A0A087XCN0_POEFO Loading...

CTTNBP2 N-terminal like

AlphaFold DB , UniProt , Accession A0A087XCN0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 590 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
1M47.2Very low47.8Very low215 Ų215144.6 Ų144.6100%1.05968%0.679SS**  0-29.30-81.5-145.9-88.200114.4
2L46.4Very low47.8Very low138 Ų138146.3 Ų146.372%0.72369%0.691SS**Hα-helixtrans-70.2-32.2175.1-89.379.1000114F4 R5 N6L2-F4 PolarHBondContact O-N 3.01Å; L2-R5 PolarHBondContact O-N 3.4Å; L2-N6 PolarHBondContact O-N 3.33Å
3E48.3Very low47.6Very low165 Ų165148.9 Ų148.977%0.77170%0.698SS**Hα-helixtrans-66.5-33.9178.5-69.4-91.9134.700113.2G7E3-G7 PolarHBondContact O-N 2.79Å
4F47.8Very low47.9Very low185 Ų185145.7 Ų145.781%0.81169%0.693SS**Hα-helixtrans-76-31177.4-113.3-91.7000112.6L2 G7 L8L2-F4 PolarHBondContact O-N 3.01Å; F4-G7 PolarHBondContact O-N 3.43Å; F4-L8 PolarHBondContact O-N 3.12Å
5R48.5Very low48.6Very low183 Ų183149.9 Ų149.969%0.69171%0.708SS**Hα-helixtrans-69.2-42175.7-161.6178.1-137.7-166.53111.4L2 G7 L8 E9L2-R5 PolarHBondContact O-N 3.4Å; R5-G7 VanDerWaalsContact C-N 3.27Å; R5-G7 PolarHBondContact O-N 2.68Å; R5-L8 PolarHBondContact O-N 2.78Å; R5-E9 PolarHBondContact O-N 2.8Å
6N48.1Very low49.1Very low76 Ų76146 Ų14641%0.40670%0.696SS.*Hα-helixtrans-72.6-18.4178.1-66.1-10.6000113.2L2 R10L2-N6 PolarHBondContact O-N 3.33Å; N6-R10 WeakPolarHBondContact O-CG 3.32Å; N6-R10 PolarHBondContact O-NE 3Å
7G46.9Very low49.9Very low31 Ų31142.7 Ų142.732%0.3268%0.684SS.*Hα-helixtrans-78.4-39.317300000113E3 F4 R5 R10 H11E3-G7 PolarHBondContact O-N 2.79Å; F4-G7 PolarHBondContact O-N 3.43Å; R5-G7 VanDerWaalsContact C-N 3.27Å; R5-G7 PolarHBondContact O-N 2.68Å; G7-R10 PolarHBondContact O-N 3.43Å; G7-H11 PolarHBondContact O-N 2.84Å
8L50.6Low50.8Low128 Ų128141.8 Ų141.867%0.6768%0.681SS**Hα-helixtrans-75.4-36.7-179.3-152.274.3000112.3F4 R5 R10 H11 M12F4-L8 PolarHBondContact O-N 3.12Å; R5-L8 PolarHBondContact O-N 2.78Å; L8-R10 PolarHBondContact O-N 3.39Å; L8-H11 PolarHBondContact O-N 2.73Å; L8-M12 PolarHBondContact O-N 3.15Å
9E46.1Very low51.7Low131 Ų131144.2 Ų144.261%0.61269%0.691SS**Hα-helixtrans-64.8-27.8171.6-80.7-176.316600113R5R5-E9 PolarHBondContact O-N 2.8Å
10R48.3Very low52.9Low185 Ų185140.9 Ų140.970%0.69868%0.684SS**Hα-helixtrans-78.4-22.4175.1-79-174.4-79.4164.8-6.4113.2N6 G7 L8N6-R10 WeakPolarHBondContact O-CG 3.32Å; N6-R10 PolarHBondContact O-NE 3Å; G7-R10 PolarHBondContact O-N 3.43Å; L8-R10 PolarHBondContact O-N 3.39Å
11H47.4Very low54.2Low154 Ų154136.1 Ų136.171%0.71366%0.661SS**Hα-helixtrans-93.5-17.4-179-126.869000114.4G7 L8 K13 T14G7-H11 PolarHBondContact O-N 2.84Å; L8-H11 PolarHBondContact O-N 2.73Å; H11-K13 VanDerWaalsContact C-N 3.31Å; H11-T14 PolarHBondContact O-OG1 2.78Å
12M48Very low56Low165 Ų165128.4 Ų128.481%0.81363%0.628SS**THydrogen-bonded Turntrans-88.6-1.9171.5-68.9-112.6132.400112.9L8 T14L8-M12 PolarHBondContact O-N 3.15Å; M12-T14 PolarHBondContact O-N 3.3Å
13K45.7Very low57.9Low180 Ų180130 Ų13078%0.78363%0.63SS**THydrogen-bonded Turntrans-88.717.9173.3-147.6158.1-172.5167.60112.4H11 K15H11-K13 VanDerWaalsContact C-N 3.31Å; K13-K15 PolarHBondContact O-N 3.35Å
14T51.4Low60Low104 Ų104126.6 Ų126.664%0.63862%0.621SS**SBendtrans-75.4110.4157.90.20000106.8H11 M12 V16H11-T14 PolarHBondContact O-OG1 2.78Å; M12-T14 PolarHBondContact O-N 3.3Å; T14-V16 VanDerWaalsContact C-N 3.3Å; T14-V16 PolarHBondContact O-N 2.78Å
15K58.3Low61.9Low209 Ų209122 Ų12291%0.90960%0.603SS**  trans-54.385.2178.8-70.9172.6172.9177.90111.4K13 N17K13-K15 PolarHBondContact O-N 3.35Å; K15-N17 PolarHBondContact O-N 2.79Å
16V57.7Low63.7Low87 Ų87116.5 Ų116.553%0.52759%0.586SS.*  trans-79102.4155.4-1640000104.5T14 M18 L21T14-V16 VanDerWaalsContact C-N 3.3Å; T14-V16 PolarHBondContact O-N 2.78Å; V16-M18 VanDerWaalsContact C-N 3.35Å; V16-M18 PolarHBondContact O-N 3.41Å; V16-L21 HydrophobicContact CG1-CD1 4.29Å; V16-L21 HydrophobicContact CG1-CD2 3.76Å; V16-L21 HydrophobicContact CG1-CG 4.38Å
17N62.2Low65.7Low90 Ų90117.7 Ų117.748%0.48159%0.592SS.*  trans-66.697.5-179.8-171.310.2000108.1K15 E19 S20K15-N17 PolarHBondContact O-N 2.79Å; N17-E19 PolarHBondContact O-N 2.8Å; N17-S20 WeakPolarHBondContact CB-OG 3.44Å; N17-S20 PolarHBondContact O-N 3.34Å; N17-S20 PolarHBondContact O-OG 3.43Å
18M65.6Low67.8Low127 Ų127121.9 Ų121.963%0.62661%0.605SS**THydrogen-bonded Turntrans-57.3-23.7-173.8-73.1-90.5157.800112.7V16 L29V16-M18 VanDerWaalsContact C-N 3.35Å; V16-M18 PolarHBondContact O-N 3.41Å; M18-L29 HydrophobicContact CE-CD2 3.79Å; M18-L29 HydrophobicContact SD-CD2 4.2Å
19E67.6Low69.7Low186 Ų186118 Ų11887%0.86959%0.585SS**THydrogen-bonded Turntrans-85.3-12.3-179.4-64.5165.7178.800113.1N17N17-E19 PolarHBondContact O-N 2.8Å
20S76.7Confident71.8Confident79 Ų79117.5 Ų117.555%0.55258%0.581SS**SBendtrans-113.812.5-178.175.80000114.2N17N17-S20 WeakPolarHBondContact CB-OG 3.44Å; N17-S20 PolarHBondContact O-N 3.34Å; N17-S20 PolarHBondContact O-OG 3.43Å
21L79.8Confident73.9Confident41 Ų41112.3 Ų112.322%0.21557%0.573CS.*  trans-75.1130.1178.1-68.8174.7000110.6V16 E25 L26 L29V16-L21 HydrophobicContact CG1-CD1 4.29Å; V16-L21 HydrophobicContact CG1-CD2 3.76Å; V16-L21 HydrophobicContact CG1-CG 4.38Å; L21-E25 HydrophobicContact CB-CB 4.46Å; L21-E25 HydrophobicContact CD2-CB 4.09Å; L21-L26 HydrophobicContact CB-CB 4.43Å; L21-L26 HydrophobicContact CD1-CD1 4.41Å; L21-L29 HydrophobicContact CD1-CD2 4.02Å
22S85.2Confident76Confident53 Ų53109.9 Ų109.937%0.37156%0.564SS.*  trans-68.3155.1170.968.60000110.4P24 E25 L26S22-P24 VanDerWaalsContact C-CD 3.42Å; S22-P24 VanDerWaalsContact C-N 3.33Å; S22-P24 WeakPolarHBondContact OG-CD 3.27Å; S22-E25 WeakPolarHBondContact CB-OE2 3.3Å; S22-E25 PolarHBondContact N-OE2 3.4Å; S22-E25 PolarHBondContact O-N 3.18Å; S22-E25 WeakPolarHBondContact OG-CG 3.39Å; S22-E25 PolarHBondContact OG-OE2 2.88Å; S22-L26 PolarHBondContact O-N 2.68Å
23K86.4Confident78.1Confident172 Ų172106.1 Ų106.175%0.74855%0.547SS*.Hα-helixtrans-46.9-44.4179.1-171.3177.7179.4-178.40114.5L27K23-L27 HydrophobicContact CG-CD1 4.44Å; K23-L27 WeakPolarHBondContact O-CG 3.38Å; K23-L27 PolarHBondContact O-N 2.87Å
24P91Very high80.4Confident92 Ų92103 Ų10360%0.59754%0.535SS*.Hα-helixtrans-69.1-35.4177.526.4-34.6000113.4S22 L27 M28S22-P24 VanDerWaalsContact C-CD 3.42Å; S22-P24 VanDerWaalsContact C-N 3.33Å; S22-P24 WeakPolarHBondContact OG-CD 3.27Å; P24-L27 PolarHBondContact O-N 3.31Å; P24-M28 WeakPolarHBondContact O-CB 3.4Å; P24-M28 PolarHBondContact O-N 2.82Å
25E88.1Confident82.5Confident89 Ų8999.7 Ų99.742%0.41652%0.521SS..Hα-helixtrans-68.8-38.2178.3-66.1166.3140.900111.6L21 S22 M28 L29L21-E25 HydrophobicContact CB-CB 4.46Å; L21-E25 HydrophobicContact CD2-CB 4.09Å; S22-E25 WeakPolarHBondContact CB-OE2 3.3Å; S22-E25 PolarHBondContact N-OE2 3.4Å; S22-E25 PolarHBondContact O-N 3.18Å; S22-E25 WeakPolarHBondContact OG-CG 3.39Å; S22-E25 PolarHBondContact OG-OE2 2.88Å; E25-M28 PolarHBondContact O-N 2.85Å; E25-L29 WeakPolarHBondContact O-CB 3.28Å; E25-L29 PolarHBondContact O-N 3.38Å
26L87.3Confident84.2Confident67 Ų6793.7 Ų93.735%0.35150%0.496SS..Hα-helixtrans-65.7-41.9175.6-176.862.4000111.9L21 S22 L29 F30L21-L26 HydrophobicContact CB-CB 4.43Å; L21-L26 HydrophobicContact CD1-CD1 4.41Å; S22-L26 PolarHBondContact O-N 2.68Å; L26-L29 PolarHBondContact O-N 3.33Å; L26-F30 HydrophobicContact CD1-CD2 4.05Å; L26-F30 HydrophobicContact CD1-CE2 3.53Å; L26-F30 HydrophobicContact CD1-CZ 4.09Å; L26-F30 HydrophobicContact CD2-CE2 3.99Å; L26-F30 HydrophobicContact CG-CD2 3.85Å; L26-F30 HydrophobicContact CG-CE2 3.52Å; L26-F30 HydrophobicContact CG-CZ 4.5Å; L26-F30 WeakPolarHBondContact O-CD2 3.3Å; L26-F30 PolarHBondContact O-N 2.98Å
27L89.9Confident85.9Confident101 Ų10194.5 Ų94.553%0.52950%0.497SS..Hα-helixtrans-63.5-43.5175.6-74.9171.1000111.8K23 P24 L29 F30 S31K23-L27 HydrophobicContact CG-CD1 4.44Å; K23-L27 WeakPolarHBondContact O-CG 3.38Å; K23-L27 PolarHBondContact O-N 2.87Å; P24-L27 PolarHBondContact O-N 3.31Å; L27-L29 VanDerWaalsContact C-N 3.33Å; L27-L29 PolarHBondContact O-N 3.26Å; L27-F30 PolarHBondContact O-N 3.46Å; L27-S31 PolarHBondContact O-N 2.93Å; L27-S31 PolarHBondContact O-OG 3.31Å
28M91.6Very high87.5Confident119 Ų11995.4 Ų95.459%0.58650%0.499SS*.Hα-helixtrans-60.3-42.5175.5178.9173.354.300111.8P24 E25 S31 I32P24-M28 WeakPolarHBondContact O-CB 3.4Å; P24-M28 PolarHBondContact O-N 2.82Å; E25-M28 PolarHBondContact O-N 2.85Å; M28-S31 PolarHBondContact O-N 3.25Å; M28-I32 HydrophobicContact CG-CD1 4.21Å; M28-I32 WeakPolarHBondContact O-CG1 3.42Å; M28-I32 PolarHBondContact O-N 3.24Å; M28-I32 VanDerWaalsContact O-N 3.08Å
29L88.7Confident88.9Confident48 Ų4892 Ų9225%0.25149%0.491SS..Hα-helixtrans-63-43.5175.6179.762.6000111.9M18 L21 E25 L26 L27 S31 I32 L33M18-L29 HydrophobicContact CE-CD2 3.79Å; M18-L29 HydrophobicContact SD-CD2 4.2Å; L21-L29 HydrophobicContact CD1-CD2 4.02Å; E25-L29 WeakPolarHBondContact O-CB 3.28Å; E25-L29 PolarHBondContact O-N 3.38Å; L26-L29 PolarHBondContact O-N 3.33Å; L27-L29 VanDerWaalsContact C-N 3.33Å; L27-L29 PolarHBondContact O-N 3.26Å; L29-S31 PolarHBondContact O-N 2.78Å; L29-I32 PolarHBondContact O-N 2.85Å; L29-L33 HydrophobicContact CD1-CD1 4.24Å; L29-L33 HydrophobicContact CD1-CG 4.29Å; L29-L33 HydrophobicContact CG-CD1 4.05Å; L29-L33 WeakPolarHBondContact O-CG 3.26Å; L29-L33 PolarHBondContact O-N 3.44Å
30F90.1Very high90.1Very high120 Ų12090.2 Ų90.253%0.52648%0.476SS..Hα-helixtrans-62.5-41.2176.1-79.7-54.9000112.5L26 L27 I32 L33 E34L26-F30 HydrophobicContact CD1-CD2 4.05Å; L26-F30 HydrophobicContact CD1-CE2 3.53Å; L26-F30 HydrophobicContact CD1-CZ 4.09Å; L26-F30 HydrophobicContact CD2-CE2 3.99Å; L26-F30 HydrophobicContact CG-CD2 3.85Å; L26-F30 HydrophobicContact CG-CE2 3.52Å; L26-F30 HydrophobicContact CG-CZ 4.5Å; L26-F30 WeakPolarHBondContact O-CD2 3.3Å; L26-F30 PolarHBondContact O-N 2.98Å; L27-F30 PolarHBondContact O-N 3.46Å; F30-I32 VanDerWaalsContact C-N 3.31Å; F30-I32 PolarHBondContact O-N 2.83Å; F30-L33 PolarHBondContact O-N 3.37Å; F30-E34 WeakPolarHBondContact O-CB 3.46Å; F30-E34 PolarHBondContact O-N 2.76Å
31S92.4Very high91Very high76 Ų7690.7 Ų90.753%0.53147%0.473SS..Hα-helixtrans-62.3-37.5175.6-61.30000112.6L27 M28 L29 G35L27-S31 PolarHBondContact O-N 2.93Å; L27-S31 PolarHBondContact O-OG 3.31Å; M28-S31 PolarHBondContact O-N 3.25Å; L29-S31 PolarHBondContact O-N 2.78Å; S31-G35 PolarHBondContact O-N 3.33Å; S31-G35 VanDerWaalsContact O-N 3.12Å
32I92.3Very high91.7Very high103 Ų10393.3 Ų93.353%0.52849%0.49SS..Hα-helixtrans-67.9-45.9175.8-66.9165.7000110.8M28 L29 F30 E34 G35 E36M28-I32 HydrophobicContact CG-CD1 4.21Å; M28-I32 WeakPolarHBondContact O-CG1 3.42Å; M28-I32 PolarHBondContact O-N 3.24Å; M28-I32 VanDerWaalsContact O-N 3.08Å; L29-I32 PolarHBondContact O-N 2.85Å; F30-I32 VanDerWaalsContact C-N 3.31Å; F30-I32 PolarHBondContact O-N 2.83Å; I32-E34 VanDerWaalsContact C-N 3.34Å; I32-E34 PolarHBondContact O-N 2.91Å; I32-G35 PolarHBondContact O-N 3.28Å; I32-E36 PolarHBondContact O-N 2.86Å
