A0A060XAQ2_ONCMY Loading...

Leucine rich adaptor protein 1 like

AlphaFold DB , UniProt , Accession A0A060XAQ2, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110531734, Length 202 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M48.9Very low69.8Low214 Ų214107.8 Ų107.8100%1.05454%0.537SS*.  035.30-88.1-85.8-16700108.9
2D55.5Low71.6Confident117 Ų117104.7 Ų104.763%0.62652%0.523SS*.  trans-105.2-13.6-157.5-47.3-66.9000113V6D2-V6 WeakPolarHBondContact O-CG2 3.49Å
3G58Low73.1Confident49 Ų49102 Ų10251%0.50551%0.51SS..Hα-helixtrans-73.9-27.7-17900000114.6L7G3-L7 WeakPolarHBondContact O-CG 3.05Å; G3-L7 PolarHBondContact O-N 2.89Å
4E60.1Low74.5Confident119 Ų11997.1 Ų97.156%0.55649%0.485SS*.Hα-helixtrans-74.5-33.7179.9-161.7-174.9156.200111.7R8E4-R8 WeakPolarHBondContact O-CG 3.26Å; E4-R8 PolarHBondContact O-N 3.34Å; E4-R8 VanDerWaalsContact O-N 3.12Å; E4-R8 IonicContact OE1-CZ 3.53Å; E4-R8 IonicContact OE1-NE 2.92Å; E4-R8 IonicContact OE1-NH2 3.65Å; E4-R8 PolarHBondContact OE1-NH2 3.44Å
5H65.2Low75.8Confident125 Ų12597.5 Ų97.558%0.57950%0.495SS*.Hα-helixtrans-67.1-47.3177.9-158.3-74.8000111L7 R8 D9H5-L7 VanDerWaalsContact C-N 3.31Å; H5-L7 PolarHBondContact O-N 3.28Å; H5-R8 PolarHBondContact O-N 3.5Å; H5-R8 VanDerWaalsContact O-N 3.15Å; H5-D9 IonicContact CE1-OD1 3.91Å; H5-D9 IonicContact CE1-OD2 2.76Å; H5-D9 PolarHBondContact CE1-OD2 3.03Å; H5-D9 IonicContact ND1-OD1 2.69Å; H5-D9 IonicContact ND1-OD2 3.62Å; H5-D9 PolarHBondContact ND1-OD2 3.3Å; H5-D9 PolarHBondContact O-N 3.14Å
6V69.5Low77Confident42 Ų42100.8 Ų100.826%0.25551%0.505SS..Hα-helixtrans-60.6-38.7178.7173.60000112.1D2 D9 F10 L29D2-V6 WeakPolarHBondContact O-CG2 3.49Å; V6-D9 PolarHBondContact O-N 3.02Å; V6-F10 HydrophobicContact CG1-CD2 3.77Å; V6-F10 HydrophobicContact CG1-CE2 3.34Å; V6-F10 HydrophobicContact CG1-CZ 4.23Å; V6-F10 WeakPolarHBondContact O-CD2 3.44Å; V6-F10 PolarHBondContact O-N 3.14Å; V6-L29 HydrophobicContact CG1-CD2 3.67Å; V6-L29 HydrophobicContact CG1-CG 4.23Å
7L71.8Confident77.9Confident105 Ų105101.4 Ų101.455%0.5551%0.509SS..Hα-helixtrans-70.5-35.6176.8-74.4175.2000113.1G3 H5 K11 I26G3-L7 WeakPolarHBondContact O-CG 3.05Å; G3-L7 PolarHBondContact O-N 2.89Å; H5-L7 VanDerWaalsContact C-N 3.31Å; H5-L7 PolarHBondContact O-N 3.28Å; L7-K11 PolarHBondContact O-N 3.43Å; L7-I26 HydrophobicContact CD2-CG2 4.04Å
8R76.4Confident78.8Confident171 Ų17199.6 Ų99.665%0.64552%0.521SS*.Hα-helixtrans-66-40.9171.9-75.6-174-171.7-165.86.4111.4E4 H5 K11 D12E4-R8 WeakPolarHBondContact O-CG 3.26Å; E4-R8 PolarHBondContact O-N 3.34Å; E4-R8 VanDerWaalsContact O-N 3.12Å; E4-R8 IonicContact OE1-CZ 3.53Å; E4-R8 IonicContact OE1-NE 2.92Å; E4-R8 IonicContact OE1-NH2 3.65Å; E4-R8 PolarHBondContact OE1-NH2 3.44Å; H5-R8 PolarHBondContact O-N 3.5Å; H5-R8 VanDerWaalsContact O-N 3.15Å; R8-K11 PolarHBondContact O-N 3.35Å; R8-D12 PolarHBondContact O-N 3.34Å; R8-D12 VanDerWaalsContact O-N 3.11Å
9D82.3Confident79.6Confident72 Ų72104.5 Ų104.539%0.38553%0.531SS..Hα-helixtrans-63.3-43.7179.2-65.3-25000111.5H5 V6 K11 D12 I13H5-D9 IonicContact CE1-OD1 3.91Å; H5-D9 IonicContact CE1-OD2 2.76Å; H5-D9 PolarHBondContact CE1-OD2 3.03Å; H5-D9 IonicContact ND1-OD1 2.69Å; H5-D9 IonicContact ND1-OD2 3.62Å; H5-D9 PolarHBondContact ND1-OD2 3.3Å; H5-D9 PolarHBondContact O-N 3.14Å; V6-D9 PolarHBondContact O-N 3.02Å; D9-K11 VanDerWaalsContact C-N 3.33Å; D9-K11 PolarHBondContact O-N 3.26Å; D9-D12 PolarHBondContact O-N 2.91Å; D9-I13 WeakPolarHBondContact O-CD1 3.21Å; D9-I13 VanDerWaalsContact O-CG1 3.26Å; D9-I13 WeakPolarHBondContact O-CG1 3.17Å; D9-I13 PolarHBondContact O-N 3.46Å; D9-I13 VanDerWaalsContact O-N 3.08Å
10F90.2Very high80.3Confident22 Ų22107.4 Ų107.410%0.09654%0.54CS..Hα-helixtrans-63.4-38.3175.5-74.1-52.5000112.9V6 D12 I13 E14 V21 I26 L29V6-F10 HydrophobicContact CG1-CD2 3.77Å; V6-F10 HydrophobicContact CG1-CE2 3.34Å; V6-F10 HydrophobicContact CG1-CZ 4.23Å; V6-F10 WeakPolarHBondContact O-CD2 3.44Å; V6-F10 PolarHBondContact O-N 3.14Å; F10-D12 PolarHBondContact O-N 3.39Å; F10-I13 HydrophobicContact CD1-CD1 4.43Å; F10-I13 PolarHBondContact O-N 3.07Å; F10-E14 WeakPolarHBondContact O-CG 3.29Å; F10-E14 PolarHBondContact O-N 3.45Å; F10-V21 HydrophobicContact CB-CG2 4.48Å; F10-V21 HydrophobicContact CD1-CB 4.39Å; F10-V21 HydrophobicContact CD1-CG1 3.82Å; F10-V21 HydrophobicContact CD1-CG2 4.04Å; F10-V21 HydrophobicContact CE1-CG1 4.04Å; F10-V21 HydrophobicContact CG-CG1 4.44Å; F10-I26 HydrophobicContact CD2-CG1 4.1Å; F10-I26 HydrophobicContact CD2-CG2 4.35Å; F10-I26 HydrophobicContact CE2-CB 4.41Å; F10-I26 HydrophobicContact CE2-CG1 4.2Å; F10-I26 HydrophobicContact CE2-CG2 4.35Å; F10-I26 HydrophobicContact CG-CG1 4.42Å; F10-L29 HydrophobicContact CE2-CD2 3.87Å; F10-L29 HydrophobicContact CZ-CB 4.34Å; F10-L29 HydrophobicContact CZ-CD2 3.5Å; F10-L29 VanDerWaalsContact CZ-CD2 3.5Å
11K89.6Confident80.8Confident150 Ų150103 Ų10365%0.65252%0.519SS*.Hα-helixtrans-64-40.5177.9-168.5173.4-179.3179.80112.1L7 R8 D9 E14 T15L7-K11 PolarHBondContact O-N 3.43Å; R8-K11 PolarHBondContact O-N 3.35Å; D9-K11 VanDerWaalsContact C-N 3.33Å; D9-K11 PolarHBondContact O-N 3.26Å; K11-E14 PolarHBondContact O-N 3.05Å; K11-T15 WeakPolarHBondContact O-CG2 3.42Å; K11-T15 PolarHBondContact O-N 3.34Å; K11-T15 PolarHBondContact O-OG1 3.24Å
12D92.1Very high82.9Confident70 Ų7096.5 Ų96.537%0.37449%0.493SS..Hα-helixtrans-63.1-45.5174.5-178.545.5000111.3R8 D9 F10 E14 T15 K16R8-D12 PolarHBondContact O-N 3.34Å; R8-D12 VanDerWaalsContact O-N 3.11Å; D9-D12 PolarHBondContact O-N 2.91Å; F10-D12 PolarHBondContact O-N 3.39Å; D12-E14 VanDerWaalsContact C-N 3.34Å; D12-E14 PolarHBondContact O-N 3.47Å; D12-T15 PolarHBondContact O-N 2.93Å; D12-T15 VanDerWaalsContact O-N 3.14Å; D12-T15 PolarHBondContact O-OG1 3.37Å; D12-K16 PolarHBondContact O-N 3.31Å; D12-K16 VanDerWaalsContact OD1-CE 3.3Å; D12-K16 WeakPolarHBondContact OD1-CE 3.31Å; D12-K16 IonicContact OD1-NZ 3.56Å; D12-K16 VanDerWaalsContact OD2-CE 3.27Å; D12-K16 WeakPolarHBondContact OD2-CE 3.37Å; D12-K16 IonicContact OD2-NZ 3.44Å; D12-K16 PolarHBondContact OD2-NZ 3.27Å
13I90.3Very high84.4Confident70 Ų7097.9 Ų97.936%0.35950%0.495SS..Hα-helixtrans-59.8-42.6177.6-66.2163.7000111.6D9 F10 T15 K16 L17 V21D9-I13 WeakPolarHBondContact O-CD1 3.21Å; D9-I13 VanDerWaalsContact O-CG1 3.26Å; D9-I13 WeakPolarHBondContact O-CG1 3.17Å; D9-I13 PolarHBondContact O-N 3.46Å; D9-I13 VanDerWaalsContact O-N 3.08Å; F10-I13 HydrophobicContact CD1-CD1 4.43Å; F10-I13 PolarHBondContact O-N 3.07Å; I13-T15 VanDerWaalsContact C-N 3.31Å; I13-T15 PolarHBondContact O-N 3.44Å; I13-K16 PolarHBondContact O-N 3.13Å; I13-L17 HydrophobicContact CG2-CD1 3.7Å; I13-L17 HydrophobicContact CG2-CG 4.23Å; I13-L17 WeakPolarHBondContact O-CB 3.37Å; I13-L17 WeakPolarHBondContact O-CG 3.36Å; I13-L17 PolarHBondContact O-N 3.48Å; I13-V21 HydrophobicContact CG2-CG2 4.37Å
14E93.4Very high85.7Confident34 Ų3499.7 Ų99.716%0.15950%0.5CS..Hα-helixtrans-59.2-43.1175.7-72.3-178.4-178.400112.1F10 K11 D12 G18 R19 K20 V21F10-E14 WeakPolarHBondContact O-CG 3.29Å; F10-E14 PolarHBondContact O-N 3.45Å; K11-E14 PolarHBondContact O-N 3.05Å; D12-E14 VanDerWaalsContact C-N 3.34Å; D12-E14 PolarHBondContact O-N 3.47Å; E14-G18 WeakPolarHBondContact O-CA 3.41Å; E14-G18 PolarHBondContact O-N 3.38Å; E14-R19 WeakPolarHBondContact CA-O 2.7Å; E14-R19 PolarHBondContact O-N 3.33Å; E14-K20 VanDerWaalsContact CD-CD 3.5Å; E14-K20 WeakPolarHBondContact OE1-CD 3.5Å; E14-K20 IonicContact OE1-NZ 2.83Å; E14-K20 WeakPolarHBondContact OE2-CD 3.46Å; E14-K20 IonicContact OE2-NZ 3.58Å; E14-K20 PolarHBondContact OE2-NZ 3.27Å; E14-V21 HydrophobicContact CG-CB 4.21Å; E14-V21 HydrophobicContact CG-CG2 3.66Å; E14-V21 PolarHBondContact OE1-N 3.41Å; E14-V21 VanDerWaalsContact OE1-N 3.08Å
