyproline II helixtrans-73.6117.3-168.427.6-33.7000112.3
276R41.1Very low38.7Very low221 Ų221128.8 Ų128.883%0.83480%0.796SS**PPolyproline II helixtrans-78.6126.2169.4-173.3179.7-167.7-104.36.1109.1G274 A278G274-R276 PolarHBondContact O-N 3.05Å; R276-A278 PolarHBondContact O-N 3.46Å
277P37.3Very low39.1Very low117 Ų117123 Ų12376%0.7678%0.781SS**PPolyproline II helixtrans-61.3123.6172.2-21.933.5000110.2
278A39Very low39.3Very low91 Ų91123.9 Ų123.975%0.75279%0.789SS**PPolyproline II helixtrans-79.3145.4173.400000110.2R276 G280R276-A278 PolarHBondContact O-N 3.46Å; A278-G280 PolarHBondContact O-N 2.78Å
279F37.1Very low39Very low213 Ų213127.6 Ų127.693%0.93479%0.788SS**  trans-69.495.5166.6-85.2-97.9000109
280G44.7Very low39.7Very low55 Ų55126.9 Ų126.957%0.56778%0.775SS**  trans-80.1165.6164.400000111.7A278A278-G280 PolarHBondContact O-N 2.78Å
281P46.6Very low40.4Very low122 Ų122127.5 Ų127.579%0.79277%0.768SS**  trans-62.4154.8172.829.6-35.2000110.5S283P281-S283 PolarHBondContact O-N 2.92Å
282P44.8Very low41Very low130 Ų130132 Ų13284%0.84477%0.772SS**  trans-62.5112.8-17425.5-34.1000110.6S284P282-S284 PolarHBondContact O-N 2.9Å
283S37.1Very low41.3Very low107 Ų107128.8 Ų128.875%0.74876%0.764SS**  trans-55.8131.1161.135.70000108.2P281 V285P281-S283 PolarHBondContact O-N 2.92Å; S283-V285 PolarHBondContact O-N 3.25Å
284S43.2Very low41.6Very low101 Ų101128.2 Ų128.271%0.70676%0.758SS**  trans-53116.4177.950.40000109.5P282 T286P282-S284 PolarHBondContact O-N 2.9Å; S284-T286 VanDerWaalsContact C-N 3.25Å; S284-T286 PolarHBondContact O-N 3.38Å
285V40.6Very low41.8Very low136 Ų136133.6 Ų133.682%0.82476%0.763SS**  trans-6891.9171.1178.40000106.9S283 C287S283-V285 PolarHBondContact O-N 3.25Å; V285-C287 PolarHBondContact O-N 2.97Å
286T38.9Very low41.9Very low111 Ų111132 Ų13268%0.68175%0.753SS**  trans-61.9106.2174.9-580000108.2S284S284-T286 VanDerWaalsContact C-N 3.25Å; S284-T286 PolarHBondContact O-N 3.38Å
287C36.1Very low42.4Very low91 Ų91125.2 Ų125.262%0.61574%0.744SS**  trans-51.6143.5170.7-61.80000109.6V285 Y289V285-C287 PolarHBondContact O-N 2.97Å; C287-Y289 PolarHBondContact O-N 3.25Å
288P42.2Very low42.7Very low138 Ų138124.4 Ų124.490%0.89674%0.738SS**SBendtrans-77.847.2-179.235.5-37.9000111.8
289Y35.3Very low43.3Very low201 Ų201125.8 Ų125.879%0.78873%0.729SS**SBendtrans-80.6139.6159.7-119.6-91.5000107.7C287 T291C287-Y289 PolarHBondContact O-N 3.25Å; Y289-T291 PolarHBondContact O-N 3.11Å; Y289-T291 VanDerWaalsContact O-N 3.12Å
290P47.2Very low43.6Very low85 Ų85122.3 Ų122.355%0.55273%0.728SS**  trans-55.2122.7170-22.232.9000108.9Q292P290-Q292 PolarHBondContact O-N 3.44Å
291T46.8Very low44.2Very low121 Ų121122.7 Ų122.774%0.74273%0.732SS**  trans-53114.6168-45.70000106.6Y289 H293Y289-T291 PolarHBondContact O-N 3.11Å; Y289-T291 VanDerWaalsContact O-N 3.12Å; T291-H293 PolarHBondContact O-N 2.86Å