33L92.7Very high92.2Very high85 Ų8594.8 Ų94.845%0.44550%0.497SS..Hα-helixtrans-65.4-36.5179.8-70173.2000112.3L29 F30 E36 L37L29-L33 HydrophobicContact CD1-CD1 4.24Å; L29-L33 HydrophobicContact CD1-CG 4.29Å; L29-L33 HydrophobicContact CG-CD1 4.05Å; L29-L33 WeakPolarHBondContact O-CG 3.26Å; L29-L33 PolarHBondContact O-N 3.44Å; F30-L33 PolarHBondContact O-N 3.37Å; L33-E36 PolarHBondContact O-N 3.48Å; L33-L37 WeakPolarHBondContact O-CB 3.29Å; L33-L37 PolarHBondContact O-N 3.36Å
34E93.1Very high92.5Very high115 Ų11590.4 Ų90.454%0.53748%0.48SS..Hα-helixtrans-62.7-47.5173-177.9178.8-17200111.3F30 I32 E36 L37 Q38F30-E34 WeakPolarHBondContact O-CB 3.46Å; F30-E34 PolarHBondContact O-N 2.76Å; I32-E34 VanDerWaalsContact C-N 3.34Å; I32-E34 PolarHBondContact O-N 2.91Å; E34-E36 VanDerWaalsContact C-N 3.34Å; E34-E36 PolarHBondContact O-N 2.94Å; E34-L37 PolarHBondContact O-N 3.1Å; E34-Q38 WeakPolarHBondContact O-CG 3.31Å; E34-Q38 PolarHBondContact O-N 3.31Å
35G95.1Very high92.8Very high34 Ų3492.7 Ų92.735%0.35148%0.483SS..Hα-helixtrans-62.9-37.9176.600000113.1S31 I32 A39S31-G35 PolarHBondContact O-N 3.33Å; S31-G35 VanDerWaalsContact O-N 3.12Å; I32-G35 PolarHBondContact O-N 3.28Å; G35-A39 WeakPolarHBondContact O-CB 3.49Å; G35-A39 PolarHBondContact O-N 3.16Å
36E93.9Very high93Very high83 Ų8391.3 Ų91.339%0.38849%0.487SS..Hα-helixtrans-65.9-42.1176-169.9-17613700111.8I32 L33 E34 A39 R40I32-E36 PolarHBondContact O-N 2.86Å; L33-E36 PolarHBondContact O-N 3.48Å; E34-E36 VanDerWaalsContact C-N 3.34Å; E34-E36 PolarHBondContact O-N 2.94Å; E36-A39 PolarHBondContact O-N 3.44Å; E36-R40 WeakPolarHBondContact O-CG 3.23Å; E36-R40 PolarHBondContact O-N 3.16Å; E36-R40 IonicContact OE1-CZ 3.47Å; E36-R40 IonicContact OE1-NE 2.74Å; E36-R40 PolarHBondContact OE1-NE 3.35Å; E36-R40 IonicContact OE1-NH2 3.39Å; E36-R40 PolarHBondContact OE1-NH2 3.45Å
37L94.9Very high93.3Very high104 Ų10492.4 Ų92.455%0.54549%0.493SS..Hα-helixtrans-63.1-47.3177.3-172.967.9000111L33 E34 A39 R40 D41L33-L37 WeakPolarHBondContact O-CB 3.29Å; L33-L37 PolarHBondContact O-N 3.36Å; E34-L37 PolarHBondContact O-N 3.1Å; L37-A39 VanDerWaalsContact C-N 3.33Å; L37-A39 PolarHBondContact O-N 2.95Å; L37-R40 WeakPolarHBondContact O-CB 3.34Å; L37-R40 PolarHBondContact O-N 2.84Å; L37-R40 VanDerWaalsContact O-N 3.14Å; L37-D41 PolarHBondContact O-N 3.48Å
38Q95.9Very high93.5Very high110 Ų11094.7 Ų94.751%0.51450%0.499SS..Hα-helixtrans-59-42.9176.9-71.7172.2-2.200112E34 R40 D41 V42E34-Q38 WeakPolarHBondContact O-CG 3.31Å; E34-Q38 PolarHBondContact O-N 3.31Å; Q38-R40 VanDerWaalsContact C-N 3.32Å; Q38-R40 PolarHBondContact O-N 3.23Å; Q38-D41 PolarHBondContact O-N 2.88Å; Q38-V42 WeakPolarHBondContact O-CG2 3.42Å; Q38-V42 PolarHBondContact O-N 2.89Å; Q38-V42 VanDerWaalsContact O-N 3.14Å
39A93.4Very high93.5Very high56 Ų5691.8 Ų91.846%0.46349%0.494SS..Hα-helixtrans-63.2-38.1176.900000112.4G35 E36 L37 V42 V43G35-A39 WeakPolarHBondContact O-CB 3.49Å; G35-A39 PolarHBondContact O-N 3.16Å; E36-A39 PolarHBondContact O-N 3.44Å; L37-A39 VanDerWaalsContact C-N 3.33Å; L37-A39 PolarHBondContact O-N 2.95Å; A39-V42 PolarHBondContact O-N 3.34Å; A39-V43 WeakPolarHBondContact O-CG2 3.22Å; A39-V43 PolarHBondContact O-N 3.34Å
40R93.9Very high93.6Very high147 Ų14795 Ų9556%0.55551%0.507SS*.Hα-helixtrans-65.6-41.1175.3-71.1173.1-179.5-153.22111.8E36 L37 Q38 V42 V43 I44E36-R40 WeakPolarHBondContact O-CG 3.23Å; E36-R40 PolarHBondContact O-N 3.16Å; E36-R40 IonicContact OE1-CZ 3.47Å; E36-R40 IonicContact OE1-NE 2.74Å; E36-R40 PolarHBondContact OE1-NE 3.35Å; E36-R40 IonicContact OE1-NH2 3.39Å; E36-R40 PolarHBondContact OE1-NH2 3.45Å; L37-R40 WeakPolarHBondContact O-CB 3.34Å; L37-R40 PolarHBondContact O-N 2.84Å; L37-R40 VanDerWaalsContact O-N 3.14Å; Q38-R40 VanDerWaalsContact C-N 3.32Å; Q38-R40 PolarHBondContact O-N 3.23Å; R40-V42 VanDerWaalsContact C-N 3.34Å; R40-V42 PolarHBondContact O-N 2.89Å; R40-V43 PolarHBondContact O-N 3.2Å; R40-I44 VanDerWaalsContact O-CG1 3.3Å; R40-I44 WeakPolarHBondContact O-CG1 3.35Å; R40-I44 PolarHBondContact O-N 2.64Å
41D94.4Very high93.6Very high90 Ų9093.3 Ų93.348%0.48151%0.509SS..Hα-helixtrans-61.2-42.9177.8-74.7-25.8000111.6L37 Q38 V43 I44 E45L37-D41 PolarHBondContact O-N 3.48Å; Q38-D41 PolarHBondContact O-N 2.88Å; D41-V43 VanDerWaalsContact C-N 3.34Å; D41-V43 PolarHBondContact O-N 2.7Å; D41-I44 PolarHBondContact O-N 3.26Å; D41-E45 PolarHBondContact O-N 3.44Å
42V94.6Very high93.4Very high96 Ų9696.5 Ų96.558%0.58251%0.513SS*.Hα-helixtrans-60.5-42.4175.2173.60000111.7Q38 A39 R40 E45 A46Q38-V42 WeakPolarHBondContact O-CG2 3.42Å; Q38-V42 PolarHBondContact O-N 2.89Å; Q38-V42 VanDerWaalsContact O-N 3.14Å; A39-V42 PolarHBondContact O-N 3.34Å; R40-V42 VanDerWaalsContact C-N 3.34Å; R40-V42 PolarHBondContact O-N 2.89Å; V42-E45 PolarHBondContact O-N 3.41Å; V42-A46 PolarHBondContact O-N 3.46Å
43V95.7Very high93Very high83 Ų8398 Ų9850%0.50352%0.519SS..Hα-helixtrans-67.8-40.4177.9172.60000111.5A39 R40 D41 E45 A46 L47A39-V43 WeakPolarHBondContact O-CG2 3.22Å; A39-V43 PolarHBondContact O-N 3.34Å; R40-V43 PolarHBondContact O-N 3.2Å; D41-V43 VanDerWaalsContact C-N 3.34Å; D41-V43 PolarHBondContact O-N 2.7Å; V43-E45 VanDerWaalsContact C-N 3.31Å; V43-E45 PolarHBondContact O-N 2.86Å; V43-A46 PolarHBondContact O-N 3.02Å; V43-L47 HydrophobicContact CG1-CD1 3.92Å; V43-L47 HydrophobicContact CG1-CG 4.31Å; V43-L47 WeakPolarHBondContact O-CB 3.49Å; V43-L47 VanDerWaalsContact O-CG 3.3Å; V43-L47 WeakPolarHBondContact O-CG 3.38Å; V43-L47 PolarHBondContact O-N 3.35Å
44I94.2Very high92.7Very high80 Ų8098.4 Ų98.441%0.4152%0.52SS..Hα-helixtrans-62.3-42176.2-70.5166000110.4R40 D41 L47 K48R40-I44 VanDerWaalsContact O-CG1 3.3Å; R40-I44 WeakPolarHBondContact O-CG1 3.35Å; R40-I44 PolarHBondContact O-N 2.64Å; D41-I44 PolarHBondContact O-N 3.26Å; I44-L47 PolarHBondContact O-N 2.96Å; I44-K48 HydrophobicContact CG2-CD 4.12Å; I44-K48 HydrophobicContact CG2-CG 4.46Å; I44-K48 WeakPolarHBondContact O-CB 3.34Å; I44-K48 VanDerWaalsContact O-CG 3.32Å; I44-K48 WeakPolarHBondContact O-CG 3.3Å; I44-K48 PolarHBondContact O-N 2.96Å
45E95.6Very high92.3Very high141 Ų14198.5 Ų98.566%0.65952%0.519SS*.Hα-helixtrans-62.5-45.9176.1-171.9171.3-168.300111.6D41 V42 V43 L47 K48 A49D41-E45 PolarHBondContact O-N 3.44Å; V42-E45 PolarHBondContact O-N 3.41Å; V43-E45 VanDerWaalsContact C-N 3.31Å; V43-E45 PolarHBondContact O-N 2.86Å; E45-L47 PolarHBondContact O-N 3.29Å; E45-K48 PolarHBondContact O-N 3.3Å; E45-A49 PolarHBondContact O-N 3.44Å
46A94Very high91.7Very high60 Ų60100.5 Ų100.550%0.49652%0.521SS..Hα-helixtrans-60.6-43.2175.700000112.5V42 V43 A49 Q50V42-A46 PolarHBondContact O-N 3.46Å; V43-A46 PolarHBondContact O-N 3.02Å; A46-A49 PolarHBondContact O-N 2.97Å; A46-Q50 WeakPolarHBondContact O-CB 3.47Å; A46-Q50 PolarHBondContact O-N 2.91Å
47L93.9Very high91Very high90 Ų90102.5 Ų102.547%0.47153%0.53SS..Hα-helixtrans-66.5-39.9177.1-72.4172.4000111.9V43 I44 E45 A49 Q50 C51V43-L47 HydrophobicContact CG1-CD1 3.92Å; V43-L47 HydrophobicContact CG1-CG 4.31Å; V43-L47 WeakPolarHBondContact O-CB 3.49Å; V43-L47 VanDerWaalsContact O-CG 3.3Å; V43-L47 WeakPolarHBondContact O-CG 3.38Å; V43-L47 PolarHBondContact O-N 3.35Å; I44-L47 PolarHBondContact O-N 2.96Å; E45-L47 PolarHBondContact O-N 3.29Å; L47-A49 VanDerWaalsContact C-N 3.34Å; L47-Q50 PolarHBondContact O-N 3.14Å; L47-C51 WeakPolarHBondContact O-CB 3.41Å; L47-C51 PolarHBondContact O-N 2.92Å; L47-C51 PolarHBondContact O-SG 2.91Å; L47-C51 VanDerWaalsContact O-SG 3.35Å
48K92.7Very high90.3Very high149 Ų149104.7 Ų104.765%0.64854%0.538SS*.Hα-helixtrans-62.2-41.9173.7-78.1176.4176.9176.30111.7I44 E45 C51 K52I44-K48 HydrophobicContact CG2-CD 4.12Å; I44-K48 HydrophobicContact CG2-CG 4.46Å; I44-K48 WeakPolarHBondContact O-CB 3.34Å; I44-K48 VanDerWaalsContact O-CG 3.32Å; I44-K48 WeakPolarHBondContact O-CG 3.3Å; I44-K48 PolarHBondContact O-N 2.96Å; E45-K48 PolarHBondContact O-N 3.3Å; K48-C51 PolarHBondContact O-N 3.31Å; K48-K52 WeakPolarHBondContact O-CB 3.43Å; K48-K52 PolarHBondContact O-N 3.46Å
49A91.8Very high89.2Confident58 Ų58104.7 Ų104.748%0.47954%0.538SS..Hα-helixtrans-63-44.5175.500000111.3E45 A46 L47 C51 K52 E53E45-A49 PolarHBondContact O-N 3.44Å; A46-A49 PolarHBondContact O-N 2.97Å; L47-A49 VanDerWaalsContact C-N 3.34Å; A49-C51 PolarHBondContact O-N 2.91Å; A49-K52 WeakPolarHBondContact O-CB 3.31Å; A49-K52 PolarHBondContact O-N 3.21Å; A49-E53 PolarHBondContact O-N 3.4Å
50Q90.7Very high88Confident115 Ų115109.3 Ų109.354%0.53754%0.544SS..Hα-helixtrans-63.3-42.2176.8-169.1177.930.900112.4A46 L47 K52 E53 L54A46-Q50 WeakPolarHBondContact O-CB 3.47Å; A46-Q50 PolarHBondContact O-N 2.91Å; L47-Q50 PolarHBondContact O-N 3.14Å; Q50-K52 VanDerWaalsContact C-N 3.29Å; Q50-K52 PolarHBondContact O-N 3.01Å; Q50-E53 PolarHBondContact O-N 3.28Å; Q50-L54 HydrophobicContact CG-CD1 4.38Å; Q50-L54 WeakPolarHBondContact O-CB 3.39Å; Q50-L54 WeakPolarHBondContact O-CG 3.48Å; Q50-L54 PolarHBondContact O-N 2.73Å
51C89.7Confident86.6Confident84 Ų84104.2 Ų104.257%0.56854%0.538SS*.Hα-helixtrans-62-38174.2-73.40000112L47 K48 A49 F55L47-C51 WeakPolarHBondContact O-CB 3.41Å; L47-C51 PolarHBondContact O-N 2.92Å; L47-C51 PolarHBondContact O-SG 2.91Å; L47-C51 VanDerWaalsContact O-SG 3.35Å; K48-C51 PolarHBondContact O-N 3.31Å; A49-C51 PolarHBondContact O-N 2.91Å; C51-F55 VanDerWaalsContact O-CB 3.26Å; C51-F55 WeakPolarHBondContact O-CB 3.37Å; C51-F55 PolarHBondContact O-N 2.96Å
52K88.5Confident85Confident143 Ų143110.7 Ų110.762%0.62256%0.556SS**Hα-helixtrans-66.4-43.8176-172.6-178.2177.8-1750111.7K48 A49 Q50 F55 I56K48-K52 WeakPolarHBondContact O-CB 3.43Å; K48-K52 PolarHBondContact O-N 3.46Å; A49-K52 WeakPolarHBondContact O-CB 3.31Å; A49-K52 PolarHBondContact O-N 3.21Å; Q50-K52 VanDerWaalsContact C-N 3.29Å; Q50-K52 PolarHBondContact O-N 3.01Å; K52-F55 PolarHBondContact O-N 3.21Å; K52-I56 HydrophobicContact CG-CD1 4.09Å; K52-I56 VanDerWaalsContact O-CG1 3.27Å; K52-I56 WeakPolarHBondContact O-CG1 3.31Å; K52-I56 PolarHBondContact O-N 2.92Å
53E84.6Confident83.4Confident136 Ų136114.4 Ų114.464%0.63656%0.56SS**Hα-helixtrans-59.1-48.4175.4-16678.2-145.800110.9A49 Q50 F55 I56 Q57A49-E53 PolarHBondContact O-N 3.4Å; Q50-E53 PolarHBondContact O-N 3.28Å; E53-F55 PolarHBondContact O-N 3.38Å; E53-I56 PolarHBondContact O-N 3.04Å; E53-Q57 WeakPolarHBondContact O-CB 3.39Å; E53-Q57 PolarHBondContact O-N 3.41Å