15T94.4Very high86.9Confident102 Ų10298.5 Ų98.563%0.62650%0.497SS*.Hα-helixtrans-69.1-37.8178.4590000112.6K11 D12 I13K11-T15 WeakPolarHBondContact O-CG2 3.42Å; K11-T15 PolarHBondContact O-N 3.34Å; K11-T15 PolarHBondContact O-OG1 3.24Å; D12-T15 PolarHBondContact O-N 2.93Å; D12-T15 VanDerWaalsContact O-N 3.14Å; D12-T15 PolarHBondContact O-OG1 3.37Å; I13-T15 VanDerWaalsContact C-N 3.31Å; I13-T15 PolarHBondContact O-N 3.44Å
16K95.1Very high88Confident150 Ų15094.4 Ų94.465%0.65248%0.479SS*.Hα-helixtrans-70.9-36.3178.8-77174.8175.1166.50113.1D12 I13D12-K16 PolarHBondContact O-N 3.31Å; D12-K16 VanDerWaalsContact OD1-CE 3.3Å; D12-K16 WeakPolarHBondContact OD1-CE 3.31Å; D12-K16 IonicContact OD1-NZ 3.56Å; D12-K16 VanDerWaalsContact OD2-CE 3.27Å; D12-K16 WeakPolarHBondContact OD2-CE 3.37Å; D12-K16 IonicContact OD2-NZ 3.44Å; D12-K16 PolarHBondContact OD2-NZ 3.27Å; I13-K16 PolarHBondContact O-N 3.13Å
17L92.3Very high88.7Confident112 Ų112100.9 Ų100.959%0.58650%0.499SS*.Hα-helixtrans-97.1-7.8-176.4-59.3-175.7000113.4I13 R19I13-L17 HydrophobicContact CG2-CD1 3.7Å; I13-L17 HydrophobicContact CG2-CG 4.23Å; I13-L17 WeakPolarHBondContact O-CB 3.37Å; I13-L17 WeakPolarHBondContact O-CG 3.36Å; I13-L17 PolarHBondContact O-N 3.48Å; L17-R19 PolarHBondContact O-N 2.94Å
18G94Very high89.2Confident69 Ų69100.2 Ų100.271%0.71150%0.503SS*.THydrogen-bonded Turntrans62.120.4-17800000113.8E14E14-G18 WeakPolarHBondContact O-CA 3.41Å; E14-G18 PolarHBondContact O-N 3.38Å
19R93.1Very high89.3Confident192 Ų19297 Ų9773%0.72550%0.498SS*.SBendtrans-137.5141.3-177.1-69.6-168.8-69.2-141.3-0.4110.6E14 L17E14-R19 WeakPolarHBondContact CA-O 2.7Å; E14-R19 PolarHBondContact O-N 3.33Å; L17-R19 PolarHBondContact O-N 2.94Å
20K94.3Very high89.2Confident162 Ų16296.6 Ų96.670%0.70451%0.505SS*.PPolyproline II helixtrans-68.1136.5179.5-175.964.178.7-165.10110.4E14E14-K20 VanDerWaalsContact CD-CD 3.5Å; E14-K20 WeakPolarHBondContact OE1-CD 3.5Å; E14-K20 IonicContact OE1-NZ 2.83Å; E14-K20 WeakPolarHBondContact OE2-CD 3.46Å; E14-K20 IonicContact OE2-NZ 3.58Å; E14-K20 PolarHBondContact OE2-NZ 3.27Å
21V91.3Very high87.8Confident15 Ų1597.8 Ų97.89%0.09152%0.524CS..PPolyproline II helixtrans-74.5129.4173.6175.50000108.2F10 I13 E14 E23 L25 I26F10-V21 HydrophobicContact CB-CG2 4.48Å; F10-V21 HydrophobicContact CD1-CB 4.39Å; F10-V21 HydrophobicContact CD1-CG1 3.82Å; F10-V21 HydrophobicContact CD1-CG2 4.04Å; F10-V21 HydrophobicContact CE1-CG1 4.04Å; F10-V21 HydrophobicContact CG-CG1 4.44Å; I13-V21 HydrophobicContact CG2-CG2 4.37Å; E14-V21 HydrophobicContact CG-CB 4.21Å; E14-V21 HydrophobicContact CG-CG2 3.66Å; E14-V21 PolarHBondContact OE1-N 3.41Å; E14-V21 VanDerWaalsContact OE1-N 3.08Å; V21-E23 PolarHBondContact O-N 2.86Å; V21-L25 HydrophobicContact CG1-CB 4.41Å; V21-L25 HydrophobicContact CG1-CD2 4.08Å; V21-I26 HydrophobicContact CB-CD1 4.34Å; V21-I26 HydrophobicContact CB-CG1 4.43Å; V21-I26 HydrophobicContact CG1-CD1 4.23Å; V21-I26 HydrophobicContact CG1-CG1 3.79Å
22P91.8Very high86.3Confident78 Ų7893.5 Ų93.551%0.50652%0.522SS..PPolyproline II helixtrans-58.3133.1178.5-25.234.1000112.2S24 L25 I26P22-S24 PolarHBondContact O-N 3.16Å; P22-S24 VanDerWaalsContact O-N 3.15Å; P22-L25 WeakPolarHBondContact O-CB 3.5Å; P22-L25 PolarHBondContact O-N 3.49Å; P22-I26 PolarHBondContact O-N 3.43Å
23E86.5Confident84.6Confident146 Ų14696.7 Ų96.768%0.68254%0.539SS*.Hα-helixtrans-60.4-28.6-179-64.5-174.5179.900113.1V21 L25 I26 R27V21-E23 PolarHBondContact O-N 2.86Å; E23-L25 VanDerWaalsContact C-N 3.26Å; E23-L25 PolarHBondContact O-N 2.89Å; E23-I26 PolarHBondContact O-N 2.88Å; E23-R27 VanDerWaalsContact O-CB 3.25Å; E23-R27 WeakPolarHBondContact O-CB 3.41Å; E23-R27 PolarHBondContact O-N 3.14Å
24S85.4Confident82.7Confident88 Ų88100.1 Ų100.162%0.61556%0.558SS**Hα-helixtrans-60.5-37.2174.454.60000111.9P22 S28P22-S24 PolarHBondContact O-N 3.16Å; P22-S24 VanDerWaalsContact O-N 3.15Å; S24-S28 VanDerWaalsContact O-CB 3.22Å; S24-S28 WeakPolarHBondContact O-CB 3.44Å; S24-S28 PolarHBondContact O-N 2.75Å
25L87Confident80.9Confident93 Ų93107.7 Ų107.749%0.48759%0.593SS.*Hα-helixtrans-73.4-44.1178.1-174.163000111.2V21 P22 E23 R27 S28 L29V21-L25 HydrophobicContact CG1-CB 4.41Å; V21-L25 HydrophobicContact CG1-CD2 4.08Å; P22-L25 WeakPolarHBondContact O-CB 3.5Å; P22-L25 PolarHBondContact O-N 3.49Å; E23-L25 VanDerWaalsContact C-N 3.26Å; E23-L25 PolarHBondContact O-N 2.89Å; L25-R27 VanDerWaalsContact C-N 3.31Å; L25-R27 PolarHBondContact O-N 2.95Å; L25-S28 PolarHBondContact O-N 3.08Å; L25-L29 PolarHBondContact O-N 3.18Å
26I87.4Confident78.6Confident39 Ų39110.7 Ų110.720%0.260%0.599CS.*Hα-helixtrans-58.5-47.2176.1-57.2173.9000109.6L7 F10 V21 P22 E23 L29 A30L7-I26 HydrophobicContact CD2-CG2 4.04Å; F10-I26 HydrophobicContact CD2-CG1 4.1Å; F10-I26 HydrophobicContact CD2-CG2 4.35Å; F10-I26 HydrophobicContact CE2-CB 4.41Å; F10-I26 HydrophobicContact CE2-CG1 4.2Å; F10-I26 HydrophobicContact CE2-CG2 4.35Å; F10-I26 HydrophobicContact CG-CG1 4.42Å; V21-I26 HydrophobicContact CB-CD1 4.34Å; V21-I26 HydrophobicContact CB-CG1 4.43Å; V21-I26 HydrophobicContact CG1-CD1 4.23Å; V21-I26 HydrophobicContact CG1-CG1 3.79Å; P22-I26 PolarHBondContact O-N 3.43Å; E23-I26 PolarHBondContact O-N 2.88Å; I26-L29 PolarHBondContact O-N 3.29Å; I26-A30 WeakPolarHBondContact O-CB 3.27Å; I26-A30 PolarHBondContact O-N 3.06Å
27R83.7Confident76.2Confident179 Ų179109 Ų10968%0.67560%0.598SS**Hα-helixtrans-64.3-41.3177.9-172.4-172-55.4-102.6-1.9112.4E23 L25 L29 G31E23-R27 VanDerWaalsContact O-CB 3.25Å; E23-R27 WeakPolarHBondContact O-CB 3.41Å; E23-R27 PolarHBondContact O-N 3.14Å; L25-R27 VanDerWaalsContact C-N 3.31Å; L25-R27 PolarHBondContact O-N 2.95Å; R27-L29 VanDerWaalsContact C-N 3.35Å; R27-G31 WeakPolarHBondContact O-CA 3.3Å; R27-G31 PolarHBondContact O-N 3.41Å
28S81.9Confident74.1Confident90 Ų90112 Ų11263%0.62961%0.606SS**Hα-helixtrans-61.5-44178.4-173.50000111.5S24 L25S24-S28 VanDerWaalsContact O-CB 3.22Å; S24-S28 WeakPolarHBondContact O-CB 3.44Å; S24-S28 PolarHBondContact O-N 2.75Å; L25-S28 PolarHBondContact O-N 3.08Å
29L79.8Confident71.6Confident104 Ų104117.8 Ų117.855%0.54561%0.614SS.*Hα-helixtrans-76.5-39.6179.7-170.463.9000112.5V6 F10 L25 I26 R27 G31V6-L29 HydrophobicContact CG1-CD2 3.67Å; V6-L29 HydrophobicContact CG1-CG 4.23Å; F10-L29 HydrophobicContact CE2-CD2 3.87Å; F10-L29 HydrophobicContact CZ-CB 4.34Å; F10-L29 HydrophobicContact CZ-CD2 3.5Å; F10-L29 VanDerWaalsContact CZ-CD2 3.5Å; L25-L29 PolarHBondContact O-N 3.18Å; I26-L29 PolarHBondContact O-N 3.29Å; R27-L29 VanDerWaalsContact C-N 3.35Å; L29-G31 VanDerWaalsContact C-N 3.34Å
30A78.7Confident69.6Low63 Ų63116.2 Ų116.252%0.52162%0.615SS.*Hα-helixtrans-70.8-29.1177.900000113I26 G32I26-A30 WeakPolarHBondContact O-CB 3.27Å; I26-A30 PolarHBondContact O-N 3.06Å; A30-G32 VanDerWaalsContact C-N 3.33Å
31G61.7Low67.5Low48 Ų48115.3 Ų115.350%0.49562%0.618SS.*G310 helixtrans-81.4-3.9-179.100000115.2R27 L29 N33R27-G31 WeakPolarHBondContact O-CA 3.3Å; R27-G31 PolarHBondContact O-N 3.41Å; L29-G31 VanDerWaalsContact C-N 3.34Å; G31-N33 PolarHBondContact O-N 3.49Å