292Q47.4Very low44.4Very low161 Ų161117.9 Ų117.975%0.75270%0.701SS**PPolyproline II helixtrans-61117.5176-72.8-162.8-10.900107.3P290P290-Q292 PolarHBondContact O-N 3.44Å
293H40.5Very low45Very low169 Ų169114.6 Ų114.678%0.78269%0.685SS**PPolyproline II helixtrans-54.3131.3164.9-71.5-89.2000106.7T291 F295T291-H293 PolarHBondContact O-N 2.86Å; H293-F295 PolarHBondContact O-N 2.91Å; H293-F295 VanDerWaalsContact O-N 3.15Å
294P46.1Very low45.6Very low120 Ų120116.8 Ų116.878%0.77968%0.682SS**PPolyproline II helixtrans-51.8127.9171.2-23.833.2000108.1
295F42.2Very low45.9Very low178 Ų178113.8 Ų113.878%0.78167%0.666SS**PPolyproline II helixtrans-51.9137.3169.2-78.3-86.9000108.1H293 A297H293-F295 PolarHBondContact O-N 2.91Å; H293-F295 VanDerWaalsContact O-N 3.15Å; F295-A297 PolarHBondContact O-N 3.03Å; F295-A297 VanDerWaalsContact O-N 3.1Å
296P46.2Very low46Very low105 Ų105113.3 Ų113.368%0.68266%0.655SS**PPolyproline II helixtrans-49.8124.5174.4-25.934.1000109
297A50.9Low46Very low78 Ų78118.3 Ų118.365%0.64566%0.663SS**PPolyproline II helixtrans-57.2127178.300000107.9F295 H299F295-A297 PolarHBondContact O-N 3.03Å; F295-A297 VanDerWaalsContact O-N 3.1Å; A297-H299 PolarHBondContact O-N 3.21Å; A297-H299 VanDerWaalsContact O-N 3.08Å; A297-H299 PolarHBondContact O-ND1 3.25Å
298P44.7Very low46.3Very low99 Ų99119 Ų11964%0.64366%0.664SS**PPolyproline II helixtrans-58.7120.1-168.721.1-32.5000109.9
299H49.9Very low46Very low121 Ų121118.6 Ų118.656%0.5666%0.662SS**PPolyproline II helixtrans-62.6137174.5-48.9-39.9000108.3A297 G301 S302A297-H299 PolarHBondContact O-N 3.21Å; A297-H299 VanDerWaalsContact O-N 3.08Å; A297-H299 PolarHBondContact O-ND1 3.25Å; H299-G301 VanDerWaalsContact C-N 3.26Å; H299-G301 PolarHBondContact O-N 2.96Å; H299-S302 PolarHBondContact O-N 3.36Å
300P44.7Very low46.1Very low139 Ų139114.1 Ų114.190%0.90366%0.66SS**THydrogen-bonded Turntrans-66.787.8177.227.6-33.6000109.5
301G56.4Low45.8Very low64 Ų64118.2 Ų118.266%0.6667%0.671SS**THydrogen-bonded Turntrans154.1-23.8-173.400000115.4H299 A303H299-G301 VanDerWaalsContact C-N 3.26Å; H299-G301 PolarHBondContact O-N 2.96Å; G301-A303 PolarHBondContact O-N 2.94Å
302S52.2Low45.3Very low20 Ų20118 Ų11814%0.1467%0.672CS.*  trans-72127.5-178.7175.70000112.3E38 H299 F304E38-S302 WeakPolarHBondContact OE2-CB 3.39Å; E38-S302 PolarHBondContact OE2-OG 3.34Å; H299-S302 PolarHBondContact O-N 3.36Å; S302-F304 VanDerWaalsContact C-N 3.26Å; S302-F304 PolarHBondContact O-N 3.27Å; S302-F304 PolarHBondContact OG-N 3.45Å
303A56.5Low44.9Very low62 Ų62116 Ų11651%0.51267%0.673SS.*THydrogen-bonded Turntrans-70.8-17.6-178.400000113.8I35 G301I35-A303 HydrophobicContact CD1-CB 3.68Å; I35-A303 HydrophobicContact CG1-CB 4.08Å; G301-A303 PolarHBondContact O-N 2.94Å