54L85.1Confident81.6Confident93 Ų93117 Ų11749%0.48757%0.572SS.*Hα-helixtrans-63.5-42177.5-73173.8000112.2Q50 I56 Q57 E58Q50-L54 HydrophobicContact CG-CD1 4.38Å; Q50-L54 WeakPolarHBondContact O-CB 3.39Å; Q50-L54 WeakPolarHBondContact O-CG 3.48Å; Q50-L54 PolarHBondContact O-N 2.73Å; L54-I56 VanDerWaalsContact C-N 3.33Å; L54-I56 PolarHBondContact O-N 3.34Å; L54-Q57 PolarHBondContact O-N 2.93Å; L54-E58 WeakPolarHBondContact O-CB 3.34Å; L54-E58 PolarHBondContact O-N 2.89Å
55F86.1Confident80.1Confident116 Ų116121.4 Ų121.451%0.50960%0.595SS.*Hα-helixtrans-60.5-43.4175.9177-95.4000111.5C51 K52 E53 E58 H59C51-F55 VanDerWaalsContact O-CB 3.26Å; C51-F55 WeakPolarHBondContact O-CB 3.37Å; C51-F55 PolarHBondContact O-N 2.96Å; K52-F55 PolarHBondContact O-N 3.21Å; E53-F55 PolarHBondContact O-N 3.38Å; F55-E58 PolarHBondContact O-N 3.49Å; F55-H59 AromaticContact CD2-CD2 3.7Å; F55-H59 AromaticContact CE2-CD2 3.35Å; F55-H59 WeakPolarHBondContact CE2-CD2 3.41Å; F55-H59 AromaticContact CE2-NE2 3.45Å; F55-H59 WeakPolarHBondContact CE2-NE2 3.42Å; F55-H59 AromaticContact CZ-CD2 3.69Å; F55-H59 AromaticContact CZ-NE2 3.96Å; F55-H59 WeakPolarHBondContact O-CB 3.36Å; F55-H59 PolarHBondContact O-N 3.34Å; F55-H59 VanDerWaalsContact O-N 3.09Å
56I81.6Confident78.5Confident77 Ų77118.9 Ų118.940%0.39559%0.593SS.*Hα-helixtrans-65.7-43.7175.9-67.3166.4000110.3K52 E53 L54 E58 Y60 G61K52-I56 HydrophobicContact CG-CD1 4.09Å; K52-I56 VanDerWaalsContact O-CG1 3.27Å; K52-I56 WeakPolarHBondContact O-CG1 3.31Å; K52-I56 PolarHBondContact O-N 2.92Å; E53-I56 PolarHBondContact O-N 3.04Å; L54-I56 VanDerWaalsContact C-N 3.33Å; L54-I56 PolarHBondContact O-N 3.34Å; I56-E58 PolarHBondContact O-N 3.11Å; I56-Y60 HydrophobicContact CG2-CD2 4.38Å; I56-Y60 WeakPolarHBondContact O-CA 3.46Å; I56-Y60 VanDerWaalsContact O-CB 3.32Å; I56-Y60 WeakPolarHBondContact O-CB 3.42Å; I56-Y60 PolarHBondContact O-N 2.96Å; I56-G61 PolarHBondContact O-N 2.96Å
57Q79.8Confident77Confident124 Ų124119.7 Ų119.758%0.57959%0.589SS**Hα-helixtrans-64.3-37.4178.3-170.5176.524.600112.6E53 L54 G61E53-Q57 WeakPolarHBondContact O-CB 3.39Å; E53-Q57 PolarHBondContact O-N 3.41Å; L54-Q57 PolarHBondContact O-N 2.93Å; Q57-G61 WeakPolarHBondContact O-CA 3.46Å; Q57-G61 PolarHBondContact O-N 2.8Å
58E79.8Confident75.7Confident151 Ų151120.4 Ų120.471%0.70660%0.599SS**Hα-helixtrans-72.2-43.3179.2-170.8177.2-176.700111.9L54 F55 I56L54-E58 WeakPolarHBondContact O-CB 3.34Å; L54-E58 PolarHBondContact O-N 2.89Å; F55-E58 PolarHBondContact O-N 3.49Å; I56-E58 PolarHBondContact O-N 3.11Å
59H72.4Confident74Confident109 Ų109120.3 Ų120.351%0.50560%0.599SS.*Hα-helixtrans-82.6-31.1-177.9-83.3-82.2000114.1F55F55-H59 AromaticContact CD2-CD2 3.7Å; F55-H59 AromaticContact CE2-CD2 3.35Å; F55-H59 WeakPolarHBondContact CE2-CD2 3.41Å; F55-H59 AromaticContact CE2-NE2 3.45Å; F55-H59 WeakPolarHBondContact CE2-NE2 3.42Å; F55-H59 AromaticContact CZ-CD2 3.69Å; F55-H59 AromaticContact CZ-NE2 3.96Å; F55-H59 WeakPolarHBondContact O-CB 3.36Å; F55-H59 PolarHBondContact O-N 3.34Å; F55-H59 VanDerWaalsContact O-N 3.09Å
60Y68.9Low72.7Confident153 Ų153123.5 Ų123.560%0.660%0.604SS**Hα-helixtrans-124.1-14.1-173.5-57-80.7000113.9I56 R62 Y63I56-Y60 HydrophobicContact CG2-CD2 4.38Å; I56-Y60 WeakPolarHBondContact O-CA 3.46Å; I56-Y60 VanDerWaalsContact O-CB 3.32Å; I56-Y60 WeakPolarHBondContact O-CB 3.42Å; I56-Y60 PolarHBondContact O-N 2.96Å; Y60-R62 PolarHBondContact O-N 3.47Å; Y60-Y63 PolarHBondContact O-N 2.82Å
61G65.1Low71.6Confident41 Ų41120.1 Ų120.142%0.42360%0.595SS.*THydrogen-bonded Turntrans-74.5-5.9179.800000115I56 Q57 Y63I56-G61 PolarHBondContact O-N 2.96Å; Q57-G61 WeakPolarHBondContact O-CA 3.46Å; Q57-G61 PolarHBondContact O-N 2.8Å; G61-Y63 VanDerWaalsContact C-N 3.27Å
62R60.9Low70.5Confident226 Ų226122.2 Ų122.285%0.85360%0.6SS**THydrogen-bonded Turntrans-78.4-8.9168.2-67.7-141.9-67.7-137.5-1.7113.9Y60 N64Y60-R62 PolarHBondContact O-N 3.47Å; R62-N64 PolarHBondContact O-N 2.93Å
63Y59.8Low69.5Low174 Ų174120.3 Ų120.368%0.68259%0.593SS**  trans-92.584.7169.5-59.4-79.7000108.2Y60 G61 L65Y60-Y63 PolarHBondContact O-N 2.82Å; G61-Y63 VanDerWaalsContact C-N 3.27Å; Y63-L65 PolarHBondContact O-N 3.12Å
64N59.3Low68.7Low138 Ų138121 Ų12174%0.73859%0.59SS**  trans-61.8110154.8-86.3-47.1000105.6R62 S66R62-N64 PolarHBondContact O-N 2.93Å; N64-S66 PolarHBondContact O-N 3.26Å
65L62.9Low67.8Low171 Ų171120.7 Ų120.790%0.89559%0.589SS**  trans-69.948.6167.4-64171.8000109.6Y63 D67Y63-L65 PolarHBondContact O-N 3.12Å; L65-D67 PolarHBondContact O-N 3.37Å; L65-D67 VanDerWaalsContact O-N 3.16Å
66S61.4Low66.7Low89 Ų89118.5 Ų118.562%0.62259%0.588SS**  trans-73.7105.3170.1-66.50000106.9N64N64-S66 PolarHBondContact O-N 3.26Å
67D63.1Low65.8Low76 Ų76120.6 Ų120.641%0.40660%0.596SS.*  trans47.6105.4162.7-166.115.5000116.8L65 F69 H70L65-D67 PolarHBondContact O-N 3.37Å; L65-D67 VanDerWaalsContact O-N 3.16Å; D67-F69 PolarHBondContact O-N 3.08Å; D67-F69 VanDerWaalsContact OD1-CD2 3.31Å; D67-F69 WeakPolarHBondContact OD1-CD2 3.32Å; D67-F69 PolarHBondContact OD1-N 2.64Å; D67-H70 PolarHBondContact O-N 3.18Å; D67-H70 IonicContact OD2-ND1 3.72Å
68P64.6Low64.9Low106 Ų106121.1 Ų121.169%0.68860%0.602SS**Hα-helixtrans-54.5-18.1178.918.9-29.6000114.5L72P68-L72 PolarHBondContact O-N 3.49Å
69F57.8Low63.9Low147 Ų147120.4 Ų120.465%0.64561%0.607SS**Hα-helixtrans-68.3-32.8173.9-72.5-85.7000114D67 L72 Q73D67-F69 PolarHBondContact O-N 3.08Å; D67-F69 VanDerWaalsContact OD1-CD2 3.31Å; D67-F69 WeakPolarHBondContact OD1-CD2 3.32Å; D67-F69 PolarHBondContact OD1-N 2.64Å; F69-L72 PolarHBondContact O-N 2.97Å; F69-Q73 WeakPolarHBondContact O-CB 3.41Å; F69-Q73 PolarHBondContact O-N 3.44Å
70H64.9Low63.2Low125 Ų125117.7 Ų117.758%0.57961%0.609SS**Hα-helixtrans-73.4-29.1177.8-83.762.1000112.9D67 R74D67-H70 PolarHBondContact O-N 3.18Å; D67-H70 IonicContact OD2-ND1 3.72Å; H70-R74 PolarHBondContact O-N 2.89Å
71A66.9Low62Low44 Ų44113.5 Ų113.536%0.36461%0.612SS.*Hα-helixtrans-68.8-42.8172.700000111.2Q73 D75A71-Q73 VanDerWaalsContact C-N 3.33Å; A71-Q73 PolarHBondContact O-N 3.33Å; A71-D75 PolarHBondContact O-N 2.91Å
72L67.8Low61.6Low127 Ų127117.7 Ų117.767%0.66563%0.632SS**Hα-helixtrans-66.6-34.4176.6-128.784.5000112.5P68 F69 D75 S76P68-L72 PolarHBondContact O-N 3.49Å; F69-L72 PolarHBondContact O-N 2.97Å; L72-D75 PolarHBondContact O-N 3.23Å; L72-S76 WeakPolarHBondContact O-CB 3.23Å; L72-S76 PolarHBondContact O-N 2.93Å
73Q66.4Low60.6Low103 Ų103114.5 Ų114.548%0.48163%0.632SS.*Hα-helixtrans-67.1-42.8178.7-170.3160.5-7.400112.2F69 A71 D75 S76 E77F69-Q73 WeakPolarHBondContact O-CB 3.41Å; F69-Q73 PolarHBondContact O-N 3.44Å; A71-Q73 VanDerWaalsContact C-N 3.33Å; A71-Q73 PolarHBondContact O-N 3.33Å; Q73-D75 VanDerWaalsContact C-N 3.3Å; Q73-D75 PolarHBondContact O-N 3.06Å; Q73-S76 PolarHBondContact O-N 3.02Å; Q73-S76 PolarHBondContact O-OG 3.41Å; Q73-E77 WeakPolarHBondContact O-CG 3.46Å; Q73-E77 PolarHBondContact O-N 3.44Å; Q73-E77 VanDerWaalsContact O-N 3.13Å
74R69.3Low60.1Low150 Ų150115.4 Ų115.457%0.56664%0.639SS**Hα-helixtrans-57.5-42.2170.7-89.4-166.4-52108.512.2112.6H70 S76 E77 I78H70-R74 PolarHBondContact O-N 2.89Å; R74-S76 VanDerWaalsContact C-N 3.33Å; R74-E77 PolarHBondContact O-N 2.9Å; R74-I78 WeakPolarHBondContact O-CG1 3.46Å; R74-I78 PolarHBondContact O-N 3.33Å
75D65.8Low58.9Low87 Ų87117 Ų11747%0.46564%0.642SS.*Hα-helixtrans-73.3-30.6-176.7-66.3-11.1000111.2A71 L72 Q73 I78 V79A71-D75 PolarHBondContact O-N 2.91Å; L72-D75 PolarHBondContact O-N 3.23Å; Q73-D75 VanDerWaalsContact C-N 3.3Å; Q73-D75 PolarHBondContact O-N 3.06Å; D75-I78 PolarHBondContact O-N 3.29Å; D75-V79 PolarHBondContact O-N 3.33Å
76S62.7Low58.4Low70 Ų70114.4 Ų114.449%0.4964%0.636SS.*Hα-helixtrans-67.1-34.9172.379.50000113.2L72 Q73 R74 V79 G80L72-S76 WeakPolarHBondContact O-CB 3.23Å; L72-S76 PolarHBondContact O-N 2.93Å; Q73-S76 PolarHBondContact O-N 3.02Å; Q73-S76 PolarHBondContact O-OG 3.41Å; R74-S76 VanDerWaalsContact C-N 3.33Å; S76-V79 PolarHBondContact O-N 2.98Å; S76-G80 PolarHBondContact O-N 2.9Å
77E62.5Low57.7Low121 Ų121114 Ų11457%0.56565%0.645SS**Hα-helixtrans-72.9-27.2178.7-72.2169.9-171.800112.7Q73 R74Q73-E77 WeakPolarHBondContact O-CG 3.46Å; Q73-E77 PolarHBondContact O-N 3.44Å; Q73-E77 VanDerWaalsContact O-N 3.13Å; R74-E77 PolarHBondContact O-N 2.9Å
78I60.6Low56.5Low136 Ų136122.2 Ų122.270%0.69767%0.67SS**Hα-helixtrans-78.4-30.3176.1-66.3167.7000111.7R74 D75R74-I78 WeakPolarHBondContact O-CG1 3.46Å; R74-I78 PolarHBondContact O-N 3.33Å; D75-I78 PolarHBondContact O-N 3.29Å
79V59.1Low55.4Low136 Ų136122.7 Ų122.782%0.82468%0.676SS**Hα-helixtrans-85.2-25.7175.6173.80000111.9D75 S76D75-V79 PolarHBondContact O-N 3.33Å; S76-V79 PolarHBondContact O-N 2.98Å
80G57Low54.8Low52 Ų52120.3 Ų120.354%0.53668%0.678SS.*  trans-108.561.4-17800000114.7S76S76-G80 PolarHBondContact O-N 2.9Å
81G45Very low54.1Low65 Ų65119.8 Ų119.867%0.6769%0.686SS**  trans-74.6125.6169.300000111.9N83G81-N83 PolarHBondContact O-N 3.34Å
82P55.4Low53.3Low128 Ų128124.2 Ų124.283%0.83171%0.708SS**  trans-83.6118.8179.932.7-29.3000109.5
83N41.3Very low52.9Low159 Ų159121.8 Ų121.885%0.8570%0.702SS**  trans-136.290.6166-130.3-25.5000109.4G81G81-N83 PolarHBondContact O-N 3.34Å
84K48.5Very low53Low194 Ų194121 Ų12184%0.84370%0.701SS**  trans-85.3112.8155.8-83.3-178.8174.3178.80106.5
85E34.9Very low53.3Low172 Ų172118.9 Ų118.980%0.80471%0.707SS**  trans-165138.1140.5-89.2-45.2127.100108.3
86P51Low54.2Low116 Ų116119.9 Ų119.975%0.75371%0.712SS**  trans-91.6135.8-17234.7-26.8000111.4
87G47.1Very low55.2Low80 Ų80121.1 Ų121.183%0.82572%0.716SS**  trans97.981.9162.300000116.1
88R37.2Very low56.3Low248 Ų248118.6 Ų118.694%0.93671%0.709SS**  trans-152.7118140-136.6173.9-165.5-102.32.6109.3S90R88-S90 PolarHBondContact O-N 3.37Å
89S41.9Very low57.6Low116 Ų116117.2 Ų117.281%0.81170%0.702SS**  trans-52.1114.1179.136.90000112
90S46Very low59.1Low98 Ų98118.3 Ų118.369%0.68570%0.696SS**  trans-69.8131.9150.359.50000106.6R88 T92R88-S90 PolarHBondContact O-N 3.37Å; S90-T92 PolarHBondContact O-N 3.35Å; S90-T92 VanDerWaalsContact O-N 3.1Å
91P49.6Very low60.7Low113 Ų113121.7 Ų121.773%0.73470%0.701SS**  trans-61124.2169.626.7-29.4000105.1S93P91-S93 PolarHBondContact O-N 2.91Å
92T49.5Very low63Low137 Ų137122.1 Ų122.184%0.8469%0.69SS**  trans-55.791.4164.751.10000106.2S90 N94S90-T92 PolarHBondContact O-N 3.35Å; S90-T92 VanDerWaalsContact O-N 3.1Å; T92-N94 PolarHBondContact O-N 3.36Å
93S59.4Low64.9Low76 Ų76119.6 Ų119.653%0.53167%0.672SS.*  trans-56.8118.917955.60000105.5P91 P95 V98P91-S93 PolarHBondContact O-N 2.91Å; S93-P95 WeakPolarHBondContact O-CD 3.48Å; S93-V98 WeakPolarHBondContact OG-CG2 3.26Å
94N69.8Low67.3Low88 Ų88114.3 Ų114.347%0.47165%0.648SS.*  trans-48.8120.3-179.7-179.3-38.4000107.9T92 L96 V97T92-N94 PolarHBondContact O-N 3.36Å; N94-L96 PolarHBondContact O-N 3.38Å; N94-L96 WeakPolarHBondContact OD1-CB 3.47Å; N94-L96 PolarHBondContact OD1-N 2.97Å; N94-L96 VanDerWaalsContact OD1-N 3.08Å; N94-V97 HydrophobicContact CB-CG2 4.1Å; N94-V97 WeakPolarHBondContact O-CB 3.38Å; N94-V97 PolarHBondContact O-N 3.5Å