32G58.4Low65.3Low60 Ų60121.1 Ų121.162%0.61965%0.653SS**G310 helixtrans-68.6-12.5-177.200000116A30A30-G32 VanDerWaalsContact C-N 3.33Å
33N56.6Low63.1Low136 Ų136126.9 Ų126.973%0.72767%0.671SS**G310 helixtrans-118.89.6-172.1-89.535.8000116G31G31-N33 PolarHBondContact O-N 3.49Å
34N49.3Very low61.4Low142 Ų142127.9 Ų127.976%0.75968%0.68SS**  trans-108.575.4-177.8-68.4-11.4000112.4
35H56.3Low59.8Low193 Ų193128 Ų12889%0.89469%0.686SS**  trans-111.490.6151.9-118.8-60.9000108
36H46.8Very low58.5Low165 Ų165129.6 Ų129.676%0.76470%0.7SS**  trans-159.5110.2153.4-149-86000112.3
37D44.4Very low57.1Low116 Ų116133 Ų13362%0.6273%0.725SS**  trans69.8123.4146.2-81.9-0.1000125.6
38K47.8Very low55.8Low175 Ų175132.7 Ų132.776%0.76173%0.728SS**  trans87.694.2142.8-67.9178-174.2-162.70118.1
39H42.2Very low54.6Low190 Ų190134.7 Ų134.788%0.8873%0.732SS**  -158.6147.3109.6-115.8-89000111.5
40E49.4Very low53.7Low159 Ų159138.1 Ų138.174%0.74375%0.745SS**  trans-65.6153-161.6-62.6-89.8115.400116.5
41D51.3Low52.9Low142 Ų142137.8 Ų137.876%0.75974%0.739SS**  trans50.193.7152-71.7-21.1000119.7
42T44.4Very low53.7Low137 Ų137139.6 Ų139.684%0.8474%0.737SS**  trans-160105.6132-690000110.3
43K45.3Very low55Low199 Ų199139.5 Ų139.587%0.86573%0.727SS**  trans30.497.6151.5-60.6-176-177.6-1770117.1A45K43-A45 PolarHBondContact O-N 3.28Å
44L52.5Low56.8Low168 Ų168135.9 Ų135.988%0.8872%0.716SS**  trans-49.8114161.4-84.6112.4000111.9
45A50.3Low58.8Low89 Ų89132.7 Ų132.774%0.73670%0.699SS**  trans-137.178.815200000108.2K43 P47K43-A45 PolarHBondContact O-N 3.28Å; A45-P47 VanDerWaalsContact C-CD 3.44Å; A45-P47 WeakPolarHBondContact O-CD 3.41Å
46T60.6Low60.7Low127 Ų127129 Ų12978%0.77969%0.685SS**  trans-10297.7162.836.60000110.1
47P57.3Low63Low112 Ų112127.4 Ų127.473%0.72768%0.676SS**  trans-129.687.2156.535.9-19.5000109.7A45A45-P47 VanDerWaalsContact C-CD 3.44Å; A45-P47 WeakPolarHBondContact O-CD 3.41Å
48K56.1Low65.5Low171 Ų171128.9 Ų128.974%0.74367%0.673SS**  trans-163.534.4166-126.6171-176.5178.10117.4N52K48-N52 PolarHBondContact O-ND2 2.89Å
49N58.2Low67.8Low133 Ų133125.1 Ų125.171%0.71166%0.661SS**SBendtrans-105.3-10.5173.4-77.6-23.9000114.5S53N49-S53 PolarHBondContact O-N 3.47Å
50Q60.3Low70.5Confident176 Ų176121.9 Ų121.982%0.82265%0.646SS**Hα-helixtrans-72.8-38.9179.9-71.2-178.8-3.700112.9N52 S53 A54Q50-N52 VanDerWaalsContact C-N 3.34Å; Q50-N52 PolarHBondContact O-N 3.46Å; Q50-S53 PolarHBondContact O-N 3.42Å; Q50-A54 PolarHBondContact O-N 3.49Å; Q50-A54 VanDerWaalsContact O-N 3.09Å
51S62.1Low72.8Confident56 Ų56118 Ų11839%0.39264%0.636SS.*Hα-helixtrans-61.3-43.6177.5550000111.6S53 A54 D55S51-S53 VanDerWaalsContact C-N 3.3Å; S51-S53 PolarHBondContact O-N 3.32Å; S51-A54 PolarHBondContact O-N 2.99Å; S51-D55 PolarHBondContact O-N 2.99Å
52N79.1Confident75Confident86 Ų86117.6 Ų117.646%0.4663%0.628SS.*Hα-helixtrans-65.1-35.7178.6-58.8-26.8000111.4K48 Q50 L56K48-N52 PolarHBondContact O-ND2 2.89Å; Q50-N52 VanDerWaalsContact C-N 3.34Å; Q50-N52 PolarHBondContact O-N 3.46Å; N52-L56 WeakPolarHBondContact O-CB 3.27Å; N52-L56 WeakPolarHBondContact O-CG 3.33Å; N52-L56 PolarHBondContact O-N 3.28Å
53S85.3Confident77.6Confident57 Ų57115.5 Ų115.540%0.39961%0.609SS.*Hα-helixtrans-67.6-41.9176.3-177.40000112.3N49 Q50 S51 L56 K57N49-S53 PolarHBondContact O-N 3.47Å; Q50-S53 PolarHBondContact O-N 3.42Å; S51-S53 VanDerWaalsContact C-N 3.3Å; S51-S53 PolarHBondContact O-N 3.32Å; S53-L56 PolarHBondContact O-N 2.92Å; S53-K57 WeakPolarHBondContact O-CG 3.46Å; S53-K57 PolarHBondContact O-N 3.11Å
54A93Very high80.2Confident61 Ų61110.8 Ų110.850%0.50459%0.593SS.*Hα-helixtrans-65.7-40.7176.300000112.1Q50 S51 K57 R58Q50-A54 PolarHBondContact O-N 3.49Å; Q50-A54 VanDerWaalsContact O-N 3.09Å; S51-A54 PolarHBondContact O-N 2.99Å; A54-K57 PolarHBondContact O-N 2.69Å; A54-R58 WeakPolarHBondContact O-CB 3.48Å; A54-R58 PolarHBondContact O-N 2.96Å
55D92.9Very high82.4Confident75 Ų75109.1 Ų109.140%0.40158%0.579SS.*Hα-helixtrans-65.7-41.1176.3-79.5-40.3000112.6S51 R58 L59S51-D55 PolarHBondContact O-N 2.99Å; D55-R58 PolarHBondContact O-N 3.25Å; D55-R58 IonicContact OD1-CZ 3.36Å; D55-R58 IonicContact OD1-NE 3.67Å; D55-R58 IonicContact OD1-NH2 2.71Å; D55-R58 PolarHBondContact OD1-NH2 3.39Å; D55-L59 WeakPolarHBondContact O-CB 3.35Å; D55-L59 PolarHBondContact O-N 2.91Å
56L94.5Very high84.7Confident114 Ų114110 Ų11060%0.59757%0.571SS**Hα-helixtrans-62.9-44.8174.3-75175.3000111.7N52 S53 R58 L59 E60N52-L56 WeakPolarHBondContact O-CB 3.27Å; N52-L56 WeakPolarHBondContact O-CG 3.33Å; N52-L56 PolarHBondContact O-N 3.28Å; S53-L56 PolarHBondContact O-N 2.92Å; L56-R58 VanDerWaalsContact C-N 3.33Å; L56-R58 PolarHBondContact O-N 3.25Å; L56-L59 PolarHBondContact O-N 3.45Å; L56-E60 WeakPolarHBondContact O-CB 3.47Å; L56-E60 PolarHBondContact O-N 3.25Å
57K95.5Very high86.5Confident132 Ų132111.3 Ų111.357%0.57456%0.562SS**Hα-helixtrans-61-41.7175-74.1179.9179.2-174.60112S53 A54 L59 E60 S61S53-K57 WeakPolarHBondContact O-CG 3.46Å; S53-K57 PolarHBondContact O-N 3.11Å; A54-K57 PolarHBondContact O-N 2.69Å; K57-L59 VanDerWaalsContact C-N 3.35Å; K57-E60 PolarHBondContact O-N 2.95Å; K57-S61 PolarHBondContact O-N 3.49Å; K57-S61 PolarHBondContact O-OG 3.21Å
58R96.9Very high88.4Confident147 Ų147112 Ų11256%0.55556%0.555SS**Hα-helixtrans-62.9-42.4175.9-178.5176.565.7171.9-3.3111.4A54 D55 L56 K62A54-R58 WeakPolarHBondContact O-CB 3.48Å; A54-R58 PolarHBondContact O-N 2.96Å; D55-R58 PolarHBondContact O-N 3.25Å; D55-R58 IonicContact OD1-CZ 3.36Å; D55-R58 IonicContact OD1-NE 3.67Å; D55-R58 IonicContact OD1-NH2 2.71Å; D55-R58 PolarHBondContact OD1-NH2 3.39Å; L56-R58 VanDerWaalsContact C-N 3.33Å; L56-R58 PolarHBondContact O-N 3.25Å; R58-K62 WeakPolarHBondContact O-CG 3.32Å; R58-K62 PolarHBondContact O-N 3.42Å; R58-K62 VanDerWaalsContact O-N 3.09Å
59L97.3Very high90.5Very high97 Ų97108.3 Ų108.351%0.50854%0.541SS..Hα-helixtrans-63.7-45.6176.4178.961.1000111.1D55 L56 K57 S61 K62 M63D55-L59 WeakPolarHBondContact O-CB 3.35Å; D55-L59 PolarHBondContact O-N 2.91Å; L56-L59 PolarHBondContact O-N 3.45Å; K57-L59 VanDerWaalsContact C-N 3.35Å; L59-S61 PolarHBondContact O-N 3.14Å; L59-K62 PolarHBondContact O-N 3.39Å; L59-K62 VanDerWaalsContact O-N 3.17Å; L59-M63 HydrophobicContact CD1-CG 4.36Å; L59-M63 WeakPolarHBondContact O-CG 3.4Å; L59-M63 PolarHBondContact O-N 3.46Å
60E97.6Very high92.4Very high121 Ų121106.5 Ų106.557%0.56553%0.529SS*.Hα-helixtrans-56.5-49.1176.8-177.3178.7-168.400111.6L56 K57 K62 M63 L64L56-E60 WeakPolarHBondContact O-CB 3.47Å; L56-E60 PolarHBondContact O-N 3.25Å; K57-E60 PolarHBondContact O-N 2.95Å; E60-K62 VanDerWaalsContact C-N 3.32Å; E60-K62 PolarHBondContact O-N 2.95Å; E60-M63 PolarHBondContact O-N 2.73Å; E60-M63 VanDerWaalsContact O-N 3.15Å; E60-L64 HydrophobicContact CG-CD1 4.41Å; E60-L64 PolarHBondContact O-N 2.94Å
61S98.3Very high94.2Very high77 Ų77100.7 Ų100.754%0.53851%0.511SS..Hα-helixtrans-58.9-41.9175.8-620000112.5K57 L59 L64 F65K57-S61 PolarHBondContact O-N 3.49Å; K57-S61 PolarHBondContact O-OG 3.21Å; L59-S61 PolarHBondContact O-N 3.14Å; S61-L64 PolarHBondContact O-N 3.3Å; S61-F65 WeakPolarHBondContact O-CB 3.41Å; S61-F65 PolarHBondContact O-N 2.91Å