304F48.8Very low45.1Very low153 Ų153113.3 Ų113.367%0.67168%0.68SS**THydrogen-bonded Turntrans-93.86.2-175.3-89.4-85.2000114.8I35 S302I35-F304 HydrophobicContact CG2-CD2 4.14Å; I35-F304 HydrophobicContact CG2-CE2 3.82Å; S302-F304 VanDerWaalsContact C-N 3.26Å; S302-F304 PolarHBondContact O-N 3.27Å; S302-F304 PolarHBondContact OG-N 3.45Å
305G49.8Very low44.9Very low37 Ų37111.5 Ų111.538%0.38168%0.683SS.*  trans-1303.3-173.500000117.5Y307G305-Y307 VanDerWaalsContact C-N 3.26Å; G305-Y307 PolarHBondContact O-N 2.89Å
306Q43.5Very low45.2Very low126 Ų126106.3 Ų106.359%0.58968%0.68SS**  trans-78.760.7-173.1-69.9-77.9-1.600113.9
307Y39.1Very low45Very low217 Ų217107.7 Ų107.785%0.85169%0.688SS**  trans-101.395.6156.4-82.5-82.9000108.9G305 P309G305-Y307 VanDerWaalsContact C-N 3.26Å; G305-Y307 PolarHBondContact O-N 2.89Å; Y307-P309 WeakPolarHBondContact O-CD 3.49Å
308T41.4Very low44.7Very low104 Ų104108.3 Ų108.364%0.63869%0.694SS**  trans-96.9110168.8440000109.5S310T308-S310 PolarHBondContact O-N 2.95Å
309P36.1Very low44.9Very low130 Ų130109.4 Ų109.484%0.84470%0.701SS**  trans-73.593.6171.8-15.331.8000109.4Y307 H311Y307-P309 WeakPolarHBondContact O-CD 3.49Å; P309-H311 PolarHBondContact O-N 2.7Å
310S38.1Very low44.2Very low107 Ų107114 Ų11475%0.74872%0.715SS**  trans-71.986.7177.540.60000111.8T308T308-S310 PolarHBondContact O-N 2.95Å
311H40.8Very low44.2Very low172 Ų172113 Ų11380%0.79671%0.708SS**  trans63.3142.5171.6-73.7-83.7000117.9P309 P313P309-H311 PolarHBondContact O-N 2.7Å; H311-P313 WeakPolarHBondContact O-CD 3.32Å
312P36.6Very low43.4Very low115 Ų115114.2 Ų114.275%0.74771%0.712SS**PPolyproline II helixtrans-83.4125.5-179.832.1-32.7000112.1
313P38.3Very low42.6Very low121 Ų121118.9 Ų118.979%0.78675%0.745SS**PPolyproline II helixtrans-71.2140.6150.930.8-29.6000108.7H311 G315H311-P313 WeakPolarHBondContact O-CD 3.32Å; P313-G315 PolarHBondContact O-N 3.17Å
314A43.9Very low41.5Very low111 Ų111127 Ų12792%0.91776%0.764SS**SBendtrans-69.2122.1-17600000112.2
315G42.7Very low40.8Very low82 Ų82125.8 Ų125.885%0.84577%0.774SS**SBendtrans89.696.7159.700000116.9P313P313-G315 PolarHBondContact O-N 3.17Å
316G48.3Very low39.9Very low69 Ų69135 Ų13571%0.71180%0.799SS**  trans146.8140.4162.900000113.5
317P42.8Very low39.5Very low134 Ų134132.1 Ų132.187%0.8780%0.804SS**PPolyproline II helixtrans-74.8126173.430.2-32.3000110.6
318A45Very low39.7Very low92 Ų92125.3 Ų125.376%0.7680%0.8SS**PPolyproline II helixtrans-72.7135175.200000111
319P48Very low39.3Very low121 Ų121131.2 Ų131.279%0.78681%0.812SS**PPolyproline II helixtrans-75.8143.4173.531.3-33.3000111
320Y35.3Very low39.3Very low218 Ų218130.9 Ų130.986%0.85581%0.812SS**PPolyproline II helixtrans-59.8143.8170.3-73.2-90.7000110.9A322Y320-A322 PolarHBondContact O-N 2.7Å