95P75.9Confident69.5Low104 Ų104110.5 Ų110.568%0.67563%0.633SS**Hα-helixtrans-57.3-24.5-170.620.3-32.7000112.6S93 L99S93-P95 WeakPolarHBondContact O-CD 3.48Å; P95-L99 WeakPolarHBondContact O-CB 3.06Å; P95-L99 PolarHBondContact O-N 2.84Å
96L83.6Confident72.3Confident109 Ų109105.8 Ų105.857%0.57162%0.618SS**Hα-helixtrans-68.8-32.5174.7-65.1169.9000113.6N94 K100N94-L96 PolarHBondContact O-N 3.38Å; N94-L96 WeakPolarHBondContact OD1-CB 3.47Å; N94-L96 PolarHBondContact OD1-N 2.97Å; N94-L96 VanDerWaalsContact OD1-N 3.08Å; L96-K100 WeakPolarHBondContact O-CB 3.48Å; L96-K100 VanDerWaalsContact O-CG 3.3Å; L96-K100 WeakPolarHBondContact O-CG 3.5Å; L96-K100 PolarHBondContact O-N 3.39Å
97V84.5Confident74.4Confident96 Ų96107.5 Ų107.558%0.58261%0.609SS**Hα-helixtrans-71.8-42.8178.6178.10000110.2N94 K100 L101N94-V97 HydrophobicContact CB-CG2 4.1Å; N94-V97 WeakPolarHBondContact O-CB 3.38Å; N94-V97 PolarHBondContact O-N 3.5Å; V97-K100 PolarHBondContact O-N 3.35Å; V97-L101 PolarHBondContact O-N 3.45Å
98V85.1Confident76.7Confident68 Ų68109.5 Ų109.541%0.41260%0.595SS.*Hα-helixtrans-63.1-44.6174.4-178.90000110.3S93 K100 L101 V102S93-V98 WeakPolarHBondContact OG-CG2 3.26Å; V98-K100 PolarHBondContact O-N 2.89Å; V98-L101 WeakPolarHBondContact O-CB 3.39Å; V98-L101 PolarHBondContact O-N 2.98Å; V98-V102 HydrophobicContact CG1-CG2 4.49Å; V98-V102 WeakPolarHBondContact O-CG2 3.46Å; V98-V102 PolarHBondContact O-N 3.15Å
99L88.3Confident79.5Confident107 Ų107102.7 Ų102.756%0.5658%0.576SS**Hα-helixtrans-62.2-43.1177.3-172.563.9000112.5P95 L101 V102 V103P95-L99 WeakPolarHBondContact O-CB 3.06Å; P95-L99 PolarHBondContact O-N 2.84Å; L99-L101 VanDerWaalsContact C-N 3.31Å; L99-L101 PolarHBondContact O-N 2.94Å; L99-V102 PolarHBondContact O-N 3.17Å; L99-V103 WeakPolarHBondContact O-CB 3.42Å; L99-V103 VanDerWaalsContact O-CG2 3.32Å; L99-V103 WeakPolarHBondContact O-CG2 3.41Å; L99-V103 PolarHBondContact O-N 2.97Å
100K89.4Confident82.1Confident158 Ų158103.4 Ų103.469%0.68757%0.566SS**Hα-helixtrans-61.5-38.4174.7-78.6178.2179.4-177.10112.3L96 V97 V98 S104L96-K100 WeakPolarHBondContact O-CB 3.48Å; L96-K100 VanDerWaalsContact O-CG 3.3Å; L96-K100 WeakPolarHBondContact O-CG 3.5Å; L96-K100 PolarHBondContact O-N 3.39Å; V97-K100 PolarHBondContact O-N 3.35Å; V98-K100 PolarHBondContact O-N 2.89Å; K100-S104 VanDerWaalsContact O-CB 3.25Å; K100-S104 WeakPolarHBondContact O-CB 3.41Å; K100-S104 PolarHBondContact O-N 3.44Å
101L91.8Very high84.5Confident124 Ų124104.2 Ų104.265%0.64956%0.559SS**Hα-helixtrans-66.6-43.9176.1-174.663.4000111.3V97 V98 L99 S104 H105V97-L101 PolarHBondContact O-N 3.45Å; V98-L101 WeakPolarHBondContact O-CB 3.39Å; V98-L101 PolarHBondContact O-N 2.98Å; L99-L101 VanDerWaalsContact C-N 3.31Å; L99-L101 PolarHBondContact O-N 2.94Å; L101-S104 PolarHBondContact O-N 3.07Å; L101-H105 VanDerWaalsContact O-CB 3.3Å; L101-H105 WeakPolarHBondContact O-CB 3.35Å; L101-H105 PolarHBondContact O-N 2.84Å
102V93.3Very high86.8Confident74 Ų74105.6 Ų105.645%0.44855%0.553SS.*Hα-helixtrans-63-46.9175.9173.30000110.9V98 L99 S104 H105 C106V98-V102 HydrophobicContact CG1-CG2 4.49Å; V98-V102 WeakPolarHBondContact O-CG2 3.46Å; V98-V102 PolarHBondContact O-N 3.15Å; L99-V102 PolarHBondContact O-N 3.17Å; V102-S104 VanDerWaalsContact C-N 3.34Å; V102-S104 PolarHBondContact O-N 3.07Å; V102-H105 CarbonylContact O-C 3.59Å; V102-H105 WeakPolarHBondContact O-CB 3.41Å; V102-H105 PolarHBondContact O-N 3Å; V102-H105 VanDerWaalsContact O-N 3.14Å; V102-C106 WeakPolarHBondContact O-CB 3.44Å; V102-C106 PolarHBondContact O-N 3.29Å; V102-C106 PolarHBondContact O-SG 3Å
103V94Very high89Confident74 Ų74104.1 Ų104.145%0.44854%0.538SS..Hα-helixtrans-61.1-41.9176.71710000111.6L99 H105 C106 R107L99-V103 WeakPolarHBondContact O-CB 3.42Å; L99-V103 VanDerWaalsContact O-CG2 3.32Å; L99-V103 WeakPolarHBondContact O-CG2 3.41Å; L99-V103 PolarHBondContact O-N 2.97Å; V103-H105 VanDerWaalsContact C-N 3.35Å; V103-C106 PolarHBondContact O-N 2.74Å; V103-R107 WeakPolarHBondContact O-CB 3.49Å; V103-R107 PolarHBondContact O-N 3.35Å
104S93.6Very high90.8Very high48 Ų48106.2 Ų106.234%0.33654%0.543SS..Hα-helixtrans-63.8-40174.4-174.60000111.9K100 L101 V102 R107 K108K100-S104 VanDerWaalsContact O-CB 3.25Å; K100-S104 WeakPolarHBondContact O-CB 3.41Å; K100-S104 PolarHBondContact O-N 3.44Å; L101-S104 PolarHBondContact O-N 3.07Å; V102-S104 VanDerWaalsContact C-N 3.34Å; V102-S104 PolarHBondContact O-N 3.07Å; S104-R107 PolarHBondContact O-N 3.34Å; S104-K108 WeakPolarHBondContact O-CG 3.43Å; S104-K108 PolarHBondContact O-N 2.83Å
105H93.4Very high92.1Very high115 Ų115105 Ų10553%0.53255%0.545SS..Hα-helixtrans-65.8-46.8176.3-173.973.4000111.9L101 V102 V103 R107 K108 M109L101-H105 VanDerWaalsContact O-CB 3.3Å; L101-H105 WeakPolarHBondContact O-CB 3.35Å; L101-H105 PolarHBondContact O-N 2.84Å; V102-H105 CarbonylContact O-C 3.59Å; V102-H105 WeakPolarHBondContact O-CB 3.41Å; V102-H105 PolarHBondContact O-N 3Å; V102-H105 VanDerWaalsContact O-N 3.14Å; V103-H105 VanDerWaalsContact C-N 3.35Å; H105-R107 VanDerWaalsContact C-N 3.34Å; H105-R107 PolarHBondContact O-N 3.48Å; H105-K108 PolarHBondContact O-N 3.19Å; H105-M109 WeakPolarHBondContact O-CB 3.47Å; H105-M109 PolarHBondContact O-N 3.17Å
106C94.1Very high93.1Very high72 Ų72106.6 Ų106.649%0.48654%0.543SS..Hα-helixtrans-59.6-42.1175-68.70000111.8V102 V103 M109 Q110V102-C106 WeakPolarHBondContact O-CB 3.44Å; V102-C106 PolarHBondContact O-N 3.29Å; V102-C106 PolarHBondContact O-SG 3Å; V103-C106 PolarHBondContact O-N 2.74Å; C106-M109 PolarHBondContact O-N 3.03Å; C106-Q110 WeakPolarHBondContact O-CB 3.31Å; C106-Q110 PolarHBondContact O-N 3.2Å
107R95.6Very high93.8Very high153 Ų153106.5 Ų106.558%0.57754%0.543SS*.Hα-helixtrans-62.9-48.4176.2-173.5179.9-61.9-177-0.7112V103 S104 H105 M109 Q110 E111V103-R107 WeakPolarHBondContact O-CB 3.49Å; V103-R107 PolarHBondContact O-N 3.35Å; S104-R107 PolarHBondContact O-N 3.34Å; H105-R107 VanDerWaalsContact C-N 3.34Å; H105-R107 PolarHBondContact O-N 3.48Å; R107-M109 VanDerWaalsContact C-N 3.28Å; R107-M109 PolarHBondContact O-N 2.84Å; R107-Q110 WeakPolarHBondContact O-CB 3.3Å; R107-Q110 PolarHBondContact O-N 3.38Å; R107-E111 WeakPolarHBondContact O-CG 3.49Å; R107-E111 PolarHBondContact O-N 3.02Å
108K95.8Very high94.4Very high121 Ų121104.4 Ų104.453%0.52654%0.536SS..Hα-helixtrans-61.9-36.4176.1-72.2174.8-176.5179.70112.2S104 H105 K112S104-K108 WeakPolarHBondContact O-CG 3.43Å; S104-K108 PolarHBondContact O-N 2.83Å; H105-K108 PolarHBondContact O-N 3.19Å; K108-K112 WeakPolarHBondContact O-CB 3.29Å; K108-K112 VanDerWaalsContact O-CG 3.29Å; K108-K112 WeakPolarHBondContact O-CG 3.47Å; K108-K112 PolarHBondContact O-N 3.27Å
109M96.1Very high95Very high106 Ų106103.6 Ų103.652%0.52254%0.536SS..Hα-helixtrans-66.1-45.9174.8-173.866.979.500111.1H105 C106 R107 E111 K112 M113H105-M109 WeakPolarHBondContact O-CB 3.47Å; H105-M109 PolarHBondContact O-N 3.17Å; C106-M109 PolarHBondContact O-N 3.03Å; R107-M109 VanDerWaalsContact C-N 3.28Å; R107-M109 PolarHBondContact O-N 2.84Å; M109-E111 PolarHBondContact O-N 2.93Å; M109-K112 PolarHBondContact O-N 2.9Å; M109-M113 WeakPolarHBondContact O-CB 3.39Å; M109-M113 PolarHBondContact O-N 3.4Å
110Q96Very high95.4Very high130 Ų13099.7 Ų99.761%0.60752%0.519SS*.Hα-helixtrans-60.2-43.9176.8-176.2-177.45.200111.8C106 R107 M113 L114C106-Q110 WeakPolarHBondContact O-CB 3.31Å; C106-Q110 PolarHBondContact O-N 3.2Å; R107-Q110 WeakPolarHBondContact O-CB 3.3Å; R107-Q110 PolarHBondContact O-N 3.38Å; Q110-M113 PolarHBondContact O-N 3.31Å; Q110-L114 WeakPolarHBondContact O-CB 3.31Å; Q110-L114 PolarHBondContact O-N 2.84Å
111E96.4Very high95.8Very high116 Ų11697.3 Ų97.354%0.54251%0.511SS..Hα-helixtrans-61.9-44.8175.9-73.4167-17300111.8R107 M109 L114 A115R107-E111 WeakPolarHBondContact O-CG 3.49Å; R107-E111 PolarHBondContact O-N 3.02Å; M109-E111 PolarHBondContact O-N 2.93Å; E111-L114 PolarHBondContact O-N 3.21Å; E111-A115 WeakPolarHBondContact O-CB 3.39Å; E111-A115 PolarHBondContact O-N 3Å
112K96.6Very high96.1Very high141 Ų14194 Ų9461%0.61350%0.498SS*.Hα-helixtrans-62.9-43.3175.4-75.5177.4179.9-1740112.1K108 M109 A115 Q116K108-K112 WeakPolarHBondContact O-CB 3.29Å; K108-K112 VanDerWaalsContact O-CG 3.29Å; K108-K112 WeakPolarHBondContact O-CG 3.47Å; K108-K112 PolarHBondContact O-N 3.27Å; M109-K112 PolarHBondContact O-N 2.9Å; K112-A115 PolarHBondContact O-N 3.35Å; K112-Q116 WeakPolarHBondContact O-CB 3.33Å; K112-Q116 VanDerWaalsContact O-CG 3.32Å; K112-Q116 WeakPolarHBondContact O-CG 3.48Å; K112-Q116 PolarHBondContact O-N 2.88Å
113M96.9Very high96.4Very high107 Ų10798.3 Ų98.353%0.52751%0.506SS..Hα-helixtrans-62.3-44.6177.4-176.4178.868.300110.7M109 Q110 Q116 L117M109-M113 WeakPolarHBondContact O-CB 3.39Å; M109-M113 PolarHBondContact O-N 3.4Å; Q110-M113 PolarHBondContact O-N 3.31Å; M113-Q116 PolarHBondContact O-N 3Å; M113-L117 HydrophobicContact CG-CD1 4.29Å; M113-L117 WeakPolarHBondContact O-CG 3.33Å; M113-L117 PolarHBondContact O-N 2.99Å
114L96.8Very high96.6Very high119 Ų119100.8 Ų100.862%0.62351%0.513SS*.Hα-helixtrans-63.4-43.4177-172.467.6000111.8Q110 E111 Q116 L117 A118Q110-L114 WeakPolarHBondContact O-CB 3.31Å; Q110-L114 PolarHBondContact O-N 2.84Å; E111-L114 PolarHBondContact O-N 3.21Å; L114-Q116 VanDerWaalsContact C-N 3.33Å; L114-Q116 PolarHBondContact O-N 3.31Å; L114-L117 PolarHBondContact O-N 3.39Å; L114-A118 WeakPolarHBondContact O-CB 3.48Å; L114-A118 PolarHBondContact O-N 3.33Å
115A97.1Very high96.8Very high62 Ų62105.5 Ų105.551%0.51252%0.523SS..Hα-helixtrans-63-39.2175.900000112.1E111 K112 A119E111-A115 WeakPolarHBondContact O-CB 3.39Å; E111-A115 PolarHBondContact O-N 3Å; K112-A115 PolarHBondContact O-N 3.35Å; A115-A119 VanDerWaalsContact O-CB 3.32Å; A115-A119 WeakPolarHBondContact O-CB 3.46Å; A115-A119 PolarHBondContact O-N 3.38Å
116Q97.4Very high97Very high139 Ų139107.7 Ų107.765%0.6553%0.527SS*.Hα-helixtrans-66.4-41.2174.8-76.9-178.5-1700112.2K112 M113 L114 A119 A120K112-Q116 WeakPolarHBondContact O-CB 3.33Å; K112-Q116 VanDerWaalsContact O-CG 3.32Å; K112-Q116 WeakPolarHBondContact O-CG 3.48Å; K112-Q116 PolarHBondContact O-N 2.88Å; M113-Q116 PolarHBondContact O-N 3Å; L114-Q116 VanDerWaalsContact C-N 3.33Å; L114-Q116 PolarHBondContact O-N 3.31Å; Q116-A119 PolarHBondContact O-N 3.07Å; Q116-A120 WeakPolarHBondContact O-CB 3.48Å; Q116-A120 PolarHBondContact O-N 3.31Å
117L97.1Very high97.2Very high106 Ų106108.1 Ų108.156%0.55553%0.527SS*.Hα-helixtrans-62.8-46.5174.8-73.2171.8000111.1M113 L114 A119 A120 E121M113-L117 HydrophobicContact CG-CD1 4.29Å; M113-L117 WeakPolarHBondContact O-CG 3.33Å; M113-L117 PolarHBondContact O-N 2.99Å; L114-L117 PolarHBondContact O-N 3.39Å; L117-A119 VanDerWaalsContact C-N 3.33Å; L117-A119 PolarHBondContact O-N 2.86Å; L117-A120 PolarHBondContact O-N 3.47Å; L117-E121 WeakPolarHBondContact O-CB 3.46Å; L117-E121 PolarHBondContact O-N 3.24Å