62K98.6Very high96Very high134 Ų134103 Ų10358%0.58352%0.515SS*.Hα-helixtrans-65.1-39.1176.1-74.2-179.7175.9-168.70112.2R58 L59 E60 F65 L66R58-K62 WeakPolarHBondContact O-CG 3.32Å; R58-K62 PolarHBondContact O-N 3.42Å; R58-K62 VanDerWaalsContact O-N 3.09Å; L59-K62 PolarHBondContact O-N 3.39Å; L59-K62 VanDerWaalsContact O-N 3.17Å; E60-K62 VanDerWaalsContact C-N 3.32Å; E60-K62 PolarHBondContact O-N 2.95Å; K62-F65 PolarHBondContact O-N 3.49Å; K62-L66 WeakPolarHBondContact O-CB 3.4Å; K62-L66 PolarHBondContact O-N 2.93Å
63M98.6Very high96.9Very high93 Ų93103 Ų10346%0.45852%0.515SS..Hα-helixtrans-67.4-39.7176.4-70.1-168.498.800111.8L59 E60 R67L59-M63 HydrophobicContact CD1-CG 4.36Å; L59-M63 WeakPolarHBondContact O-CG 3.4Å; L59-M63 PolarHBondContact O-N 3.46Å; E60-M63 PolarHBondContact O-N 2.73Å; E60-M63 VanDerWaalsContact O-N 3.15Å; M63-R67 WeakPolarHBondContact O-CB 3.35Å; M63-R67 VanDerWaalsContact O-CG 3.31Å; M63-R67 WeakPolarHBondContact O-CG 3.46Å; M63-R67 PolarHBondContact O-N 2.93Å
64L98.6Very high97.6Very high100 Ų100108.6 Ų108.652%0.52453%0.527SS..Hα-helixtrans-63.6-46.2174.3-75.7171.4000111.3E60 S61 L66 R67 Q68E60-L64 HydrophobicContact CG-CD1 4.41Å; E60-L64 PolarHBondContact O-N 2.94Å; S61-L64 PolarHBondContact O-N 3.3Å; L64-L66 PolarHBondContact O-N 3.31Å; L64-R67 PolarHBondContact O-N 3.18Å; L64-Q68 PolarHBondContact O-N 2.92Å
65F98.6Very high97.8Very high133 Ų133108 Ų10858%0.58352%0.522SS*.Hα-helixtrans-58.4-48.8175.7178.4-99.5000111.8S61 K62 R67 Q68 E69S61-F65 WeakPolarHBondContact O-CB 3.41Å; S61-F65 PolarHBondContact O-N 2.91Å; K62-F65 PolarHBondContact O-N 3.49Å; F65-R67 VanDerWaalsContact C-N 3.31Å; F65-R67 PolarHBondContact O-N 2.83Å; F65-Q68 WeakPolarHBondContact O-CB 3.37Å; F65-Q68 PolarHBondContact O-N 3.15Å; F65-Q68 VanDerWaalsContact O-N 3.1Å; F65-E69 HydrophobicContact CD1-CG 4.16Å; F65-E69 HydrophobicContact CE1-CG 3.61Å; F65-E69 HydrophobicContact CE2-CG 4.06Å; F65-E69 HydrophobicContact CZ-CG 3.55Å; F65-E69 PolarHBondContact O-N 3.44Å
66L98.8Very high98.1Very high107 Ų107108.2 Ų108.256%0.5652%0.522SS*.Hα-helixtrans-60.9-40.2178.1-177.862.3000112.1K62 L64 Q68 E69 M70K62-L66 WeakPolarHBondContact O-CB 3.4Å; K62-L66 PolarHBondContact O-N 2.93Å; L64-L66 PolarHBondContact O-N 3.31Å; L66-Q68 VanDerWaalsContact C-N 3.31Å; L66-Q68 PolarHBondContact O-N 3.33Å; L66-E69 PolarHBondContact O-N 2.88Å; L66-M70 HydrophobicContact CD1-CG 4.25Å; L66-M70 HydrophobicContact CG-CG 4.4Å; L66-M70 WeakPolarHBondContact O-CB 3.39Å; L66-M70 WeakPolarHBondContact O-CG 3.49Å; L66-M70 PolarHBondContact O-N 3.43Å
67R98.6Very high98.3Very high156 Ų156106.4 Ų106.459%0.58951%0.513SS*.Hα-helixtrans-61.4-41.2174.9-77.5-179.3-178.2117.7-1.7111.8M63 L64 F65 A71M63-R67 WeakPolarHBondContact O-CB 3.35Å; M63-R67 VanDerWaalsContact O-CG 3.31Å; M63-R67 WeakPolarHBondContact O-CG 3.46Å; M63-R67 PolarHBondContact O-N 2.93Å; L64-R67 PolarHBondContact O-N 3.18Å; F65-R67 VanDerWaalsContact C-N 3.31Å; F65-R67 PolarHBondContact O-N 2.83Å; R67-A71 WeakPolarHBondContact O-CB 3.39Å; R67-A71 PolarHBondContact O-N 3.08Å
68Q98.8Very high98.5Very high127 Ų127104.5 Ų104.559%0.59351%0.513SS*.Hα-helixtrans-64.5-46.6176.8-175.461.429.200111.5L64 F65 L66 M70 A71 H72L64-Q68 PolarHBondContact O-N 2.92Å; F65-Q68 WeakPolarHBondContact O-CB 3.37Å; F65-Q68 PolarHBondContact O-N 3.15Å; F65-Q68 VanDerWaalsContact O-N 3.1Å; L66-Q68 VanDerWaalsContact C-N 3.31Å; L66-Q68 PolarHBondContact O-N 3.33Å; Q68-M70 PolarHBondContact O-N 3.12Å; Q68-A71 PolarHBondContact O-N 3.24Å; Q68-H72 WeakPolarHBondContact O-CB 3.1Å; Q68-H72 PolarHBondContact O-N 3.49Å
69E98.7Very high98.6Very high93 Ų93104.7 Ų104.744%0.43552%0.517SS..Hα-helixtrans-61.9-42.1177.4-74.2-68.190.600111.8F65 L66 A71 H72 L73F65-E69 HydrophobicContact CD1-CG 4.16Å; F65-E69 HydrophobicContact CE1-CG 3.61Å; F65-E69 HydrophobicContact CE2-CG 4.06Å; F65-E69 HydrophobicContact CZ-CG 3.55Å; F65-E69 PolarHBondContact O-N 3.44Å; L66-E69 PolarHBondContact O-N 2.88Å; E69-A71 VanDerWaalsContact C-N 3.33Å; E69-A71 PolarHBondContact O-N 3.41Å; E69-H72 PolarHBondContact O-N 2.97Å; E69-L73 WeakPolarHBondContact O-CB 3.43Å; E69-L73 PolarHBondContact O-N 3.36Å
70M98.9Very high98.6Very high94 Ų94104.5 Ų104.546%0.46352%0.516SS..Hα-helixtrans-65.1-36.8176.1-71-62.4-64.200112.2L66 Q68 R74L66-M70 HydrophobicContact CD1-CG 4.25Å; L66-M70 HydrophobicContact CG-CG 4.4Å; L66-M70 WeakPolarHBondContact O-CB 3.39Å; L66-M70 WeakPolarHBondContact O-CG 3.49Å; L66-M70 PolarHBondContact O-N 3.43Å; Q68-M70 PolarHBondContact O-N 3.12Å; M70-R74 WeakPolarHBondContact O-CG 3.26Å; M70-R74 PolarHBondContact O-N 3.27Å; M70-R74 VanDerWaalsContact O-N 3.11Å
71A98.7Very high98.7Very high54 Ų54104.1 Ų104.145%0.44652%0.516SS..Hα-helixtrans-67.3-41.1174.200000111.5R67 Q68 E69 R74 A75R67-A71 WeakPolarHBondContact O-CB 3.39Å; R67-A71 PolarHBondContact O-N 3.08Å; Q68-A71 PolarHBondContact O-N 3.24Å; E69-A71 VanDerWaalsContact C-N 3.33Å; E69-A71 PolarHBondContact O-N 3.41Å; A71-R74 PolarHBondContact O-N 2.94Å; A71-A75 PolarHBondContact O-N 3.24Å
72H98.8Very high98.7Very high104 Ų104106.4 Ų106.448%0.48152%0.518SS..Hα-helixtrans-63.2-45.4176-178.7-130.1000111.8Q68 E69 R74 A75 I76Q68-H72 WeakPolarHBondContact O-CB 3.1Å; Q68-H72 PolarHBondContact O-N 3.49Å; E69-H72 PolarHBondContact O-N 2.97Å; H72-R74 PolarHBondContact O-N 3.29Å; H72-A75 WeakPolarHBondContact O-CB 3.39Å; H72-A75 PolarHBondContact O-N 3.47Å; H72-A75 VanDerWaalsContact O-N 3.09Å; H72-I76 WeakPolarHBondContact O-CG1 3.33Å; H72-I76 PolarHBondContact O-N 3.25Å
73L98.9Very high98.7Very high87 Ų87105.9 Ų105.946%0.45552%0.518SS..Hα-helixtrans-59.8-45.1176.6-172.863.1000111.6E69 A75 I76 D77E69-L73 WeakPolarHBondContact O-CB 3.43Å; E69-L73 PolarHBondContact O-N 3.36Å; L73-A75 VanDerWaalsContact C-N 3.28Å; L73-A75 PolarHBondContact O-N 3.43Å; L73-I76 WeakPolarHBondContact O-CB 3.13Å; L73-I76 PolarHBondContact O-N 3.05Å; L73-I76 VanDerWaalsContact O-N 3.09Å; L73-D77 PolarHBondContact O-N 3.09Å
74R98.8Very high98.8Very high175 Ų175106.4 Ų106.466%0.6652%0.522SS*.Hα-helixtrans-61-36.1174.5-74.5-169.8-172.11753113M70 A71 H72 I76 D77 V78M70-R74 WeakPolarHBondContact O-CG 3.26Å; M70-R74 PolarHBondContact O-N 3.27Å; M70-R74 VanDerWaalsContact O-N 3.11Å; A71-R74 PolarHBondContact O-N 2.94Å; H72-R74 PolarHBondContact O-N 3.29Å; R74-I76 VanDerWaalsContact C-N 3.31Å; R74-D77 PolarHBondContact O-N 3.41Å; R74-V78 WeakPolarHBondContact O-CG2 3.48Å; R74-V78 PolarHBondContact O-N 3.42Å; R74-V78 VanDerWaalsContact O-N 3.09Å
75A98.8Very high98.8Very high48 Ų48105.7 Ų105.740%0.39752%0.518SS..Hα-helixtrans-66.5-36.3176.100000111.7A71 H72 L73 K79A71-A75 PolarHBondContact O-N 3.24Å; H72-A75 WeakPolarHBondContact O-CB 3.39Å; H72-A75 PolarHBondContact O-N 3.47Å; H72-A75 VanDerWaalsContact O-N 3.09Å; L73-A75 VanDerWaalsContact C-N 3.28Å; L73-A75 PolarHBondContact O-N 3.43Å; A75-K79 WeakPolarHBondContact O-CG 3.39Å; A75-K79 PolarHBondContact O-N 2.76Å
76I98.8Very high98.8Very high79 Ų79103 Ų10341%0.40552%0.516SS..Hα-helixtrans-64.5-46.6172.8-65.8167.1000110.3H72 L73 R74 V78 K79 L80H72-I76 WeakPolarHBondContact O-CG1 3.33Å; H72-I76 PolarHBondContact O-N 3.25Å; L73-I76 WeakPolarHBondContact O-CB 3.13Å; L73-I76 PolarHBondContact O-N 3.05Å; L73-I76 VanDerWaalsContact O-N 3.09Å; R74-I76 VanDerWaalsContact C-N 3.31Å; I76-V78 VanDerWaalsContact C-N 3.32Å; I76-V78 PolarHBondContact O-N 3.08Å; I76-K79 WeakPolarHBondContact O-CB 3.4Å; I76-K79 PolarHBondContact O-N 3.08Å; I76-K79 VanDerWaalsContact O-N 3.08Å; I76-L80 PolarHBondContact O-N 3.03Å