321P45.1Very low39.3Very low118 Ų118136.1 Ų136.177%0.76682%0.817SS**PPolyproline II helixtrans-62.8136.1173.326.9-33.4000110.4
322A38.8Very low39.3Very low90 Ų90133.8 Ų133.874%0.74482%0.817SS**PPolyproline II helixtrans-63.7151-175.100000112.8Y320 Y324Y320-A322 PolarHBondContact O-N 2.7Å; A322-Y324 PolarHBondContact O-N 3.35Å
323S35.4Very low39.5Very low118 Ų118133 Ų13383%0.82582%0.821SS**PPolyproline II helixtrans-63.1120.6173.138.70000111.3S325S323-S325 PolarHBondContact O-N 3.44Å
324Y34.5Very low39.6Very low233 Ų233131.6 Ų131.691%0.91482%0.819SS**PPolyproline II helixtrans-63.9121166.9-83.9-88.6000109.6A322A322-Y324 PolarHBondContact O-N 3.35Å
325S33.9Very low39.7Very low126 Ų126132 Ų13288%0.88181%0.812SS**  trans-86.9115175.6-165.60000109.7S323S323-S325 PolarHBondContact O-N 3.44Å
326Y29.8Very low39.4Very low230 Ų230132.7 Ų132.790%0.90281%0.81SS**  trans-139.8130.3171-152.4-85.1000109.8
327G35.1Very low38.8Very low67 Ų67140.4 Ų140.469%0.69182%0.819SS**SBendtrans71.390.7165.400000116.4
328G44.4Very low38.4Very low74 Ų74139.8 Ų139.876%0.76382%0.819SS**  trans-59.4143.2-176.100000117.4
329Y32.8Very low37.8Very low228 Ų228140.8 Ų140.889%0.89482%0.82SS**  trans-130.8114.5148.7-90.4-83.7000108.7
330S35.5Very low37.2Very low122 Ų122140.5 Ų140.585%0.85382%0.821SS**  trans-89.7115179.5-56.10000110.5
331Y37.5Very low37.3Very low218 Ų218138.8 Ų138.886%0.85582%0.82SS**PPolyproline II helixtrans-80.6137.2161.3-92.8-92.7000109.8A333Y331-A333 PolarHBondContact O-N 3.09Å
332P41.4Very low36.9Very low123 Ų123138.1 Ų138.180%0.79982%0.819SS**PPolyproline II helixtrans-70.4123.4-179.527.8-33.4000111
333A40.2Very low37.1Very low99 Ų99139.8 Ų139.882%0.81882%0.822SS**PPolyproline II helixtrans-72.5131172.500000110.7Y331Y331-A333 PolarHBondContact O-N 3.09Å
334A41.4Very low37.5Very low91 Ų91141.5 Ų141.575%0.75283%0.828SS**PPolyproline II helixtrans-69.1150.516800000110.6
335P45.5Very low37.5Very low118 Ų118133.8 Ų133.877%0.76682%0.819SS**PPolyproline II helixtrans-69147.4-175.928.3-35000112.5
336A36.5Very low38.1Very low98 Ų98137.6 Ų137.681%0.8182%0.82SS**PPolyproline II helixtrans-71.2135.2179.800000112.2
337Y37Very low38.8Very low230 Ų230132.8 Ų132.890%0.90282%0.816SS**PPolyproline II helixtrans-76.5124.4165.7-71.7-86.8000109.8S339Y337-S339 PolarHBondContact O-N 2.76Å
338S34Very low39Very low122 Ų122138.7 Ų138.785%0.85383%0.828SS**PPolyproline II helixtrans-71122.7173.6-65.70000111.6S340S338-S340 PolarHBondContact O-N 2.77Å
339S31.7Very low38.8Very low113 Ų113146.4 Ų146.479%0.7984%0.836SS**  trans-68.8111.7167.5-65.80000111Y337 Q341Y337-S339 PolarHBondContact O-N 2.76Å; S339-Q341 PolarHBondContact O-N 2.76Å; S339-Q341 VanDerWaalsContact O-N 3.16Å