118A97.4Very high97.3Very high53 Ų53105.2 Ų105.244%0.43852%0.522SS..Hα-helixtrans-61.7-39.9176.300000112.2L114 S122L114-A118 WeakPolarHBondContact O-CB 3.48Å; L114-A118 PolarHBondContact O-N 3.33Å; A118-S122 WeakPolarHBondContact O-CB 3.5Å; A118-S122 PolarHBondContact O-N 2.96Å
119A97.5Very high97.4Very high51 Ų51101.8 Ų101.842%0.42152%0.516SS..Hα-helixtrans-67.3-38.717500000112.3A115 Q116 L117 R123A115-A119 VanDerWaalsContact O-CB 3.32Å; A115-A119 WeakPolarHBondContact O-CB 3.46Å; A115-A119 PolarHBondContact O-N 3.38Å; Q116-A119 PolarHBondContact O-N 3.07Å; L117-A119 VanDerWaalsContact C-N 3.33Å; L117-A119 PolarHBondContact O-N 2.86Å; A119-R123 WeakPolarHBondContact O-CG 3.43Å; A119-R123 PolarHBondContact O-N 2.68Å
120A98Very high97.5Very high25 Ų25100.9 Ų100.921%0.20751%0.514CS..Hα-helixtrans-65.2-45.5174.800000111.4Q116 L117 S122 R123 H124Q116-A120 WeakPolarHBondContact O-CB 3.48Å; Q116-A120 PolarHBondContact O-N 3.31Å; L117-A120 PolarHBondContact O-N 3.47Å; A120-S122 PolarHBondContact O-N 3Å; A120-R123 PolarHBondContact O-N 2.82Å; A120-H124 PolarHBondContact O-CD2 3.08Å; A120-H124 PolarHBondContact O-N 2.95Å
121E97.8Very high97.6Very high108 Ų108100.3 Ų100.351%0.50551%0.514SS..Hα-helixtrans-60.7-44.7176.3-170.1-168.3151.700111.7L117 R123 H124 R125L117-E121 WeakPolarHBondContact O-CB 3.46Å; L117-E121 PolarHBondContact O-N 3.24Å; E121-R123 PolarHBondContact O-N 3.4Å; E121-H124 PolarHBondContact O-N 3.28Å; E121-R125 WeakPolarHBondContact O-CB 3.36Å; E121-R125 PolarHBondContact O-N 3.21Å; E121-R125 IonicContact OE1-CZ 3.37Å; E121-R125 IonicContact OE1-NH2 2.81Å; E121-R125 PolarHBondContact OE1-NH2 3.5Å
122S98.1Very high97.7Very high55 Ų55100.8 Ų100.839%0.38552%0.516SS..Hα-helixtrans-61.2-41.9175.8-176.80000112.3A118 A120 R125 R126A118-S122 WeakPolarHBondContact O-CB 3.5Å; A118-S122 PolarHBondContact O-N 2.96Å; A120-S122 PolarHBondContact O-N 3Å; S122-R125 PolarHBondContact O-N 3.45Å; S122-R126 PolarHBondContact O-N 3.33Å; S122-R126 VanDerWaalsContact O-N 3.07Å
123R98Very high97.8Very high163 Ų16397.4 Ų97.462%0.61550%0.503SS*.Hα-helixtrans-64.1-44.6174.4-74.4-172.8-621773.4112.1A119 A120 E121 R126 V127A119-R123 WeakPolarHBondContact O-CG 3.43Å; A119-R123 PolarHBondContact O-N 2.68Å; A120-R123 PolarHBondContact O-N 2.82Å; E121-R123 PolarHBondContact O-N 3.4Å; R123-R126 PolarHBondContact O-N 3.41Å; R123-V127 WeakPolarHBondContact O-CG2 3.28Å; R123-V127 PolarHBondContact O-N 2.92Å
124H98.2Very high97.8Very high127 Ų12796.8 Ų96.859%0.58850%0.498SS*.Hα-helixtrans-62.3-44177.4-70.8-179.6000111.5A120 E121 R126 V127 I128A120-H124 PolarHBondContact O-CD2 3.08Å; A120-H124 PolarHBondContact O-N 2.95Å; E121-H124 PolarHBondContact O-N 3.28Å; H124-R126 VanDerWaalsContact C-N 3.27Å; H124-R126 PolarHBondContact O-N 3.23Å; H124-V127 PolarHBondContact O-N 2.87Å; H124-I128 VanDerWaalsContact O-CG1 3.28Å; H124-I128 WeakPolarHBondContact O-CG1 3.36Å; H124-I128 PolarHBondContact O-N 3.42Å
125R98.3Very high97.9Very high146 Ų14699 Ų9955%0.55150%0.503SS*.Hα-helixtrans-58.4-40.3176.1-170.4-178.3-68.3116.41.7111.7E121 S122 A129E121-R125 WeakPolarHBondContact O-CB 3.36Å; E121-R125 PolarHBondContact O-N 3.21Å; E121-R125 IonicContact OE1-CZ 3.37Å; E121-R125 IonicContact OE1-NH2 2.81Å; E121-R125 PolarHBondContact OE1-NH2 3.5Å; S122-R125 PolarHBondContact O-N 3.45Å; R125-A129 PolarHBondContact O-N 2.9Å
126R98.3Very high97.9Very high162 Ų162101.1 Ų101.161%0.61150%0.498SS*.Hα-helixtrans-64.4-48.9174.9-170.4-177.1-58.3166.21.5112.1S122 R123 H124 I128 A129 D130S122-R126 PolarHBondContact O-N 3.33Å; S122-R126 VanDerWaalsContact O-N 3.07Å; R123-R126 PolarHBondContact O-N 3.41Å; H124-R126 VanDerWaalsContact C-N 3.27Å; H124-R126 PolarHBondContact O-N 3.23Å; R126-I128 VanDerWaalsContact C-N 3.27Å; R126-I128 PolarHBondContact O-N 2.91Å; R126-A129 WeakPolarHBondContact O-CB 3.25Å; R126-A129 PolarHBondContact O-N 3.48Å; R126-A129 VanDerWaalsContact O-N 3.1Å; R126-D130 VanDerWaalsContact O-CG 3.26Å; R126-D130 PolarHBondContact O-N 3.14Å
127V98.3Very high97.9Very high81 Ų81100 Ų10049%0.49149%0.488SS..Hα-helixtrans-59.6-39.8178.4172.40000111.5R123 H124 D130 L131R123-V127 WeakPolarHBondContact O-CG2 3.28Å; R123-V127 PolarHBondContact O-N 2.92Å; H124-V127 PolarHBondContact O-N 2.87Å; V127-D130 PolarHBondContact O-N 2.92Å; V127-L131 HydrophobicContact CG1-CD1 4.04Å; V127-L131 HydrophobicContact CG1-CG 4.42Å; V127-L131 WeakPolarHBondContact O-CB 3.45Å; V127-L131 VanDerWaalsContact O-CG 3.26Å; V127-L131 WeakPolarHBondContact O-CG 3.48Å; V127-L131 PolarHBondContact O-N 2.87Å
128I98Very high98Very high91 Ų9199.8 Ų99.847%0.46748%0.484SS..Hα-helixtrans-61.6-47.4175.1-68164.7000110.4H124 R126 D130 L131 E132H124-I128 VanDerWaalsContact O-CG1 3.28Å; H124-I128 WeakPolarHBondContact O-CG1 3.36Å; H124-I128 PolarHBondContact O-N 3.42Å; R126-I128 VanDerWaalsContact C-N 3.27Å; R126-I128 PolarHBondContact O-N 2.91Å; I128-D130 PolarHBondContact O-N 3.33Å; I128-L131 PolarHBondContact O-N 3.29Å; I128-E132 HydrophobicContact CG2-CG 4.39Å; I128-E132 WeakPolarHBondContact O-CG 3.46Å; I128-E132 PolarHBondContact O-N 3.49Å
129A98.1Very high98Very high50 Ų50100.2 Ų100.241%0.41349%0.487SS..Hα-helixtrans-61.4-42.3178.100000112.5R125 R126 L131 E132 E133R125-A129 PolarHBondContact O-N 2.9Å; R126-A129 WeakPolarHBondContact O-CB 3.25Å; R126-A129 PolarHBondContact O-N 3.48Å; R126-A129 VanDerWaalsContact O-N 3.1Å; A129-L131 VanDerWaalsContact C-N 3.35Å; A129-L131 PolarHBondContact O-N 3.47Å; A129-E132 PolarHBondContact O-N 3.33Å; A129-E133 WeakPolarHBondContact O-CB 3.48Å; A129-E133 PolarHBondContact O-N 2.99Å
130D98.1Very high97.9Very high87 Ų87102.1 Ų102.147%0.46549%0.487SS..Hα-helixtrans-63.3-40.6177.4-62.6-18.8000111.1R126 V127 I128 E133 E134R126-D130 VanDerWaalsContact O-CG 3.26Å; R126-D130 PolarHBondContact O-N 3.14Å; V127-D130 PolarHBondContact O-N 2.92Å; I128-D130 PolarHBondContact O-N 3.33Å; D130-E133 PolarHBondContact O-N 2.87Å; D130-E134 WeakPolarHBondContact O-CB 3.13Å; D130-E134 PolarHBondContact O-N 3.07Å
131L98.3Very high97.9Very high117 Ų117105.4 Ų105.461%0.61350%0.501SS*.Hα-helixtrans-69.1-37.8176.6-71.6173.7000112.8V127 I128 A129 E134 K135V127-L131 HydrophobicContact CG1-CD1 4.04Å; V127-L131 HydrophobicContact CG1-CG 4.42Å; V127-L131 WeakPolarHBondContact O-CB 3.45Å; V127-L131 VanDerWaalsContact O-CG 3.26Å; V127-L131 WeakPolarHBondContact O-CG 3.48Å; V127-L131 PolarHBondContact O-N 2.87Å; I128-L131 PolarHBondContact O-N 3.29Å; A129-L131 VanDerWaalsContact C-N 3.35Å; A129-L131 PolarHBondContact O-N 3.47Å; L131-E134 PolarHBondContact O-N 3.38Å; L131-K135 WeakPolarHBondContact O-CB 3.47Å; L131-K135 PolarHBondContact O-N 2.84Å
132E97.9Very high97.8Very high127 Ų127104.4 Ų104.459%0.59350%0.503SS*.Hα-helixtrans-65.8-40.2174.2-74.3174.917500111.3I128 A129 K135 R136I128-E132 HydrophobicContact CG2-CG 4.39Å; I128-E132 WeakPolarHBondContact O-CG 3.46Å; I128-E132 PolarHBondContact O-N 3.49Å; A129-E132 PolarHBondContact O-N 3.33Å; E132-K135 PolarHBondContact O-N 3.24Å; E132-R136 PolarHBondContact O-N 3.37Å; E132-R136 VanDerWaalsContact O-N 3.08Å
133E97.9Very high97.8Very high70 Ų70104.4 Ų104.433%0.32751%0.506SS..Hα-helixtrans-62.4-47.3172.5164.8150.9-134.300112A129 D130 K135 R136 R137A129-E133 WeakPolarHBondContact O-CB 3.48Å; A129-E133 PolarHBondContact O-N 2.99Å; D130-E133 PolarHBondContact O-N 2.87Å; E133-K135 VanDerWaalsContact C-N 3.31Å; E133-K135 PolarHBondContact O-N 3.36Å; E133-R136 VanDerWaalsContact CB-NH2 3.34Å; E133-R136 PolarHBondContact O-N 3.26Å; E133-R136 VanDerWaalsContact O-N 3.14Å; E133-R136 IonicContact OE1-NH2 3.44Å; E133-R136 PolarHBondContact OE1-NH2 3.41Å; E133-R137 WeakPolarHBondContact O-CG 3.42Å; E133-R137 PolarHBondContact O-N 3.12Å; E133-R137 IonicContact OE1-CZ 3.71Å; E133-R137 IonicContact OE1-NE 2.66Å; E133-R137 PolarHBondContact OE1-NE 2.94Å; E133-R137 IonicContact OE1-NH2 3.65Å; E133-R137 PolarHBondContact OE1-NH2 2.95Å
134E97.6Very high97.7Very high93 Ų93102.8 Ų102.844%0.43551%0.505SS..Hα-helixtrans-62.2-39.9178.8-164.363.5-162.600111.5D130 L131 R136 R137 H138D130-E134 WeakPolarHBondContact O-CB 3.13Å; D130-E134 PolarHBondContact O-N 3.07Å; L131-E134 PolarHBondContact O-N 3.38Å; E134-R136 VanDerWaalsContact C-N 3.32Å; E134-R136 PolarHBondContact O-N 3.24Å; E134-R137 PolarHBondContact O-N 2.68Å; E134-H138 PolarHBondContact O-CD2 3Å; E134-H138 VanDerWaalsContact O-CD2 3.26Å; E134-H138 PolarHBondContact O-N 3.41Å; E134-H138 IonicContact OE1-CE1 2.93Å; E134-H138 IonicContact OE1-NE2 2.74Å
135K98.1Very high97.7Very high165 Ų16598.2 Ų98.272%0.71749%0.492SS*.Hα-helixtrans-61-41.2174.5-177.6-176173.5-172.50112.1L131 E132 E133 A139L131-K135 WeakPolarHBondContact O-CB 3.47Å; L131-K135 PolarHBondContact O-N 2.84Å; E132-K135 PolarHBondContact O-N 3.24Å; E133-K135 VanDerWaalsContact C-N 3.31Å; E133-K135 PolarHBondContact O-N 3.36Å; K135-A139 PolarHBondContact O-N 2.87Å; K135-A139 VanDerWaalsContact O-N 3.1Å
136R97.9Very high97.6Very high108 Ų10896.2 Ų96.241%0.40849%0.492SS..Hα-helixtrans-67.3-44.9176.8174.2-177.838.559.61.3111E132 E133 E134 H138 A139 E140E132-R136 PolarHBondContact O-N 3.37Å; E132-R136 VanDerWaalsContact O-N 3.08Å; E133-R136 VanDerWaalsContact CB-NH2 3.34Å; E133-R136 PolarHBondContact O-N 3.26Å; E133-R136 VanDerWaalsContact O-N 3.14Å; E133-R136 IonicContact OE1-NH2 3.44Å; E133-R136 PolarHBondContact OE1-NH2 3.41Å; E134-R136 VanDerWaalsContact C-N 3.32Å; E134-R136 PolarHBondContact O-N 3.24Å; R136-H138 VanDerWaalsContact C-N 3.33Å; R136-H138 PolarHBondContact O-N 3.12Å; R136-A139 WeakPolarHBondContact O-CB 3.5Å; R136-A139 PolarHBondContact O-N 3.44Å; R136-A139 VanDerWaalsContact O-N 3.11Å; R136-E140 VanDerWaalsContact CG-OE1 3.29Å; R136-E140 WeakPolarHBondContact CG-OE1 3.48Å; R136-E140 WeakPolarHBondContact O-CG 3.43Å; R136-E140 PolarHBondContact O-N 3.4Å
137R98Very high97.6Very high116 Ų11693.7 Ų93.744%0.43849%0.491SS..Hα-helixtrans-56.7-46.8174.9-71.1-178.2-176.3-77.7-5.7111.5E133 E134 A139 E140 D141E133-R137 WeakPolarHBondContact O-CG 3.42Å; E133-R137 PolarHBondContact O-N 3.12Å; E133-R137 IonicContact OE1-CZ 3.71Å; E133-R137 IonicContact OE1-NE 2.66Å; E133-R137 PolarHBondContact OE1-NE 2.94Å; E133-R137 IonicContact OE1-NH2 3.65Å; E133-R137 PolarHBondContact OE1-NH2 2.95Å; E134-R137 PolarHBondContact O-N 2.68Å; R137-A139 VanDerWaalsContact C-N 3.3Å; R137-A139 PolarHBondContact O-N 3.32Å; R137-E140 PolarHBondContact O-N 2.87Å; R137-E140 VanDerWaalsContact O-N 3.17Å; R137-D141 VanDerWaalsContact O-CG 3.25Å; R137-D141 PolarHBondContact O-N 3.37Å