77D98.9Very high98.8Very high76 Ų76102.8 Ų102.841%0.40651%0.514SS..Hα-helixtrans-57.8-44.6179.6-68.3-18.5000111.9L73 R74 K79 L80 M81L73-D77 PolarHBondContact O-N 3.09Å; R74-D77 PolarHBondContact O-N 3.41Å; D77-K79 VanDerWaalsContact C-N 3.31Å; D77-K79 PolarHBondContact O-N 3.3Å; D77-L80 PolarHBondContact O-N 3.09Å; D77-M81 WeakPolarHBondContact O-CB 3.43Å; D77-M81 WeakPolarHBondContact O-CG 3.47Å; D77-M81 PolarHBondContact O-N 3.33Å
78V98.8Very high98.7Very high92 Ų9299.8 Ų99.856%0.55851%0.51SS*.Hα-helixtrans-60.5-42176.7171.90000111.2R74 I76 M81 Q82R74-V78 WeakPolarHBondContact O-CG2 3.48Å; R74-V78 PolarHBondContact O-N 3.42Å; R74-V78 VanDerWaalsContact O-N 3.09Å; I76-V78 VanDerWaalsContact C-N 3.32Å; I76-V78 PolarHBondContact O-N 3.08Å; V78-M81 PolarHBondContact O-N 3.34Å; V78-Q82 WeakPolarHBondContact O-CB 3.43Å; V78-Q82 PolarHBondContact O-N 2.89Å
79K98.6Very high98.7Very high151 Ų15197.7 Ų97.766%0.65750%0.502SS*.Hα-helixtrans-65.8-43.7176.9-72.9178.6177.6-178.20111.8A75 I76 D77 M81 Q82 Q83A75-K79 WeakPolarHBondContact O-CG 3.39Å; A75-K79 PolarHBondContact O-N 2.76Å; I76-K79 WeakPolarHBondContact O-CB 3.4Å; I76-K79 PolarHBondContact O-N 3.08Å; I76-K79 VanDerWaalsContact O-N 3.08Å; D77-K79 VanDerWaalsContact C-N 3.31Å; D77-K79 PolarHBondContact O-N 3.3Å; K79-M81 VanDerWaalsContact C-N 3.33Å; K79-M81 PolarHBondContact O-N 3.11Å; K79-Q82 PolarHBondContact O-N 3.38Å; K79-Q83 WeakPolarHBondContact O-CG 3.48Å; K79-Q83 PolarHBondContact O-N 3.02Å
80L98.8Very high98.7Very high93 Ų9394.7 Ų94.749%0.48750%0.496SS..Hα-helixtrans-61-44.5177.9-177.765.4000110.9I76 D77 Q83 L84I76-L80 PolarHBondContact O-N 3.03Å; D77-L80 PolarHBondContact O-N 3.09Å; L80-Q83 PolarHBondContact O-N 3.09Å; L80-L84 HydrophobicContact CG-CD1 4.35Å; L80-L84 WeakPolarHBondContact O-CG 3.45Å; L80-L84 PolarHBondContact O-N 2.91Å
81M98.9Very high98.6Very high114 Ų11495.4 Ų95.456%0.56250%0.501SS*.Hα-helixtrans-60.7-44.7174.8-74.5173.238.500112.1D77 V78 K79 Q83 L84 I85D77-M81 WeakPolarHBondContact O-CB 3.43Å; D77-M81 WeakPolarHBondContact O-CG 3.47Å; D77-M81 PolarHBondContact O-N 3.33Å; V78-M81 PolarHBondContact O-N 3.34Å; K79-M81 VanDerWaalsContact C-N 3.33Å; K79-M81 PolarHBondContact O-N 3.11Å; M81-Q83 VanDerWaalsContact C-N 3.3Å; M81-Q83 PolarHBondContact O-N 2.94Å; M81-L84 PolarHBondContact O-N 3.42Å; M81-I85 WeakPolarHBondContact O-CG1 3.48Å; M81-I85 PolarHBondContact O-N 3.31Å
82Q98.8Very high98.6Very high125 Ų12596.4 Ų96.458%0.58450%0.497SS*.Hα-helixtrans-60.7-40.8177.2-172.669.839.800111.8V78 K79 I85 S86V78-Q82 WeakPolarHBondContact O-CB 3.43Å; V78-Q82 PolarHBondContact O-N 2.89Å; K79-Q82 PolarHBondContact O-N 3.38Å; Q82-I85 PolarHBondContact O-N 3.43Å; Q82-S86 WeakPolarHBondContact O-CB 3.4Å; Q82-S86 PolarHBondContact O-N 3.44Å
83Q98.8Very high98.4Very high122 Ų12294.9 Ų94.957%0.5750%0.497SS*.Hα-helixtrans-64.4-44.9175.7-72.6178.4-48.500111.5K79 L80 M81 I85 S86 I87K79-Q83 WeakPolarHBondContact O-CG 3.48Å; K79-Q83 PolarHBondContact O-N 3.02Å; L80-Q83 PolarHBondContact O-N 3.09Å; M81-Q83 VanDerWaalsContact C-N 3.3Å; M81-Q83 PolarHBondContact O-N 2.94Å; Q83-I85 VanDerWaalsContact C-N 3.34Å; Q83-I85 PolarHBondContact O-N 3.39Å; Q83-S86 PolarHBondContact O-N 3.26Å; Q83-I87 VanDerWaalsContact O-CG1 3.27Å; Q83-I87 WeakPolarHBondContact O-CG1 3.31Å; Q83-I87 PolarHBondContact O-N 2.98Å
84L98.8Very high98.3Very high104 Ų10495.7 Ų95.755%0.54550%0.501SS..Hα-helixtrans-60.7-42.4177.3-74.6169.2000112.1L80 M81 I87 N88L80-L84 HydrophobicContact CG-CD1 4.35Å; L80-L84 WeakPolarHBondContact O-CG 3.45Å; L80-L84 PolarHBondContact O-N 2.91Å; M81-L84 PolarHBondContact O-N 3.42Å; L84-I87 PolarHBondContact O-N 3.36Å; L84-N88 WeakPolarHBondContact O-CB 3.14Å; L84-N88 PolarHBondContact O-N 2.89Å
85I98.6Very high98.1Very high85 Ų8591.2 Ų91.244%0.43649%0.487SS..Hα-helixtrans-61.2-49.6174.9-68.1165.3000110.1M81 Q82 Q83 I87 N88 D89M81-I85 WeakPolarHBondContact O-CG1 3.48Å; M81-I85 PolarHBondContact O-N 3.31Å; Q82-I85 PolarHBondContact O-N 3.43Å; Q83-I85 VanDerWaalsContact C-N 3.34Å; Q83-I85 PolarHBondContact O-N 3.39Å; I85-I87 VanDerWaalsContact C-N 3.28Å; I85-I87 PolarHBondContact O-N 2.99Å; I85-N88 WeakPolarHBondContact O-CB 3.48Å; I85-N88 PolarHBondContact O-N 3.46Å; I85-N88 VanDerWaalsContact O-N 3.14Å; I85-D89 VanDerWaalsContact O-CG 3.31Å; I85-D89 PolarHBondContact O-N 3.1Å
86S98.6Very high97.9Very high78 Ų7896.1 Ų96.155%0.54550%0.495SS..Hα-helixtrans-60.9-36179.6-173.70000113.1Q82 Q83 G90Q82-S86 WeakPolarHBondContact O-CB 3.4Å; Q82-S86 PolarHBondContact O-N 3.44Å; Q83-S86 PolarHBondContact O-N 3.26Å; S86-G90 PolarHBondContact O-N 2.91Å
87I98.7Very high97.6Very high102 Ų10297.5 Ų97.552%0.52351%0.507SS..Hα-helixtrans-68.7-45.2175.7-69.8164.2000110.3Q83 L84 I85 D89 G90 I91Q83-I87 VanDerWaalsContact O-CG1 3.27Å; Q83-I87 WeakPolarHBondContact O-CG1 3.31Å; Q83-I87 PolarHBondContact O-N 2.98Å; L84-I87 PolarHBondContact O-N 3.36Å; I85-I87 VanDerWaalsContact C-N 3.28Å; I85-I87 PolarHBondContact O-N 2.99Å; I87-D89 VanDerWaalsContact C-N 3.34Å; I87-D89 PolarHBondContact O-N 3Å; I87-G90 PolarHBondContact O-N 3.39Å; I87-I91 HydrophobicContact CG2-CD1 3.83Å; I87-I91 HydrophobicContact CG2-CG1 4.39Å; I87-I91 WeakPolarHBondContact O-CG1 3.4Å; I87-I91 PolarHBondContact O-N 2.86Å
88N98.4Very high97.3Very high93 Ų9399.3 Ų99.350%0.49751%0.514SS..Hα-helixtrans-57.7-47.4177.6-179.172.8000111.4L84 I85 G90 I91 E92L84-N88 WeakPolarHBondContact O-CB 3.14Å; L84-N88 PolarHBondContact O-N 2.89Å; I85-N88 WeakPolarHBondContact O-CB 3.48Å; I85-N88 PolarHBondContact O-N 3.46Å; I85-N88 VanDerWaalsContact O-N 3.14Å; N88-G90 VanDerWaalsContact C-N 3.3Å; N88-G90 PolarHBondContact O-N 3.47Å; N88-I91 PolarHBondContact O-N 3.26Å; N88-E92 PolarHBondContact O-N 3.21Å
89D98.1Very high96.6Very high82 Ų8299.5 Ų99.544%0.43951%0.509SS..Hα-helixtrans-64-36.9177.9-64.1-10.5000111.6I85 I87 E92 S93I85-D89 VanDerWaalsContact O-CG 3.31Å; I85-D89 PolarHBondContact O-N 3.1Å; I87-D89 VanDerWaalsContact C-N 3.34Å; I87-D89 PolarHBondContact O-N 3Å; D89-E92 PolarHBondContact O-N 3.45Å; D89-S93 WeakPolarHBondContact O-CB 3.25Å; D89-S93 PolarHBondContact O-N 2.9Å; D89-S93 PolarHBondContact O-OG 3.41Å
90G97.9Very high95.2Very high30 Ų3097.7 Ų97.731%0.30951%0.507SS..Hα-helixtrans-64.7-44174.900000113S86 I87 N88 S93 I94S86-G90 PolarHBondContact O-N 2.91Å; I87-G90 PolarHBondContact O-N 3.39Å; N88-G90 VanDerWaalsContact C-N 3.3Å; N88-G90 PolarHBondContact O-N 3.47Å; G90-S93 WeakPolarHBondContact O-CB 3.37Å; G90-S93 PolarHBondContact O-N 2.87Å; G90-I94 WeakPolarHBondContact O-CG1 3.22Å; G90-I94 PolarHBondContact O-N 2.85Å; G90-I94 VanDerWaalsContact O-N 3.08Å
91I97.8Very high93.7Very high109 Ų109101 Ų10156%0.55952%0.517SS*.Hα-helixtrans-61.6-46.3175.7-68.8166.1000110.1I87 N88 S93 I94 K95I87-I91 HydrophobicContact CG2-CD1 3.83Å; I87-I91 HydrophobicContact CG2-CG1 4.39Å; I87-I91 WeakPolarHBondContact O-CG1 3.4Å; I87-I91 PolarHBondContact O-N 2.86Å; N88-I91 PolarHBondContact O-N 3.26Å; I91-S93 VanDerWaalsContact C-N 3.32Å; I91-S93 PolarHBondContact O-N 3.44Å; I91-I94 PolarHBondContact O-N 3.25Å; I91-K95 WeakPolarHBondContact O-CB 3.47Å; I91-K95 PolarHBondContact O-N 2.95Å