340S34.9Very low38.9Very low115 Ų115147.6 Ų147.680%0.80484%0.839SS**  trans-74.496.8170172.80000110.7S338S338-S340 PolarHBondContact O-N 2.77Å
341Q37.1Very low39Very low181 Ų181146.4 Ų146.485%0.84684%0.836SS**PPolyproline II helixtrans-82.6120.9163.2-69.8-170.527.700110.2S339S339-Q341 PolarHBondContact O-N 2.76Å; S339-Q341 VanDerWaalsContact O-N 3.16Å
342S36.4Very low38.9Very low105 Ų105139.6 Ų139.673%0.73483%0.833SS**PPolyproline II helixtrans-78.2130.8174.2-52.30000111.2
343P44.5Very low39Very low125 Ų125145.2 Ų145.281%0.81284%0.84SS**PPolyproline II helixtrans-83.3140.6173.532.4-33000112.2G345P343-G345 PolarHBondContact O-N 3.45Å
344T42.9Very low39Very low154 Ų154144 Ų14495%0.94584%0.838SS**  trans-75.7112.2-178.5-18.10000111.9
345G34.8Very low39.3Very low70 Ų70145.7 Ų145.772%0.72284%0.838SS**  trans-106.7132.9176.400000113.2P343P343-G345 PolarHBondContact O-N 3.45Å
346K46.9Very low39.5Very low207 Ų207145.7 Ų145.790%0.984%0.838SS**PPolyproline II helixtrans-77.2140.6177.1-59.3174-179176.70111.2
347P43.9Very low40Very low128 Ų128149.5 Ų149.583%0.83184%0.839SS**PPolyproline II helixtrans-83130.2171.131.7-31.6000112.1
348M40.1Very low41Very low191 Ų191143.2 Ų143.294%0.94183%0.826SS**PPolyproline II helixtrans-84.3147.6161.5-95.9-168.4166.300110.6
349Y39.4Very low41.4Very low236 Ų236148 Ų14893%0.92583%0.827SS**PPolyproline II helixtrans-69.2135.5168-91.7-104.9000112.1
350R34.3Very low42.4Very low253 Ų253151.9 Ų151.996%0.95586%0.855SS**  -162.1160.2120.9-138.9168.9-170.8-138.9-1113.3
351A37.6Very low42.8Very low97 Ų97153.8 Ų153.880%0.80286%0.857SS**  trans-89.4161-16800000115.2
352G36.2Very low43.1Very low76 Ų76152.3 Ų152.378%0.78486%0.858SS**  trans-168.2113.1164.500000110.8
353Y44.3Very low43.4Very low240 Ų240154.9 Ų154.994%0.94187%0.865SS**  trans-73.1142175.1-89.4-110.8000110.9
354G39.7Very low43.4Very low75 Ų75156.7 Ų156.777%0.77387%0.868SS**  trans-159.3106.8171.900000111.2
355V47Very low43.4Very low125 Ų125156.9 Ų156.976%0.75886%0.863SS**PPolyproline II helixtrans-83.7137.4-178.8177.40000110.2
356P49.8Very low44Very low119 Ų119162.7 Ų162.777%0.77387%0.872SS**PPolyproline II helixtrans-80.4131.4169.631.9-32000111.5
357Q46.6Very low43.8Very low178 Ų178159.5 Ų159.583%0.83287%0.87SS**PPolyproline II helixtrans-103.9146.2167.6-90.8-85.6-29.400109.9
358P59.4Low43.8Very low98 Ų98161.9 Ų161.964%0.63687%0.873SS**PPolyproline II helixtrans-97.5156.1-171.937.2-34.4000114.8
359Y43Very low44.1Very low222 Ų222159.5 Ų159.587%0.87187%0.868SS**  trans36.5120.5153.1-78-84.4000121.6
360S51.6Low44.5Very low195 Ų195152.5 Ų152.5100%1.36486%0.862SS**  -1490122-72.50000109.3

Retrieved 360 of 360 residues in 229.5 ms (Link to these results)

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