138H97.7Very high97.6Very high101 Ų10193.9 Ų93.947%0.46849%0.492SS..Hα-helixtrans-61.8-35.5175.9-74.7-40.9000114E134 R136 T142E134-H138 PolarHBondContact O-CD2 3Å; E134-H138 VanDerWaalsContact O-CD2 3.26Å; E134-H138 PolarHBondContact O-N 3.41Å; E134-H138 IonicContact OE1-CE1 2.93Å; E134-H138 IonicContact OE1-NE2 2.74Å; R136-H138 VanDerWaalsContact C-N 3.33Å; R136-H138 PolarHBondContact O-N 3.12Å; H138-T142 WeakPolarHBondContact O-CB 3.35Å; H138-T142 PolarHBondContact O-N 2.89Å; H138-T142 PolarHBondContact O-OG1 2.92Å
139A97.4Very high97.6Very high61 Ų6192.8 Ų92.850%0.50449%0.49SS..Hα-helixtrans-67.2-41.3175.700000111.5K135 R136 R137 T142 A143K135-A139 PolarHBondContact O-N 2.87Å; K135-A139 VanDerWaalsContact O-N 3.1Å; R136-A139 WeakPolarHBondContact O-CB 3.5Å; R136-A139 PolarHBondContact O-N 3.44Å; R136-A139 VanDerWaalsContact O-N 3.11Å; R137-A139 VanDerWaalsContact C-N 3.3Å; R137-A139 PolarHBondContact O-N 3.32Å; A139-T142 PolarHBondContact O-N 2.87Å; A139-A143 PolarHBondContact O-N 3.49Å; A139-A143 VanDerWaalsContact O-N 3.07Å
140E96.6Very high97.6Very high91 Ų9197 Ų9743%0.42550%0.496SS..Hα-helixtrans-63.6-50.5174.5-69.9163.7-172.600111R136 R137 T142 A143 E144R136-E140 VanDerWaalsContact CG-OE1 3.29Å; R136-E140 WeakPolarHBondContact CG-OE1 3.48Å; R136-E140 WeakPolarHBondContact O-CG 3.43Å; R136-E140 PolarHBondContact O-N 3.4Å; R137-E140 PolarHBondContact O-N 2.87Å; R137-E140 VanDerWaalsContact O-N 3.17Å; E140-T142 VanDerWaalsContact C-N 3.25Å; E140-T142 PolarHBondContact O-N 3.42Å; E140-A143 PolarHBondContact O-N 3.21Å; E140-A143 VanDerWaalsContact O-N 3.08Å; E140-E144 PolarHBondContact O-N 3.47Å
141D97.1Very high97.6Very high95 Ų9598.2 Ų98.251%0.50850%0.501SS..Hα-helixtrans-58.9-36.4177.9-66.9-22.9000112.3R137 G145R137-D141 VanDerWaalsContact O-CG 3.25Å; R137-D141 PolarHBondContact O-N 3.37Å; D141-G145 PolarHBondContact O-N 3.46Å
142T96.9Very high97.6Very high87 Ų8798 Ų9853%0.53450%0.501SS..Hα-helixtrans-68.5-43.5176.6-57.20000110.8H138 A139 E140 G145 D146H138-T142 WeakPolarHBondContact O-CB 3.35Å; H138-T142 PolarHBondContact O-N 2.89Å; H138-T142 PolarHBondContact O-OG1 2.92Å; A139-T142 PolarHBondContact O-N 2.87Å; E140-T142 VanDerWaalsContact C-N 3.25Å; E140-T142 PolarHBondContact O-N 3.42Å; T142-G145 PolarHBondContact O-N 3.28Å; T142-D146 PolarHBondContact O-N 3.31Å
143A97.4Very high97.7Very high54 Ų5496.9 Ų96.945%0.44650%0.495SS..Hα-helixtrans-64.6-43.1178.200000112A139 E140 G145 D146 D147A139-A143 PolarHBondContact O-N 3.49Å; A139-A143 VanDerWaalsContact O-N 3.07Å; E140-A143 PolarHBondContact O-N 3.21Å; E140-A143 VanDerWaalsContact O-N 3.08Å; A143-G145 VanDerWaalsContact C-N 3.29Å; A143-G145 PolarHBondContact O-N 2.92Å; A143-D146 PolarHBondContact O-N 2.89Å; A143-D147 PolarHBondContact O-N 3.33Å
144E96.6Very high97.7Very high129 Ų12998 Ų9860%0.60350%0.499SS*.Hα-helixtrans-63.2-37.5174.4-68.5-174.9-178.500111.7E140 D146 D147 V148E140-E144 PolarHBondContact O-N 3.47Å; E144-D146 VanDerWaalsContact C-N 3.31Å; E144-D146 PolarHBondContact O-N 2.98Å; E144-D147 PolarHBondContact O-N 2.93Å; E144-V148 WeakPolarHBondContact O-CG2 3.45Å; E144-V148 PolarHBondContact O-N 3.21Å; E144-V148 VanDerWaalsContact O-N 3.12Å
145G97.2Very high97.7Very high31 Ų3197.2 Ų97.232%0.3250%0.495SS..Hα-helixtrans-62.1-35.5174.100000113.6D141 T142 A143 T149D141-G145 PolarHBondContact O-N 3.46Å; T142-G145 PolarHBondContact O-N 3.28Å; A143-G145 VanDerWaalsContact C-N 3.29Å; A143-G145 PolarHBondContact O-N 2.92Å; G145-T149 WeakPolarHBondContact O-CB 3.44Å; G145-T149 PolarHBondContact O-N 2.92Å; G145-T149 PolarHBondContact O-OG1 3.32Å
146D97.5Very high97.8Very high104 Ų10497.5 Ų97.556%0.55649%0.492SS*.Hα-helixtrans-68.7-41.8176.4-71.7-19.9000111.5T142 A143 E144 T149 Y150T142-D146 PolarHBondContact O-N 3.31Å; A143-D146 PolarHBondContact O-N 2.89Å; E144-D146 VanDerWaalsContact C-N 3.31Å; E144-D146 PolarHBondContact O-N 2.98Å; D146-T149 WeakPolarHBondContact O-CB 3.48Å; D146-T149 PolarHBondContact O-N 3.41Å; D146-Y150 WeakPolarHBondContact O-CB 3.48Å; D146-Y150 PolarHBondContact O-N 3.48Å
147D97.3Very high97.8Very high110 Ų11096.7 Ų96.759%0.58849%0.493SS*.Hα-helixtrans-62.2-44175.8-76.7-22.9000111.9A143 E144 T149 Y150 I151A143-D147 PolarHBondContact O-N 3.33Å; E144-D147 PolarHBondContact O-N 2.93Å; D147-T149 VanDerWaalsContact C-N 3.34Å; D147-Y150 PolarHBondContact O-N 2.94Å; D147-I151 WeakPolarHBondContact O-CG1 3.48Å; D147-I151 PolarHBondContact O-N 3.47Å
148V98Very high97.8Very high85 Ų8597.3 Ų97.352%0.51550%0.495SS..Hα-helixtrans-62.6-44.1175.9173.40000110.5E144 Y150 I151 L152E144-V148 WeakPolarHBondContact O-CG2 3.45Å; E144-V148 PolarHBondContact O-N 3.21Å; E144-V148 VanDerWaalsContact O-N 3.12Å; V148-Y150 VanDerWaalsContact C-N 3.34Å; V148-Y150 PolarHBondContact O-N 3Å; V148-I151 PolarHBondContact O-N 2.9Å; V148-L152 HydrophobicContact CG1-CD1 4.02Å; V148-L152 HydrophobicContact CG1-CG 4.47Å; V148-L152 WeakPolarHBondContact O-CG 3.32Å; V148-L152 PolarHBondContact O-N 3.02Å
149T98Very high97.9Very high68 Ų6896.7 Ų96.742%0.41750%0.495SS..Hα-helixtrans-57.9-48.1176.3-61.60000110.9G145 D146 D147 I151 L152 E153G145-T149 WeakPolarHBondContact O-CB 3.44Å; G145-T149 PolarHBondContact O-N 2.92Å; G145-T149 PolarHBondContact O-OG1 3.32Å; D146-T149 WeakPolarHBondContact O-CB 3.48Å; D146-T149 PolarHBondContact O-N 3.41Å; D147-T149 VanDerWaalsContact C-N 3.34Å; T149-I151 PolarHBondContact O-N 2.94Å; T149-L152 PolarHBondContact O-N 3.25Å; T149-E153 HydrophobicContact CG2-CG 4.37Å; T149-E153 WeakPolarHBondContact O-CB 3.47Å; T149-E153 WeakPolarHBondContact O-CG 3.47Å; T149-E153 PolarHBondContact O-N 3.46Å
150Y98.3Very high97.9Very high139 Ų13998.1 Ų98.155%0.54549%0.491SS..Hα-helixtrans-60-44.6179.3175.6-101.5000112.7D146 D147 V148 L152 E153 K154D146-Y150 WeakPolarHBondContact O-CB 3.48Å; D146-Y150 PolarHBondContact O-N 3.48Å; D147-Y150 PolarHBondContact O-N 2.94Å; V148-Y150 VanDerWaalsContact C-N 3.34Å; V148-Y150 PolarHBondContact O-N 3Å; Y150-L152 VanDerWaalsContact C-N 3.35Å; Y150-L152 PolarHBondContact O-N 3.28Å; Y150-E153 PolarHBondContact O-N 3.39Å; Y150-K154 HydrophobicContact CD1-CG 4.48Å; Y150-K154 HydrophobicContact CD2-CG 4.5Å; Y150-K154 HydrophobicContact CE1-CG 4.01Å; Y150-K154 HydrophobicContact CE2-CD 4.45Å; Y150-K154 HydrophobicContact CE2-CG 4.03Å; Y150-K154 WeakPolarHBondContact O-CG 3.4Å; Y150-K154 PolarHBondContact O-N 3.16Å; Y150-K154 WeakPolarHBondContact OH-CE 3.36Å
151I98.5Very high98.1Very high111 Ų111100.1 Ų100.157%0.56950%0.5SS*.Hα-helixtrans-62.4-43.8178-67165.6000110.8D147 V148 T149 K154 E155D147-I151 WeakPolarHBondContact O-CG1 3.48Å; D147-I151 PolarHBondContact O-N 3.47Å; V148-I151 PolarHBondContact O-N 2.9Å; T149-I151 PolarHBondContact O-N 2.94Å; I151-K154 PolarHBondContact O-N 3.43Å; I151-E155 WeakPolarHBondContact O-CB 3.37Å; I151-E155 PolarHBondContact O-N 3.22Å
152L98.4Very high98.1Very high114 Ų11499.7 Ų99.760%0.59750%0.495SS*.Hα-helixtrans-66.5-38.3178.6-69.7175.7000112.3V148 T149 Y150 E155 R156V148-L152 HydrophobicContact CG1-CD1 4.02Å; V148-L152 HydrophobicContact CG1-CG 4.47Å; V148-L152 WeakPolarHBondContact O-CG 3.32Å; V148-L152 PolarHBondContact O-N 3.02Å; T149-L152 PolarHBondContact O-N 3.25Å; Y150-L152 VanDerWaalsContact C-N 3.35Å; Y150-L152 PolarHBondContact O-N 3.28Å; L152-E155 PolarHBondContact O-N 3.45Å; L152-R156 WeakPolarHBondContact O-CB 3.25Å; L152-R156 PolarHBondContact O-N 2.73Å
153E98.5Very high98.2Very high103 Ų10399.2 Ų99.248%0.48149%0.489SS..Hα-helixtrans-64-43.1174.2-75.8-178.1169.500111.6T149 Y150 E155 R156 E157T149-E153 HydrophobicContact CG2-CG 4.37Å; T149-E153 WeakPolarHBondContact O-CB 3.47Å; T149-E153 WeakPolarHBondContact O-CG 3.47Å; T149-E153 PolarHBondContact O-N 3.46Å; Y150-E153 PolarHBondContact O-N 3.39Å; E153-E155 PolarHBondContact O-N 2.96Å; E153-R156 WeakPolarHBondContact O-CB 3.37Å; E153-R156 PolarHBondContact O-N 3.04Å; E153-E157 WeakPolarHBondContact O-CG 3.49Å; E153-E157 PolarHBondContact O-N 2.87Å
154K98.7Very high98.3Very high93 Ų93101.2 Ų101.240%0.40449%0.489SS..Hα-helixtrans-63.1-42.3175.2-75.3-71.5157.7-147.60112.5Y150 I151 R156 E157 R158Y150-K154 HydrophobicContact CD1-CG 4.48Å; Y150-K154 HydrophobicContact CD2-CG 4.5Å; Y150-K154 HydrophobicContact CE1-CG 4.01Å; Y150-K154 HydrophobicContact CE2-CD 4.45Å; Y150-K154 HydrophobicContact CE2-CG 4.03Å; Y150-K154 WeakPolarHBondContact O-CG 3.4Å; Y150-K154 PolarHBondContact O-N 3.16Å; Y150-K154 WeakPolarHBondContact OH-CE 3.36Å; I151-K154 PolarHBondContact O-N 3.43Å; K154-R156 VanDerWaalsContact C-N 3.34Å; K154-E157 IonicContact NZ-OE2 3.3Å; K154-E157 PolarHBondContact NZ-OE2 3.45Å; K154-E157 PolarHBondContact O-N 3.4Å; K154-R158 WeakPolarHBondContact O-CB 3.25Å; K154-R158 PolarHBondContact O-N 3.01Å
155E98.4Very high98.4Very high76 Ų76100.4 Ų100.436%0.35548%0.484SS..Hα-helixtrans-66.4-38.3176.6-17659.1-168.300111.5I151 L152 E153 R158 L159I151-E155 WeakPolarHBondContact O-CB 3.37Å; I151-E155 PolarHBondContact O-N 3.22Å; L152-E155 PolarHBondContact O-N 3.45Å; E153-E155 PolarHBondContact O-N 2.96Å; E155-R158 PolarHBondContact O-N 3.28Å; E155-R158 IonicContact OE1-CZ 2.64Å; E155-R158 IonicContact OE1-NE 3.9Å; E155-R158 PolarHBondContact OE1-NE 3.09Å; E155-R158 IonicContact OE1-NH2 3.98Å; E155-R158 PolarHBondContact OE1-NH2 3.18Å; E155-R158 IonicContact OE2-CZ 3.54Å; E155-R158 IonicContact OE2-NE 3Å; E155-R158 PolarHBondContact OE2-NE 3.15Å; E155-R158 IonicContact OE2-NH2 2.77Å; E155-L159 HydrophobicContact CG-CD1 4.12Å; E155-L159 HydrophobicContact CG-CG 4.45Å; E155-L159 WeakPolarHBondContact O-CB 3.35Å; E155-L159 VanDerWaalsContact O-CG 3.26Å; E155-L159 WeakPolarHBondContact O-CG 3.46Å; E155-L159 PolarHBondContact O-N 2.98Å
156R98.6Very high98.5Very high172 Ų172103.2 Ų103.265%0.64949%0.489SS*.Hα-helixtrans-59.9-47.6172.5178.5-171171.8-159.2-3.1111.7L152 E153 K154 L159 Q160L152-R156 WeakPolarHBondContact O-CB 3.25Å; L152-R156 PolarHBondContact O-N 2.73Å; E153-R156 WeakPolarHBondContact O-CB 3.37Å; E153-R156 PolarHBondContact O-N 3.04Å; K154-R156 VanDerWaalsContact C-N 3.34Å; R156-L159 PolarHBondContact O-N 2.98Å; R156-Q160 VanDerWaalsContact O-CB 3.3Å; R156-Q160 WeakPolarHBondContact O-CB 3.47Å; R156-Q160 PolarHBondContact O-N 2.94Å
157E98.8Very high98.5Very high90 Ų90104.8 Ų104.842%0.42149%0.487SS..Hα-helixtrans-60-45.5177.3-73.9176.4168.100111.3E153 K154 Q160 Q161E153-E157 WeakPolarHBondContact O-CG 3.49Å; E153-E157 PolarHBondContact O-N 2.87Å; K154-E157 IonicContact NZ-OE2 3.3Å; K154-E157 PolarHBondContact NZ-OE2 3.45Å; K154-E157 PolarHBondContact O-N 3.4Å; E157-Q160 PolarHBondContact O-N 3.44Å; E157-Q161 WeakPolarHBondContact O-CG 3.41Å; E157-Q161 PolarHBondContact O-N 3.23Å