92E97.1Very high91.7Very high76 Ų76102.7 Ų102.736%0.35552%0.523SS..Hα-helixtrans-63.6-39179.1-178.6152.9-130.900111.8N88 D89 I94 K95 W96N88-E92 PolarHBondContact O-N 3.21Å; D89-E92 PolarHBondContact O-N 3.45Å; E92-I94 PolarHBondContact O-N 2.94Å; E92-K95 WeakPolarHBondContact O-CB 3.45Å; E92-K95 PolarHBondContact O-N 3.43Å; E92-K95 IonicContact OE1-NZ 3.55Å; E92-W96 PolarHBondContact O-N 3Å
93S96.6Very high89.7Confident71 Ų7198.7 Ų98.750%0.49752%0.516SS..Hα-helixtrans-60-44.9174.7-59.70000112.4D89 G90 I91 W96 V97D89-S93 WeakPolarHBondContact O-CB 3.25Å; D89-S93 PolarHBondContact O-N 2.9Å; D89-S93 PolarHBondContact O-OG 3.41Å; G90-S93 WeakPolarHBondContact O-CB 3.37Å; G90-S93 PolarHBondContact O-N 2.87Å; I91-S93 VanDerWaalsContact C-N 3.32Å; I91-S93 PolarHBondContact O-N 3.44Å; S93-W96 PolarHBondContact O-N 3.38Å; S93-V97 WeakPolarHBondContact O-CG2 3.37Å; S93-V97 PolarHBondContact O-N 3.4Å
94I96.4Very high87.5Confident105 Ų10597.7 Ų97.754%0.53851%0.514SS..Hα-helixtrans-65.8-43.6176.8-67.4167.5000110.5G90 I91 E92 W96 V97 M98G90-I94 WeakPolarHBondContact O-CG1 3.22Å; G90-I94 PolarHBondContact O-N 2.85Å; G90-I94 VanDerWaalsContact O-N 3.08Å; I91-I94 PolarHBondContact O-N 3.25Å; E92-I94 PolarHBondContact O-N 2.94Å; I94-W96 VanDerWaalsContact C-N 3.33Å; I94-W96 PolarHBondContact O-N 3.25Å; I94-V97 PolarHBondContact O-N 3.37Å; I94-V97 VanDerWaalsContact O-N 3.13Å; I94-M98 HydrophobicContact CG2-CG 4.11Å; I94-M98 HydrophobicContact CG2-SD 3.58Å; I94-M98 VanDerWaalsContact CG2-SD 3.58Å; I94-M98 WeakPolarHBondContact O-CB 3.4Å; I94-M98 WeakPolarHBondContact O-CG 3.42Å; I94-M98 PolarHBondContact O-N 3.29Å
95K94.3Very high85.2Confident81 Ų8196.6 Ų96.635%0.35252%0.52SS..Hα-helixtrans-55.2-48.3177.1-171.4-162.873-173.70111I91 E92 V97 M98 E99I91-K95 WeakPolarHBondContact O-CB 3.47Å; I91-K95 PolarHBondContact O-N 2.95Å; E92-K95 WeakPolarHBondContact O-CB 3.45Å; E92-K95 PolarHBondContact O-N 3.43Å; E92-K95 IonicContact OE1-NZ 3.55Å; K95-V97 VanDerWaalsContact C-N 3.32Å; K95-V97 PolarHBondContact O-N 3.15Å; K95-M98 PolarHBondContact O-N 3.15Å; K95-M98 VanDerWaalsContact O-N 3.16Å; K95-E99 WeakPolarHBondContact CD-OE1 3.21Å; K95-E99 VanDerWaalsContact CE-OE1 3.29Å; K95-E99 WeakPolarHBondContact CE-OE1 3.4Å; K95-E99 HydrophobicContact CG-CG 4.25Å; K95-E99 WeakPolarHBondContact CG-OE1 3.42Å; K95-E99 WeakPolarHBondContact O-CB 3.37Å; K95-E99 VanDerWaalsContact O-CG 3.31Å; K95-E99 WeakPolarHBondContact O-CG 3.22Å; K95-E99 PolarHBondContact O-N 2.85Å
96W95Very high83.1Confident150 Ų15096.4 Ų96.457%0.56853%0.526SS*.Hα-helixtrans-58.9-40.9176.4-69.9124.6000113.1E92 S93 I94 D100E92-W96 PolarHBondContact O-N 3Å; S93-W96 PolarHBondContact O-N 3.38Å; I94-W96 VanDerWaalsContact C-N 3.33Å; I94-W96 PolarHBondContact O-N 3.25Å; W96-D100 PolarHBondContact O-N 2.9Å
97V92.3Very high80.8Confident108 Ų108101.5 Ų101.566%0.65553%0.533SS*.Hα-helixtrans-68.7-35.2177.4173.30000111.9S93 I94 K95S93-V97 WeakPolarHBondContact O-CG2 3.37Å; S93-V97 PolarHBondContact O-N 3.4Å; I94-V97 PolarHBondContact O-N 3.37Å; I94-V97 VanDerWaalsContact O-N 3.13Å; K95-V97 VanDerWaalsContact C-N 3.32Å; K95-V97 PolarHBondContact O-N 3.15Å
98M91.4Very high78.2Confident114 Ų114103.3 Ų103.356%0.56254%0.54SS*.Hα-helixtrans-76.5-42.6-179.9-73178.960.800112.7I94 K95 D100 K101 E102I94-M98 HydrophobicContact CG2-CG 4.11Å; I94-M98 HydrophobicContact CG2-SD 3.58Å; I94-M98 VanDerWaalsContact CG2-SD 3.58Å; I94-M98 WeakPolarHBondContact O-CB 3.4Å; I94-M98 WeakPolarHBondContact O-CG 3.42Å; I94-M98 PolarHBondContact O-N 3.29Å; K95-M98 PolarHBondContact O-N 3.15Å; K95-M98 VanDerWaalsContact O-N 3.16Å; M98-D100 PolarHBondContact O-N 2.91Å; M98-K101 PolarHBondContact O-N 3.48Å; M98-E102 PolarHBondContact O-N 2.86Å
99E84.3Confident75.9Confident97 Ų97103.4 Ų103.445%0.45355%0.548SS..Hα-helixtrans-58.6-36.6178.2-74.5172.7-178.200111.6K95 G103K95-E99 WeakPolarHBondContact CD-OE1 3.21Å; K95-E99 VanDerWaalsContact CE-OE1 3.29Å; K95-E99 WeakPolarHBondContact CE-OE1 3.4Å; K95-E99 HydrophobicContact CG-CG 4.25Å; K95-E99 WeakPolarHBondContact CG-OE1 3.42Å; K95-E99 WeakPolarHBondContact O-CB 3.37Å; K95-E99 VanDerWaalsContact O-CG 3.31Å; K95-E99 WeakPolarHBondContact O-CG 3.22Å; K95-E99 PolarHBondContact O-N 2.85Å; E99-G103 PolarHBondContact O-N 3.49Å
100D69.8Low73.7Confident113 Ų113103.4 Ų103.460%0.60455%0.554SS**Hα-helixtrans-67.3-35.1175.2-166.643.4000112.3W96 M98 L104W96-D100 PolarHBondContact O-N 2.9Å; M98-D100 PolarHBondContact O-N 2.91Å; D100-L104 VanDerWaalsContact O-CG 3.26Å; D100-L104 WeakPolarHBondContact O-CG 3.37Å; D100-L104 PolarHBondContact O-N 2.92Å
101K66.9Low71.3Confident161 Ų161107.8 Ų107.870%0.757%0.57SS**Hα-helixtrans-76.5-32.9-179.4-162.5175177.8-175.40113M98 L104 A105M98-K101 PolarHBondContact O-N 3.48Å; K101-L104 PolarHBondContact O-N 2.87Å; K101-A105 WeakPolarHBondContact O-CB 3.42Å; K101-A105 PolarHBondContact O-N 3.42Å
102E57.1Low69Low150 Ų150109.6 Ų109.670%0.70159%0.586SS**Hα-helixtrans-75.3-30.2177.9-165.4148.6-177.300112.3M98M98-E102 PolarHBondContact O-N 2.86Å
103G55.9Low66.9Low41 Ų41109.2 Ų109.242%0.42360%0.602SS.*Hα-helixtrans-70.4-26.7170.300000114.8E99E99-G103 PolarHBondContact O-N 3.49Å
104L54Low64.9Low102 Ų102111.3 Ų111.353%0.53462%0.617SS.*Hα-helixtrans-90-33.3179.3-64.9174.9000113.1D100 K101 S106 R107 E108D100-L104 VanDerWaalsContact O-CG 3.26Å; D100-L104 WeakPolarHBondContact O-CG 3.37Å; D100-L104 PolarHBondContact O-N 2.92Å; K101-L104 PolarHBondContact O-N 2.87Å; L104-S106 PolarHBondContact O-N 3Å; L104-R107 PolarHBondContact O-N 3.02Å; L104-E108 PolarHBondContact O-N 3.23Å
105A50.9Low63Low80 Ų80114 Ų11466%0.66163%0.631SS**Hα-helixtrans-67.5-22.817500000113.2K101K101-A105 WeakPolarHBondContact O-CB 3.42Å; K101-A105 PolarHBondContact O-N 3.42Å
106S53.2Low60.9Low82 Ų82119.8 Ų119.857%0.57365%0.653SS**THydrogen-bonded Turntrans-91.3-19.5176.2-168.60000114L104 S109L104-S106 PolarHBondContact O-N 3Å; S106-S109 PolarHBondContact O-OG 3.17Å
107R50.3Low58.9Low184 Ų184118.3 Ų118.369%0.69467%0.665SS**THydrogen-bonded Turntrans-92-19.3-178.2-103.4171.460.686.9-0.3115L104 S109 S110L104-R107 PolarHBondContact O-N 3.02Å; R107-S109 VanDerWaalsContact C-N 3.28Å; R107-S109 PolarHBondContact O-N 3.01Å; R107-S110 PolarHBondContact O-N 3.44Å; R107-S110 VanDerWaalsContact O-N 3.14Å
108E45.5Very low57Low141 Ų141120.1 Ų120.166%0.65967%0.67SS**G310 helixtrans-75.6-17.6175.7-152.969-137.100112.4L104 S110 L111L104-E108 PolarHBondContact O-N 3.23Å; E108-S110 PolarHBondContact O-N 2.85Å; E108-L111 WeakPolarHBondContact OE1-CD1 3.34Å
109S48.8Very low55.1Low95 Ų95123.1 Ų123.166%0.66469%0.687SS**G310 helixtrans-78.5-3.6167.460.90000113.5S106 R107S106-S109 PolarHBondContact O-OG 3.17Å; R107-S109 VanDerWaalsContact C-N 3.28Å; R107-S109 PolarHBondContact O-N 3.01Å
110S52.1Low53Low82 Ų82125.9 Ų125.957%0.57371%0.705SS**G310 helixtrans-113.713.8178.6-62.20000114R107 E108 T112R107-S110 PolarHBondContact O-N 3.44Å; R107-S110 VanDerWaalsContact O-N 3.14Å; E108-S110 PolarHBondContact O-N 2.85Å; S110-T112 VanDerWaalsContact C-N 3.26Å; S110-T112 PolarHBondContact O-N 3.09Å
111L47.5Very low52.1Low122 Ų122124.8 Ų124.864%0.63971%0.707SS**THydrogen-bonded Turntrans-84.216.7-179.6-112.1159.2000115.2E108E108-L111 WeakPolarHBondContact OE1-CD1 3.34Å
112T50.4Low50.9Low147 Ų147125.9 Ų125.990%0.90271%0.714SS**THydrogen-bonded Turntrans-123.24.217131.40000115.2S110S110-T112 VanDerWaalsContact C-N 3.26Å; S110-T112 PolarHBondContact O-N 3.09Å