158R98.8Very high98.6Very high129 Ų129101.7 Ų101.749%0.48747%0.474SS..Hα-helixtrans-60.1-48.1177.4-169.9-16975.181.2-0.1111.8K154 E155 Q160 Q161 Q162K154-R158 WeakPolarHBondContact O-CB 3.25Å; K154-R158 PolarHBondContact O-N 3.01Å; E155-R158 PolarHBondContact O-N 3.28Å; E155-R158 IonicContact OE1-CZ 2.64Å; E155-R158 IonicContact OE1-NE 3.9Å; E155-R158 PolarHBondContact OE1-NE 3.09Å; E155-R158 IonicContact OE1-NH2 3.98Å; E155-R158 PolarHBondContact OE1-NH2 3.18Å; E155-R158 IonicContact OE2-CZ 3.54Å; E155-R158 IonicContact OE2-NE 3Å; E155-R158 PolarHBondContact OE2-NE 3.15Å; E155-R158 IonicContact OE2-NH2 2.77Å; R158-Q160 VanDerWaalsContact C-N 3.31Å; R158-Q160 PolarHBondContact O-N 3.14Å; R158-Q161 PolarHBondContact O-N 3.42Å; R158-Q162 PolarHBondContact O-N 3.3Å
159L98.7Very high98.6Very high89 Ų89101.5 Ų101.547%0.46647%0.467SS..Hα-helixtrans-64.9-36.2177.8-71.3174000111.8E155 R156 Q162 L163E155-L159 HydrophobicContact CG-CD1 4.12Å; E155-L159 HydrophobicContact CG-CG 4.45Å; E155-L159 WeakPolarHBondContact O-CB 3.35Å; E155-L159 VanDerWaalsContact O-CG 3.26Å; E155-L159 WeakPolarHBondContact O-CG 3.46Å; E155-L159 PolarHBondContact O-N 2.98Å; R156-L159 PolarHBondContact O-N 2.98Å; L159-Q162 PolarHBondContact O-N 2.84Å; L159-L163 WeakPolarHBondContact O-CB 3.44Å; L159-L163 PolarHBondContact O-N 2.96Å
160Q98.7Very high98.7Very high91 Ų91101.8 Ų101.843%0.42547%0.468SS..Hα-helixtrans-64.6-45.8175.4-178.1174.9-2400111.5R156 E157 R158 Q162 L163 E164R156-Q160 VanDerWaalsContact O-CB 3.3Å; R156-Q160 WeakPolarHBondContact O-CB 3.47Å; R156-Q160 PolarHBondContact O-N 2.94Å; E157-Q160 PolarHBondContact O-N 3.44Å; R158-Q160 VanDerWaalsContact C-N 3.31Å; R158-Q160 PolarHBondContact O-N 3.14Å; Q160-Q162 VanDerWaalsContact C-N 3.34Å; Q160-Q162 PolarHBondContact O-N 2.65Å; Q160-L163 PolarHBondContact O-N 3.29Å; Q160-E164 WeakPolarHBondContact CG-OE1 3.49Å; Q160-E164 PolarHBondContact NE2-OE1 3.49Å; Q160-E164 WeakPolarHBondContact O-CG 3.35Å; Q160-E164 PolarHBondContact O-N 3.09Å
161Q98.8Very high98.7Very high132 Ų132101.5 Ų101.562%0.61747%0.467SS*.Hα-helixtrans-60.8-42.5175.8-71.61743.200111.8E157 R158 L163 E164 F165E157-Q161 WeakPolarHBondContact O-CG 3.41Å; E157-Q161 PolarHBondContact O-N 3.23Å; R158-Q161 PolarHBondContact O-N 3.42Å; Q161-L163 PolarHBondContact O-N 2.8Å; Q161-E164 PolarHBondContact O-N 3.42Å; Q161-F165 PolarHBondContact O-N 2.86Å
162Q98.8Very high98.7Very high87 Ų87102.4 Ų102.441%0.40746%0.463SS..Hα-helixtrans-60.4-45.6175.5-17862.324.300111.6R158 L159 Q160 E164 F165 E166R158-Q162 PolarHBondContact O-N 3.3Å; L159-Q162 PolarHBondContact O-N 2.84Å; Q160-Q162 VanDerWaalsContact C-N 3.34Å; Q160-Q162 PolarHBondContact O-N 2.65Å; Q162-E164 VanDerWaalsContact C-N 3.34Å; Q162-E164 PolarHBondContact O-N 3.07Å; Q162-F165 WeakPolarHBondContact O-CB 3.28Å; Q162-F165 PolarHBondContact O-N 3.47Å; Q162-E166 PolarHBondContact NE2-OE1 3.44Å; Q162-E166 WeakPolarHBondContact O-CG 3.42Å; Q162-E166 PolarHBondContact O-N 2.89Å
163L98.7Very high98.7Very high77 Ų77101.5 Ų101.540%0.40346%0.458SS..Hα-helixtrans-63.2-39.7177.4-179.964.3000112.1L159 Q160 Q161 E166 R167L159-L163 WeakPolarHBondContact O-CB 3.44Å; L159-L163 PolarHBondContact O-N 2.96Å; Q160-L163 PolarHBondContact O-N 3.29Å; Q161-L163 PolarHBondContact O-N 2.8Å; L163-E166 PolarHBondContact O-N 3.04Å; L163-R167 HydrophobicContact CD1-CG 4.43Å; L163-R167 VanDerWaalsContact O-CB 3.32Å; L163-R167 WeakPolarHBondContact O-CB 3.43Å; L163-R167 WeakPolarHBondContact O-CG 3.48Å; L163-R167 PolarHBondContact O-N 2.94Å
164E98.8Very high98.7Very high96 Ų96100.4 Ų100.445%0.44945%0.453SS..Hα-helixtrans-65.1-40.5176.4-74.6173.5-165.100111.9Q160 Q161 Q162 R167 S168Q160-E164 WeakPolarHBondContact CG-OE1 3.49Å; Q160-E164 PolarHBondContact NE2-OE1 3.49Å; Q160-E164 WeakPolarHBondContact O-CG 3.35Å; Q160-E164 PolarHBondContact O-N 3.09Å; Q161-E164 PolarHBondContact O-N 3.42Å; Q162-E164 VanDerWaalsContact C-N 3.34Å; Q162-E164 PolarHBondContact O-N 3.07Å; E164-R167 PolarHBondContact O-N 2.95Å; E164-S168 WeakPolarHBondContact O-CB 3.45Å; E164-S168 PolarHBondContact O-N 2.95Å
165F98.8Very high98.7Very high112 Ų112101.7 Ų101.749%0.49146%0.459SS..Hα-helixtrans-61-50.9173.5177.7-98.1000111.4Q161 Q162 R167 S168 Q169Q161-F165 PolarHBondContact O-N 2.86Å; Q162-F165 WeakPolarHBondContact O-CB 3.28Å; Q162-F165 PolarHBondContact O-N 3.47Å; F165-R167 PolarHBondContact O-N 3.13Å; F165-S168 WeakPolarHBondContact O-CB 3.32Å; F165-S168 PolarHBondContact O-N 3.32Å; F165-S168 VanDerWaalsContact O-N 3.07Å; F165-S168 PolarHBondContact O-OG 3.44Å; F165-Q169 PolarHBondContact O-N 3.02Å
166E98.6Very high98.7Very high90 Ų90102.1 Ų102.142%0.42146%0.461SS..Hα-helixtrans-61.4-43.5178.2-73.7176.6-167.600111.8Q162 L163 S168 Q169 V170Q162-E166 PolarHBondContact NE2-OE1 3.44Å; Q162-E166 WeakPolarHBondContact O-CG 3.42Å; Q162-E166 PolarHBondContact O-N 2.89Å; L163-E166 PolarHBondContact O-N 3.04Å; E166-S168 VanDerWaalsContact C-N 3.26Å; E166-S168 PolarHBondContact O-N 3.26Å; E166-Q169 PolarHBondContact O-N 3.01Å; E166-Q169 VanDerWaalsContact O-N 3.13Å; E166-V170 WeakPolarHBondContact O-CG2 3.49Å; E166-V170 PolarHBondContact O-N 3.3Å
167R98.8Very high98.7Very high137 Ų137100.1 Ų100.152%0.51746%0.459SS..Hα-helixtrans-57.9-39.6173.1-76.8171173.7-177.6-1.4111.9L163 E164 F165 R171L163-R167 HydrophobicContact CD1-CG 4.43Å; L163-R167 VanDerWaalsContact O-CB 3.32Å; L163-R167 WeakPolarHBondContact O-CB 3.43Å; L163-R167 WeakPolarHBondContact O-CG 3.48Å; L163-R167 PolarHBondContact O-N 2.94Å; E164-R167 PolarHBondContact O-N 2.95Å; F165-R167 PolarHBondContact O-N 3.13Å; R167-R171 WeakPolarHBondContact O-CB 3.27Å; R167-R171 VanDerWaalsContact O-CG 3.31Å; R167-R171 WeakPolarHBondContact O-CG 3.48Å; R167-R171 PolarHBondContact O-N 3.49Å
168S98.8Very high98.7Very high44 Ų44101.5 Ų101.531%0.30846%0.46SS..Hα-helixtrans-67-38.4177.184.60000112.2E164 F165 E166 R172E164-S168 WeakPolarHBondContact O-CB 3.45Å; E164-S168 PolarHBondContact O-N 2.95Å; F165-S168 WeakPolarHBondContact O-CB 3.32Å; F165-S168 PolarHBondContact O-N 3.32Å; F165-S168 VanDerWaalsContact O-N 3.07Å; F165-S168 PolarHBondContact O-OG 3.44Å; E166-S168 VanDerWaalsContact C-N 3.26Å; E166-S168 PolarHBondContact O-N 3.26Å; S168-R172 PolarHBondContact O-N 3.36Å; S168-R172 VanDerWaalsContact O-N 3.14Å
169Q98.8Very high98.7Very high81 Ų81102.8 Ų102.838%0.37947%0.465SS..Hα-helixtrans-68.2-46177.8-171.5-178.426.600111.1F165 E166 R171 R172 L173F165-Q169 PolarHBondContact O-N 3.02Å; E166-Q169 PolarHBondContact O-N 3.01Å; E166-Q169 VanDerWaalsContact O-N 3.13Å; Q169-R171 PolarHBondContact O-N 3.46Å; Q169-R172 WeakPolarHBondContact O-CB 3.43Å; Q169-R172 PolarHBondContact O-N 2.95Å; Q169-R172 VanDerWaalsContact O-N 3.09Å; Q169-L173 HydrophobicContact CG-CD1 4.39Å; Q169-L173 PolarHBondContact O-N 2.87Å
170V98.8Very high98.7Very high74 Ų74103.6 Ų103.645%0.44847%0.469SS..Hα-helixtrans-57.4-49.2174.7170.90000110.3E166 R172 L173 E174E166-V170 WeakPolarHBondContact O-CG2 3.49Å; E166-V170 PolarHBondContact O-N 3.3Å; V170-R172 PolarHBondContact O-N 3.48Å; V170-R172 VanDerWaalsContact O-N 3.15Å; V170-L173 PolarHBondContact O-N 3.46Å; V170-E174 HydrophobicContact CG1-CG 4.12Å; V170-E174 WeakPolarHBondContact CG1-OE1 3.3Å; V170-E174 WeakPolarHBondContact O-CB 3.48Å; V170-E174 VanDerWaalsContact O-CG 3.28Å; V170-E174 WeakPolarHBondContact O-CG 3.36Å; V170-E174 PolarHBondContact O-N 3.27Å
171R98.8Very high98.7Very high134 Ų134102.2 Ų102.251%0.50647%0.466SS..Hα-helixtrans-57.9-31.3176.8-76.7-173.8-64.6-109.32.6113.6R167 Q169 K175R167-R171 WeakPolarHBondContact O-CB 3.27Å; R167-R171 VanDerWaalsContact O-CG 3.31Å; R167-R171 WeakPolarHBondContact O-CG 3.48Å; R167-R171 PolarHBondContact O-N 3.49Å; Q169-R171 PolarHBondContact O-N 3.46Å; R171-K175 VanDerWaalsContact O-CG 3.28Å; R171-K175 WeakPolarHBondContact O-CG 3.28Å; R171-K175 PolarHBondContact O-N 3.5Å
172R98.8Very high98.7Very high129 Ų129101.1 Ų101.149%0.48746%0.461SS..Hα-helixtrans-72.5-50.6176.9-165.6-163-35.816010110.9S168 Q169 V170 E174 K175 E176S168-R172 PolarHBondContact O-N 3.36Å; S168-R172 VanDerWaalsContact O-N 3.14Å; Q169-R172 WeakPolarHBondContact O-CB 3.43Å; Q169-R172 PolarHBondContact O-N 2.95Å; Q169-R172 VanDerWaalsContact O-N 3.09Å; V170-R172 PolarHBondContact O-N 3.48Å; V170-R172 VanDerWaalsContact O-N 3.15Å; R172-E174 VanDerWaalsContact C-N 3.31Å; R172-E174 PolarHBondContact O-N 2.96Å; R172-K175 WeakPolarHBondContact O-CB 3.26Å; R172-K175 PolarHBondContact O-N 3.25Å; R172-K175 VanDerWaalsContact O-N 3.09Å; R172-E176 PolarHBondContact O-N 2.91Å
173L98.7Very high98.7Very high95 Ų95102.4 Ų102.450%0.49747%0.467SS..Hα-helixtrans-62-39178.3-68.9174.5000111.7Q169 V170 K175 E176 Q177Q169-L173 HydrophobicContact CG-CD1 4.39Å; Q169-L173 PolarHBondContact O-N 2.87Å; V170-L173 PolarHBondContact O-N 3.46Å; L173-K175 VanDerWaalsContact C-N 3.32Å; L173-K175 PolarHBondContact O-N 2.92Å; L173-E176 PolarHBondContact O-N 3.37Å; L173-Q177 WeakPolarHBondContact O-CB 3.39Å; L173-Q177 PolarHBondContact O-N 2.74Å
174E98.8Very high98.7Very high80 Ų80102.2 Ų102.237%0.37447%0.466SS..Hα-helixtrans-62.4-37173.8-74.4175.1171.900112.6V170 R172 R178V170-E174 HydrophobicContact CG1-CG 4.12Å; V170-E174 WeakPolarHBondContact CG1-OE1 3.3Å; V170-E174 WeakPolarHBondContact O-CB 3.48Å; V170-E174 VanDerWaalsContact O-CG 3.28Å; V170-E174 WeakPolarHBondContact O-CG 3.36Å; V170-E174 PolarHBondContact O-N 3.27Å; R172-E174 VanDerWaalsContact C-N 3.31Å; R172-E174 PolarHBondContact O-N 2.96Å; E174-R178 WeakPolarHBondContact O-CB 3.5Å; E174-R178 WeakPolarHBondContact O-CG 3.37Å; E174-R178 PolarHBondContact O-N 3.33Å
175K98.8Very high98.7Very high121 Ų121103.3 Ų103.353%0.52647%0.471SS..Hα-helixtrans-67.7-41.8174.7-74.9173.5-176.9-175.90111.3R171 R172 L173 R178 R179R171-K175 VanDerWaalsContact O-CG 3.28Å; R171-K175 WeakPolarHBondContact O-CG 3.28Å; R171-K175 PolarHBondContact O-N 3.5Å; R172-K175 WeakPolarHBondContact O-CB 3.26Å; R172-K175 PolarHBondContact O-N 3.25Å; R172-K175 VanDerWaalsContact O-N 3.09Å; L173-K175 VanDerWaalsContact C-N 3.32Å; L173-K175 PolarHBondContact O-N 2.92Å; K175-R178 VanDerWaalsContact CG-NH2 3.3Å; K175-R178 PolarHBondContact O-N 3.32Å; K175-R179 VanDerWaalsContact O-CG 3.31Å; K175-R179 WeakPolarHBondContact O-CG 3.42Å; K175-R179 PolarHBondContact O-N 2.88Å
176E98.7Very high98.7Very high85 Ų85103.6 Ų103.640%0.39747%0.474SS..Hα-helixtrans-64.9-43.6176.2-71168.6-166.900111.3R172 L173 R178 R179 I180R172-E176 PolarHBondContact O-N 2.91Å; L173-E176 PolarHBondContact O-N 3.37Å; E176-R178 PolarHBondContact O-N 2.95Å; E176-R179 PolarHBondContact O-N 3.34Å; E176-I180 WeakPolarHBondContact O-CG1 3.31Å; E176-I180 PolarHBondContact O-N 2.9Å
177Q98.6Very high98.7Very high130 Ų130105 Ų10561%0.60748%0.481SS*.Hα-helixtrans-59.5-45.6174.8-174-17534.100111.6L173 I180 T181L173-Q177 WeakPolarHBondContact O-CB 3.39Å; L173-Q177 PolarHBondContact O-N 2.74Å; Q177-I180 PolarHBondContact O-N 3.41Å; Q177-T181 WeakPolarHBondContact O-CB 3.34Å; Q177-T181 PolarHBondContact O-N 3.47Å; Q177-T181 PolarHBondContact O-OG1 2.87Å