113G52.4Low50.2Low67 Ų67126 Ų12669%0.69172%0.72SS**  trans-112.8-11.3-165.400000119
114S54.9Low49.4Very low116 Ų116130.2 Ų130.281%0.81173%0.732SS**  trans-110.463-173.9-158.10000112.8
115L55.3Low48.9Very low160 Ų160131.8 Ų131.884%0.83875%0.747SS**SBendtrans-136.1113151.7-71.3178.4000107.2
116Y51.6Low48.4Very low204 Ų204133.4 Ų133.480%0.875%0.753SS**  trans76.4105.4172.7-87.8-100.3000119.5L118Y116-L118 HydrophobicContact CD1-CG 4.38Å
117S51.8Low48Very low118 Ų118135.6 Ų135.683%0.82577%0.768SS**  -171.687.3127.5-78.30000106.8
118L52.2Low48Very low146 Ų146137.7 Ų137.776%0.76478%0.776SS**  56.6129.7100.5-69-176.5000114.6Y116Y116-L118 HydrophobicContact CD1-CG 4.38Å
119L51.5Low47.8Very low177 Ų177134.3 Ų134.393%0.92778%0.779SS**  trans92.673.1163.5-131.576.1000115.8
120D41.8Very low47.6Very low155 Ų155134.2 Ų134.283%0.82978%0.779SS**  trans-129110.9144.1-164.324.9000109
121S50.8Low46.9Very low90 Ų90138.9 Ų138.963%0.62979%0.789SS**  trans40.793.6142.9-1580000117.5
122Q40.8Very low47.1Very low184 Ų184138.9 Ų138.986%0.8679%0.794SS**  trans-119.567.4146.1-167164.20.800108.9D124Q122-D124 VanDerWaalsContact C-N 3.33Å; Q122-D124 PolarHBondContact O-N 3.15Å
123D42Very low46.8Very low153 Ų153137.1 Ų137.182%0.81879%0.788SS**  trans-77.591.5149.6-87.4-35.2000107.7
124D40.2Very low46.8Very low129 Ų129142.3 Ų142.369%0.6980%0.799SS**  trans-142.7111.5154.4-114.7-28.8000110.5Q122Q122-D124 VanDerWaalsContact C-N 3.33Å; Q122-D124 PolarHBondContact O-N 3.15Å
125T42.4Very low46.3Very low136 Ų136145.3 Ų145.383%0.83480%0.8SS**  trans80.468.1159.477.20000118.8
126S40Very low45.7Very low114 Ų114144.7 Ų144.780%0.79780%0.798SS**  trans-112.3101.6143.1-174.80000109.6R128S126-R128 VanDerWaalsContact C-N 3.28Å; S126-R128 PolarHBondContact O-N 3Å
127S46.7Very low45.1Very low127 Ų127137.8 Ų137.889%0.88879%0.788SS**  trans-64.684.5169.2-177.60000109.7
128R48.5Very low45Very low228 Ų228141 Ų14186%0.8679%0.79SS**  trans-16188.5166.1-158.2144.7168.6-100.9-1.5113.6S126S126-R128 VanDerWaalsContact C-N 3.28Å; S126-R128 PolarHBondContact O-N 3Å
129G42.7Very low44.7Very low70 Ų70139 Ų13972%0.72279%0.788SS**  trans56123.8131.400000120.3
130S44.3Very low44.9Very low94 Ų94137.8 Ų137.866%0.65778%0.782SS**  95.3114.9121.9-95.80000121
131F37.7Very low45.3Very low179 Ų179133.8 Ų133.879%0.78578%0.778SS**  trans83.4106.5136.8-58.4-56000120.7
132T51.1Low45.6Very low122 Ų122136.8 Ų136.875%0.74879%0.787SS**  30.8124.7118.8640000120.3
133S44Very low46.5Very low111 Ų111136.2 Ų136.278%0.77679%0.789SS**  trans168.8112.1136.150.80000109.7
134L53.3Low47.1Very low175 Ų175132.6 Ų132.692%0.91679%0.788SS**  51.2104.189.4-69.2-173000115.9
135H43.3Very low47.7Very low179 Ų179134.4 Ų134.483%0.82980%0.796SS**  trans177.3108.4138-143.549.5000107.5
136D43Very low48.3Very low148 Ų148132.9 Ų132.979%0.79179%0.791SS**  57.1132.769.4-162.532.5000115
137G38.4Very low49.1Very low59 Ų59132.2 Ų132.261%0.60878%0.782SS**  trans120.682.2159.200000119.1
138H49.4Very low49.4Very low184 Ų184128.8 Ų128.885%0.85277%0.767SS**  59.4111.3121.3-167.2-76.8000121
139S46.3Very low49.8Very low104 Ų104122.5 Ų122.573%0.72776%0.757SS**  179.6129.2111.7600000113.3
140D56.7Low50.5Low152 Ų152125.7 Ų125.781%0.81375%0.749SS**  trans-57.8146.7162.9-162.42.5000111.7
141G49.9Very low51.2Low72 Ų72126.5 Ų126.574%0.74275%0.745SS**  trans175.851.5-172.600000113.9D143G141-D143 PolarHBondContact O-N 3.46Å
142L56.9Low52Low153 Ų153124.3 Ų124.380%0.80174%0.742SS**  trans-59113.1157.7-65.1166.8000108.2
143D58.9Low52.3Low172 Ų172123 Ų12392%0.9273%0.733SS**  trans-174.5103.5157.8-86.7-27.8000109.5G141G141-D143 PolarHBondContact O-N 3.46Å
144G56Low52.9Low77 Ų77123 Ų12379%0.79472%0.724SS**  trans170.8-16169.500000119.9S146G144-S146 PolarHBondContact O-N 3.38Å; G144-S146 VanDerWaalsContact O-N 3.14Å
145I51.5Low53.2Low167 Ų167120.6 Ų120.686%0.85671%0.712SS**  trans-8786175.655.4162.9000110.6V147I145-V147 PolarHBondContact O-N 2.88Å
146S55Low54Low104 Ų104120.1 Ų120.173%0.72771%0.71SS**  trans-73.3110.7172.5-174.30000110.2G144 G148G144-S146 PolarHBondContact O-N 3.38Å; G144-S146 VanDerWaalsContact O-N 3.14Å; S146-G148 PolarHBondContact O-N 3.1Å
147V57.4Low54.7Low100 Ų100119.6 Ų119.661%0.60671%0.707SS**THydrogen-bonded Turntrans-67.517.3177.2-179.70000111.4I145 Y150I145-V147 PolarHBondContact O-N 2.88Å; V147-Y150 HydrophobicContact CB-CE1 4.32Å; V147-Y150 HydrophobicContact CG1-CE1 3.51Å; V147-Y150 WeakPolarHBondContact O-CD1 3.41Å; V147-Y150 WeakPolarHBondContact O-CE1 3.35Å; V147-Y150 PolarHBondContact O-OH 3.28Å
148G54.1Low55.6Low55 Ų55120.1 Ų120.157%0.56771%0.706SS**THydrogen-bonded Turntrans-96-18.7179.700000115.2S146 Y150S146-G148 PolarHBondContact O-N 3.1Å; G148-Y150 PolarHBondContact O-N 3.09Å
149S55.9Low56Low95 Ų95119.1 Ų119.166%0.66470%0.701SS**THydrogen-bonded Turntrans-79.3-9-168.1-174.10000115.3
150Y58Low56.3Low138 Ų138121.4 Ų121.454%0.54171%0.705SS.*THydrogen-bonded Turntrans-84-10.1-173.656.4-109.1000114.4V147 G148 T153V147-Y150 HydrophobicContact CB-CE1 4.32Å; V147-Y150 HydrophobicContact CG1-CE1 3.51Å; V147-Y150 WeakPolarHBondContact O-CD1 3.41Å; V147-Y150 WeakPolarHBondContact O-CE1 3.35Å; V147-Y150 PolarHBondContact O-OH 3.28Å; G148-Y150 PolarHBondContact O-N 3.09Å; Y150-T153 PolarHBondContact O-OG1 3.23Å
151L58.2Low56.1Low110 Ų110122 Ų12258%0.57671%0.708SS**SBendtrans-92.5-17.5179.3-64.1-167.8000113.9T153 L154L151-T153 VanDerWaalsContact C-N 3.27Å; L151-T153 PolarHBondContact O-N 3.28Å; L151-L154 HydrophobicContact CD2-CD1 4.24Å; L151-L154 PolarHBondContact O-N 3.39Å
152D55.8Low56.1Low134 Ų134122.9 Ų122.972%0.71770%0.703SS**Hα-helixtrans-73.6-22-178.9-152.143.9000112.2
153T56.2Low55.5Low93 Ų93122.5 Ų122.557%0.57170%0.696SS**Hα-helixtrans-89.5-3.9-179.557.60000114.2Y150 L151Y150-T153 PolarHBondContact O-OG1 3.23Å; L151-T153 VanDerWaalsContact C-N 3.27Å; L151-T153 PolarHBondContact O-N 3.28Å
154L56.4Low54.5Low111 Ų111122.5 Ų122.558%0.58169%0.691SS**Hα-helixtrans-92.9-22.1177.5-68.2179.4000112.6L151L151-L154 HydrophobicContact CD2-CD1 4.24Å; L151-L154 PolarHBondContact O-N 3.39Å
155D59.2Low53.5Low126 Ų126125.5 Ų125.567%0.67469%0.694SS**Hα-helixtrans-72.4-37.6177.4-148.645000110.9L157 A158D155-L157 VanDerWaalsContact C-N 3.31Å; D155-L157 PolarHBondContact O-N 2.93Å; D155-A158 PolarHBondContact O-N 3.33Å
156E60Low52.6Low169 Ų169122 Ų12279%0.7968%0.684SS**THydrogen-bonded Turntrans-67.7-22.6178-87.4-167154.100114.6
157L58.7Low52.3Low136 Ų136123 Ų12371%0.71269%0.688SS**THydrogen-bonded Turntrans-90.1-14.8-178.1-167.262.6000113.1D155D155-L157 VanDerWaalsContact C-N 3.31Å; D155-L157 PolarHBondContact O-N 2.93Å
158A58.2Low51.8Low71 Ų71124.2 Ų124.259%0.58770%0.696SS**THydrogen-bonded Turntrans-83.6-22-175.600000113.4D155D155-A158 PolarHBondContact O-N 3.33Å
159E55.8Low51.3Low163 Ų163129.1 Ų129.176%0.76271%0.709SS**SBendtrans-88.4-17.5-175.9-61.4-149.215400114.6
160D53Low51.2Low152 Ų152133 Ų13381%0.81372%0.722SS**THydrogen-bonded Turntrans-92.32.8-173.8-153.733.4000115.3
161L53.1Low50.8Low164 Ų164133.5 Ų133.586%0.85973%0.734SS**THydrogen-bonded Turntrans-108.70.6179.9-159.262.8000114.1
162S50.4Low50.3Low91 Ų91135.1 Ų135.164%0.63674%0.742SS**SBendtrans-93-9.2-168.875.90000116.1
163E44.7Very low49.6Very low144 Ų144138.8 Ų138.867%0.67375%0.752SS**SBendtrans-135.5115.7-171.1-62.8-167.6164.300113.9
164H37.9Very low49.2Very low172 Ų172138.9 Ų138.980%0.79676%0.756SS**  trans85.4123.9162.8-36.8-54.1000115.2
165T35.1Very low48.5Very low141 Ų141139.9 Ų139.987%0.86576%0.762SS**  cis-171154.827.5167.20000110.6
166S32.3Very low47.8Very low94 Ų94143 Ų14366%0.65777%0.77SS**  trans-48.2153.1-171.9-173.30000119.4
167P47.9Very low47.1Very low123 Ų123141.2 Ų141.280%0.79977%0.773SS**  trans-89.9109.2176.334.8-28.4000111.4
168T47Very low46.7Very low127 Ų127140.8 Ų140.878%0.77978%0.776SS**  trans-153.682.7168.8-49.30000109.8
169D43.3Very low46.1Very low157 Ų157144.5 Ų144.584%0.8478%0.784SS**  trans-155.974.9153.5-150.45.3000109.7
170L53.1Low45.6Very low178 Ų178145.9 Ų145.993%0.93279%0.791SS**  trans-123.572.3172.3-89.7168.4000106.8
171D51.1Low45Very low148 Ų148143.7 Ų143.779%0.79178%0.779SS**  trans-172.571.7155.7-133.95.7000115.5
172L48Very low44.7Very low144 Ų144144.2 Ų144.275%0.75478%0.777SS**SBendtrans-136.47.6169.9-161.651000117.6
173F39.2Very low44.4Very low211 Ų211144.7 Ų144.793%0.92578%0.776SS**  trans-134.968.7175.1-61.4-74.7000112.2
174S48.6Very low44.4Very low94 Ų94146.7 Ų146.766%0.65778%0.783SS**  trans-101.2139.9155.4-157.10000110.2
175D42.1Very low44.7Very low132 Ų132143.3 Ų143.371%0.70678%0.779SS**  trans90.285.3159.1-54.3-9.8000118.2
176K44.8Very low45.2Very low192 Ų192145.4 Ų145.484%0.83578%0.776SS**  -179.8111.6124.2-89.4143.8-166.3166.90111.9
177P44.4Very low45.6Very low132 Ų132146.9 Ų146.986%0.85778%0.783SS**  trans-88.1101.5146.830.2-25.8000109I179P177-I179 PolarHBondContact O-N 3.48Å
178V50.7Low45.5Very low126 Ų126147.3 Ų147.376%0.76478%0.784SS**  trans-73.9103.2158.3169.10000106
179I44.5Very low45.5Very low149 Ų149149.4 Ų149.476%0.76479%0.787SS**  trans178.896.1143.7-80.4143000104.7P177 D181P177-I179 PolarHBondContact O-N 3.48Å; I179-D181 HydrophobicContact CG2-CB 4.5Å; I179-D181 PolarHBondContact O-N 2.82Å
180E46Very low45.6Very low193 Ų193153.5 Ų153.590%0.90279%0.79SS**  trans-67.1114.2156.8-86.7173.3146.300107.4
181D40.2Very low45.1Very low105 Ų105152.3 Ų152.356%0.56178%0.784SS**  trans-128.398.1153.7-164.80.9000108.2I179 T183I179-D181 HydrophobicContact CG2-CB 4.5Å; I179-D181 PolarHBondContact O-N 2.82Å; D181-T183 PolarHBondContact O-N 3.31Å; D181-T183 PolarHBondContact OD1-OG1 3.06Å
182E48Very low44.9Very low175 Ų175155.8 Ų155.882%0.81879%0.786SS**THydrogen-bonded Turntrans-68.742-178.5-106.7-122.1145.700112.6
183T44.5Very low44.9Very low102 Ų102154.9 Ų154.963%0.62679%0.786SS**THydrogen-bonded Turntrans-115.2-5.8-178.7-40.50000113.5D181D181-T183 PolarHBondContact O-N 3.31Å; D181-T183 PolarHBondContact OD1-OG1 3.06Å
184F44.4Very low45.2Very low185 Ų185152 Ų15281%0.81178%0.781SS**  trans-104.510.7-175.4-70.3-77.7000116.1K186F184-K186 PolarHBondContact O-N 2.96Å
185S44Very low45.8Very low102 Ų102152 Ų15271%0.71378%0.781SS**  trans-82.450.3173.261.10000113.1
186K44.1Very low46.3Very low185 Ų185153.1 Ų153.180%0.80479%0.787SS**SBendtrans-120.7115.9159.7-78.2-178.2-178.3172.70108.7F184 T188F184-K186 PolarHBondContact O-N 2.96Å; K186-T188 PolarHBondContact O-N 3.01Å
187P40.9Very low46.6Very low125 Ų125152.6 Ų152.681%0.81279%0.787SS**  trans-67.9110.3173.627.2-29000107.8M189P187-M189 PolarHBondContact O-N 2.71Å; P187-M189 VanDerWaalsContact O-N 3.1Å
188T47.4Very low46.9Very low132 Ų132157.5 Ų157.581%0.8179%0.79SS**  trans-47.2117.5162.5-610000107.6K186 R190K186-T188 PolarHBondContact O-N 3.01Å; T188-R190 PolarHBondContact O-N 3.46Å
189M46.1Very low47.2Very low170 Ų170160.5 Ų160.584%0.83779%0.789SS**  trans-50.6121.4178.7-67.5-134.5-51.100109P187 L191P187-M189 PolarHBondContact O-N 2.71Å; P187-M189 VanDerWaalsContact O-N 3.1Å; M189-L191 VanDerWaalsContact C-N 3.28Å; M189-L191 PolarHBondContact O-N 3Å
190R45.6Very low47.8Very low243 Ų243158.8 Ų158.892%0.91779%0.789SS**  trans-59.695168.6-67.4-114.7-138.5156.44.4107.4T188 R192T188-R190 PolarHBondContact O-N 3.46Å; R190-R192 VanDerWaalsContact C-N 3.32Å; R190-R192 PolarHBondContact O-N 2.99Å
191L43.3Very low48.1Very low153 Ų153158.2 Ų158.280%0.80178%0.784SS**  trans-6699.8166.9-165.176.3000105.5M189 V193M189-L191 VanDerWaalsContact C-N 3.28Å; M189-L191 PolarHBondContact O-N 3Å; L191-V193 PolarHBondContact O-N 2.95Å
192R46.8Very low48.2Very low222 Ų222160.5 Ų160.584%0.83883%0.833SS**  trans-56.3111.4163.4-90.1-175.7170.2162-3.1105.6R190 D194R190-R192 VanDerWaalsContact C-N 3.32Å; R190-R192 PolarHBondContact O-N 2.99Å; R192-D194 PolarHBondContact O-N 3.11Å
193V46.9Very low48.2Very low124 Ų124159.8 Ų159.875%0.75283%0.833SS**  trans-66.894.5165.5173.10000104.9L191 S195L191-V193 PolarHBondContact O-N 2.95Å; V193-S195 VanDerWaalsContact C-N 3.3Å; V193-S195 PolarHBondContact O-N 3.17Å; V193-S195 VanDerWaalsContact O-N 3.11Å
194D45.9Very low48.4Very low151 Ų151162.8 Ų162.881%0.80784%0.844SS**  trans-71.597.8162.3-80.8-22.9000106R192 D196R192-D194 PolarHBondContact O-N 3.11Å; D194-D196 PolarHBondContact O-N 3.37Å
195S60.8Low48.6Very low94 Ų94161.6 Ų161.666%0.65785%0.846SS**  trans-68108.9161.547.40000108V193V193-S195 VanDerWaalsContact C-N 3.3Å; V193-S195 PolarHBondContact O-N 3.17Å; V193-S195 VanDerWaalsContact O-N 3.11Å
196D53.2Low48.9Very low156 Ų156165.1 Ų165.183%0.83485%0.854SS**  trans-179.3156.6138.6-92.2-21.6000111.7D194D194-D196 PolarHBondContact O-N 3.37Å
197E51.3Low49.2Very low180 Ų180163.9 Ų163.984%0.84186%0.857SS**  trans91.166.5171.4-57.2178.7-178.400117.7
198Y50Low49.7Very low235 Ų235166.5 Ų166.592%0.92286%0.86SS**  trans-87.692.7146.4-87.1-89000109.5
199Y56.1Low49.9Very low189 Ų189168.9 Ų168.974%0.74186%0.864SS**  trans-93110.4163.3-134.7-66.4000108.4F201Y199-F201 AromaticContact CD1-CD2 3.47Å; Y199-F201 HydrophobicContact CD1-CD2 3.47Å; Y199-F201 VanDerWaalsContact CD1-CD2 3.47Å; Y199-F201 AromaticContact CD1-CE2 3.27Å; Y199-F201 HydrophobicContact CD1-CE2 3.27Å; Y199-F201 HydrophobicContact CD1-CG 4.36Å; Y199-F201 AromaticContact CD1-CZ 3.99Å; Y199-F201 HydrophobicContact CD1-CZ 3.99Å; Y199-F201 AromaticContact CE1-CD2 3.67Å; Y199-F201 HydrophobicContact CE1-CD2 3.67Å; Y199-F201 HydrophobicContact CE1-CE1 4.2Å; Y199-F201 AromaticContact CE1-CE2 2.94Å; Y199-F201 HydrophobicContact CE1-CE2 2.94Å; Y199-F201 AromaticContact CE1-CZ 3.27Å; Y199-F201 HydrophobicContact CE1-CZ 3.27Å; Y199-F201 HydrophobicContact CG-CE2 4.42Å; Y199-F201 AromaticContact CZ-CE2 3.87Å
200C57.9Low50.2Low114 Ų114168.8 Ų168.877%0.7787%0.866SS**  trans-89.5114.9170.8-66.30000109.4
201F52.7Low50.6Low181 Ų181162.7 Ų162.779%0.79486%0.861SS**  trans-129.7129.3156.8-76-64.1000108.7Y199Y199-F201 AromaticContact CD1-CD2 3.47Å; Y199-F201 HydrophobicContact CD1-CD2 3.47Å; Y199-F201 VanDerWaalsContact CD1-CD2 3.47Å; Y199-F201 AromaticContact CD1-CE2 3.27Å; Y199-F201 HydrophobicContact CD1-CE2 3.27Å; Y199-F201 HydrophobicContact CD1-CG 4.36Å; Y199-F201 AromaticContact CD1-CZ 3.99Å; Y199-F201 HydrophobicContact CD1-CZ 3.99Å; Y199-F201 AromaticContact CE1-CD2 3.67Å; Y199-F201 HydrophobicContact CE1-CD2 3.67Å; Y199-F201 HydrophobicContact CE1-CE1 4.2Å; Y199-F201 AromaticContact CE1-CE2 2.94Å; Y199-F201 HydrophobicContact CE1-CE2 2.94Å; Y199-F201 AromaticContact CE1-CZ 3.27Å; Y199-F201 HydrophobicContact CE1-CZ 3.27Å; Y199-F201 HydrophobicContact CG-CE2 4.42Å; Y199-F201 AromaticContact CZ-CE2 3.87Å
202G41.7Very low51.2Low153 Ų153163.5 Ų163.5100%1.57787%0.867SS**  trans148.10177.100000111.1

Retrieved 202 of 202 residues in 901.4 ms (Link to these results)