178R98.8Very high98.7Very high118 Ų118106.7 Ų106.745%0.44549%0.487SS..Hα-helixtrans-58.7-48.1175.9-79.8-172.7-68.4-93-3.5111.6E174 K175 E176 I180 T181 E182E174-R178 WeakPolarHBondContact O-CB 3.5Å; E174-R178 WeakPolarHBondContact O-CG 3.37Å; E174-R178 PolarHBondContact O-N 3.33Å; K175-R178 VanDerWaalsContact CG-NH2 3.3Å; K175-R178 PolarHBondContact O-N 3.32Å; E176-R178 PolarHBondContact O-N 2.95Å; R178-I180 PolarHBondContact O-N 3.37Å; R178-T181 WeakPolarHBondContact O-CB 3.46Å; R178-T181 PolarHBondContact O-N 2.81Å; R178-T181 VanDerWaalsContact O-N 3.16Å; R178-E182 WeakPolarHBondContact O-CG 3.39Å; R178-E182 PolarHBondContact O-N 3.34Å
179R98.8Very high98.7Very high156 Ų156107.3 Ų107.359%0.58950%0.495SS*.Hα-helixtrans-58.3-46.6177.3-72.8171.5179176.5-2.4112.8K175 E176 T181 E182 Q183K175-R179 VanDerWaalsContact O-CG 3.31Å; K175-R179 WeakPolarHBondContact O-CG 3.42Å; K175-R179 PolarHBondContact O-N 2.88Å; E176-R179 PolarHBondContact O-N 3.34Å; R179-T181 VanDerWaalsContact C-N 3.28Å; R179-T181 PolarHBondContact O-N 3.35Å; R179-E182 PolarHBondContact O-N 3.48Å; R179-Q183 WeakPolarHBondContact O-CB 3.42Å; R179-Q183 VanDerWaalsContact O-CG 3.27Å; R179-Q183 WeakPolarHBondContact O-CG 3.35Å; R179-Q183 PolarHBondContact O-N 3.36Å
180I98.7Very high98.7Very high107 Ų107109.3 Ų109.355%0.54950%0.504SS..Hα-helixtrans-65.1-37178.9-66.9167.4000110.6E176 Q177 R178 L184E176-I180 WeakPolarHBondContact O-CG1 3.31Å; E176-I180 PolarHBondContact O-N 2.9Å; Q177-I180 PolarHBondContact O-N 3.41Å; R178-I180 PolarHBondContact O-N 3.37Å; I180-L184 WeakPolarHBondContact O-CB 3.34Å; I180-L184 PolarHBondContact O-N 3.47Å
181T98.7Very high98.7Very high62 Ų62114.1 Ų114.138%0.3852%0.516SS..Hα-helixtrans-67.2-46.7178-54.40000111.2Q177 R178 R179 Q183 L184 E185Q177-T181 WeakPolarHBondContact O-CB 3.34Å; Q177-T181 PolarHBondContact O-N 3.47Å; Q177-T181 PolarHBondContact O-OG1 2.87Å; R178-T181 WeakPolarHBondContact O-CB 3.46Å; R178-T181 PolarHBondContact O-N 2.81Å; R178-T181 VanDerWaalsContact O-N 3.16Å; R179-T181 VanDerWaalsContact C-N 3.28Å; R179-T181 PolarHBondContact O-N 3.35Å; T181-Q183 PolarHBondContact O-N 3.43Å; T181-L184 PolarHBondContact O-N 2.93Å; T181-E185 WeakPolarHBondContact O-CG 3.35Å; T181-E185 PolarHBondContact O-N 3.35Å
182E98.8Very high98.7Very high108 Ų108115.5 Ų115.551%0.50553%0.525SS..Hα-helixtrans-57.7-46.7175.1-72.4163.2-17100111R178 R179 L184 E185 E186R178-E182 WeakPolarHBondContact O-CG 3.39Å; R178-E182 PolarHBondContact O-N 3.34Å; R179-E182 PolarHBondContact O-N 3.48Å; E182-L184 PolarHBondContact O-N 3.05Å; E182-E185 PolarHBondContact O-N 3.25Å; E182-E186 WeakPolarHBondContact O-CG 3.37Å; E182-E186 PolarHBondContact O-N 2.93Å
183Q98.8Very high98.7Very high115 Ų115116.3 Ų116.354%0.53754%0.535SS..Hα-helixtrans-58.8-44.2175.7-74.9173.8-14.300112.6R179 T181 E185 E186 E187R179-Q183 WeakPolarHBondContact O-CB 3.42Å; R179-Q183 VanDerWaalsContact O-CG 3.27Å; R179-Q183 WeakPolarHBondContact O-CG 3.35Å; R179-Q183 PolarHBondContact O-N 3.36Å; T181-Q183 PolarHBondContact O-N 3.43Å; Q183-E185 VanDerWaalsContact C-N 3.33Å; Q183-E185 PolarHBondContact O-N 2.88Å; Q183-E186 PolarHBondContact O-N 2.68Å; Q183-E187 WeakPolarHBondContact O-CG 3.46Å; Q183-E187 PolarHBondContact O-N 2.95Å
184L98.8Very high98.7Very high73 Ų73117.3 Ų117.338%0.38254%0.54SS..Hα-helixtrans-66.7-35.9178.9-177.8154.9000111.8I180 T181 E182 R188I180-L184 WeakPolarHBondContact O-CB 3.34Å; I180-L184 PolarHBondContact O-N 3.47Å; T181-L184 PolarHBondContact O-N 2.93Å; E182-L184 PolarHBondContact O-N 3.05Å; L184-R188 HydrophobicContact CD2-CG 4.32Å; L184-R188 VanDerWaalsContact CD2-NE 3.29Å; L184-R188 WeakPolarHBondContact O-CB 3.31Å; L184-R188 VanDerWaalsContact O-CG 3.26Å; L184-R188 WeakPolarHBondContact O-CG 3.46Å; L184-R188 PolarHBondContact O-N 3.03Å
185E98.7Very high98.7Very high119 Ų119117.3 Ų117.356%0.55655%0.549SS*.Hα-helixtrans-66.7-41.5173.7-73.4178.3178.600112.1T181 E182 Q183 R188 A189T181-E185 WeakPolarHBondContact O-CG 3.35Å; T181-E185 PolarHBondContact O-N 3.35Å; E182-E185 PolarHBondContact O-N 3.25Å; Q183-E185 VanDerWaalsContact C-N 3.33Å; Q183-E185 PolarHBondContact O-N 2.88Å; E185-R188 PolarHBondContact O-N 3.16Å; E185-A189 WeakPolarHBondContact O-CB 3.36Å; E185-A189 PolarHBondContact O-N 3.43Å
186E98.8Very high98.7Very high118 Ų118114.5 Ų114.555%0.55154%0.543SS*.Hα-helixtrans-61.4-48.4173.8-73174.8-17500111.8E182 Q183 R188 A189 Q190E182-E186 WeakPolarHBondContact O-CG 3.37Å; E182-E186 PolarHBondContact O-N 2.93Å; Q183-E186 PolarHBondContact O-N 2.68Å; E186-R188 VanDerWaalsContact C-N 3.32Å; E186-R188 PolarHBondContact O-N 2.88Å; E186-A189 WeakPolarHBondContact O-CB 3.28Å; E186-A189 PolarHBondContact O-N 3.22Å; E186-A189 VanDerWaalsContact O-N 3.12Å; E186-Q190 WeakPolarHBondContact O-CG 3.41Å; E186-Q190 PolarHBondContact O-N 3.36Å
187E98.6Very high98.7Very high120 Ų120112.6 Ų112.656%0.56154%0.543SS*.Hα-helixtrans-60.6-41.6176.6-74.5-176.6169.500111.7Q183 A189 Q190 Y191Q183-E187 WeakPolarHBondContact O-CG 3.46Å; Q183-E187 PolarHBondContact O-N 2.95Å; E187-A189 VanDerWaalsContact C-N 3.33Å; E187-A189 PolarHBondContact O-N 3.25Å; E187-Q190 PolarHBondContact O-N 2.99Å; E187-Y191 WeakPolarHBondContact O-CB 3.41Å; E187-Y191 PolarHBondContact O-N 3Å
188R98.7Very high98.7Very high172 Ų172111.7 Ų111.765%0.64954%0.541SS*.Hα-helixtrans-62.6-40.3174.1-78.5178.7177.41791.3111.9L184 E185 E186 Y191 K192L184-R188 HydrophobicContact CD2-CG 4.32Å; L184-R188 VanDerWaalsContact CD2-NE 3.29Å; L184-R188 WeakPolarHBondContact O-CB 3.31Å; L184-R188 VanDerWaalsContact O-CG 3.26Å; L184-R188 WeakPolarHBondContact O-CG 3.46Å; L184-R188 PolarHBondContact O-N 3.03Å; E185-R188 PolarHBondContact O-N 3.16Å; E186-R188 VanDerWaalsContact C-N 3.32Å; E186-R188 PolarHBondContact O-N 2.88Å; R188-Y191 PolarHBondContact O-N 3.02Å; R188-K192 WeakPolarHBondContact O-CB 3.49Å; R188-K192 PolarHBondContact O-N 3.45Å
189A98.8Very high98.7Very high57 Ų57108.2 Ų108.247%0.47154%0.538SS..Hα-helixtrans-63.7-43.8176.200000111.2E185 E186 E187 K192 Q193E185-A189 WeakPolarHBondContact O-CB 3.36Å; E185-A189 PolarHBondContact O-N 3.43Å; E186-A189 WeakPolarHBondContact O-CB 3.28Å; E186-A189 PolarHBondContact O-N 3.22Å; E186-A189 VanDerWaalsContact O-N 3.12Å; E187-A189 VanDerWaalsContact C-N 3.33Å; E187-A189 PolarHBondContact O-N 3.25Å; A189-K192 PolarHBondContact O-N 3.18Å; A189-Q193 WeakPolarHBondContact O-CB 3.19Å; A189-Q193 PolarHBondContact O-N 3.45Å
190Q98.8Very high98.7Very high122 Ų122107.3 Ų107.357%0.5754%0.538SS*.Hα-helixtrans-61.2-46.3174.8-69175.116.400111.7E186 E187 K192 Q193 L194E186-Q190 WeakPolarHBondContact O-CG 3.41Å; E186-Q190 PolarHBondContact O-N 3.36Å; E187-Q190 PolarHBondContact O-N 2.99Å; Q190-K192 VanDerWaalsContact C-N 3.34Å; Q190-K192 PolarHBondContact O-N 2.65Å; Q190-Q193 WeakPolarHBondContact O-CB 3.43Å; Q190-Q193 PolarHBondContact O-N 2.85Å; Q190-L194 WeakPolarHBondContact O-CB 3.36Å; Q190-L194 PolarHBondContact O-N 3.12Å
191Y98.7Very high98.7Very high175 Ų175107.6 Ų107.669%0.68654%0.537SS*.Hα-helixtrans-60.2-42.7176.1-103.8-79.9000112.3E187 R188 Q193 L194 S195E187-Y191 WeakPolarHBondContact O-CB 3.41Å; E187-Y191 PolarHBondContact O-N 3Å; R188-Y191 PolarHBondContact O-N 3.02Å; Y191-Q193 VanDerWaalsContact C-N 3.34Å; Y191-L194 PolarHBondContact O-N 3.37Å; Y191-S195 VanDerWaalsContact O-CB 3.28Å; Y191-S195 WeakPolarHBondContact O-CB 3.38Å; Y191-S195 PolarHBondContact O-N 3.03Å
192K98.8Very high98.7Very high164 Ų164107.9 Ų107.971%0.71354%0.541SS*.Hα-helixtrans-63.6-41.3176.5-174.7179.5179.4-178.10111.4R188 A189 Q190 C196R188-K192 WeakPolarHBondContact O-CB 3.49Å; R188-K192 PolarHBondContact O-N 3.45Å; A189-K192 PolarHBondContact O-N 3.18Å; Q190-K192 VanDerWaalsContact C-N 3.34Å; Q190-K192 PolarHBondContact O-N 2.65Å; K192-C196 VanDerWaalsContact O-CB 3.32Å; K192-C196 WeakPolarHBondContact O-CB 3.49Å; K192-C196 PolarHBondContact O-N 3.44Å
193Q98.8Very high98.7Very high146 Ų146110.2 Ų110.268%0.68255%0.549SS*.Hα-helixtrans-63.3-48175.8-179.4178.7-11.600111.3A189 Q190 Y191 S195 C196 A197A189-Q193 WeakPolarHBondContact O-CB 3.19Å; A189-Q193 PolarHBondContact O-N 3.45Å; Q190-Q193 WeakPolarHBondContact O-CB 3.43Å; Q190-Q193 PolarHBondContact O-N 2.85Å; Y191-Q193 VanDerWaalsContact C-N 3.34Å; Q193-S195 PolarHBondContact O-N 2.77Å; Q193-C196 PolarHBondContact O-N 3.2Å; Q193-A197 WeakPolarHBondContact O-CB 3.32Å; Q193-A197 PolarHBondContact O-N 3.21Å
194L98.8Very high98.7Very high116 Ų116112 Ų11261%0.60755%0.551SS**Hα-helixtrans-61.3-44.8177.9-177.764.8000111.5Q190 Y191 C196 A197 L198Q190-L194 WeakPolarHBondContact O-CB 3.36Å; Q190-L194 PolarHBondContact O-N 3.12Å; Y191-L194 PolarHBondContact O-N 3.37Å; L194-C196 VanDerWaalsContact C-N 3.34Å; L194-C196 PolarHBondContact O-N 3.27Å; L194-A197 PolarHBondContact O-N 3.26Å; L194-L198 WeakPolarHBondContact O-CB 3.4Å; L194-L198 PolarHBondContact O-N 3.22Å
195S98.8Very high98.7Very high80 Ų80110.9 Ų110.956%0.55955%0.552SS**Hα-helixtrans-61.1-41.8175.8-1800000111.9Y191 Q193 L198 A199Y191-S195 VanDerWaalsContact O-CB 3.28Å; Y191-S195 WeakPolarHBondContact O-CB 3.38Å; Y191-S195 PolarHBondContact O-N 3.03Å; Q193-S195 PolarHBondContact O-N 2.77Å; S195-L198 PolarHBondContact O-N 2.97Å; S195-A199 VanDerWaalsContact O-CB 3.3Å; S195-A199 WeakPolarHBondContact O-CB 3.37Å; S195-A199 PolarHBondContact O-N 3.49Å
196C98.7Very high98.7Very high61 Ų61109 Ų10941%0.41255%0.552SS.*Hα-helixtrans-64.9-42.8175.6-174.70000112K192 Q193 L194 A199 K200K192-C196 VanDerWaalsContact O-CB 3.32Å; K192-C196 WeakPolarHBondContact O-CB 3.49Å; K192-C196 PolarHBondContact O-N 3.44Å; Q193-C196 PolarHBondContact O-N 3.2Å; L194-C196 VanDerWaalsContact C-N 3.34Å; L194-C196 PolarHBondContact O-N 3.27Å; C196-A199 PolarHBondContact O-N 2.99Å; C196-K200 WeakPolarHBondContact O-CG 3.3Å; C196-K200 PolarHBondContact O-N 3.1Å
197A98.7Very high98.7Very high46 Ų46105.7 Ų105.738%0.3855%0.545SS..Hα-helixtrans-61.5-49.6175.900000110.9Q193 L194 A199 K200 E201Q193-A197 WeakPolarHBondContact O-CB 3.32Å; Q193-A197 PolarHBondContact O-N 3.21Å; L194-A197 PolarHBondContact O-N 3.26Å; A197-A199 VanDerWaalsContact C-N 3.31Å; A197-A199 PolarHBondContact O-N 3.41Å; A197-K200 WeakPolarHBondContact O-CB 3.43Å; A197-K200 PolarHBondContact O-N 3.37Å; A197-K200 VanDerWaalsContact O-N 3.07Å; A197-E201 PolarHBondContact O-N 3.06Å
198L98.8Very high98.7Very high110 Ų110105.6 Ų105.658%0.57654%0.54SS*.Hα-helixtrans-60.3-40.8176.9-175.564.3000111.9L194 S195 K200 E201 C202L194-L198 WeakPolarHBondContact O-CB 3.4Å; L194-L198 PolarHBondContact O-N 3.22Å; S195-L198 PolarHBondContact O-N 2.97Å; L198-K200 VanDerWaalsContact C-N 3.3Å; L198-K200 PolarHBondContact O-N 3.31Å; L198-E201 PolarHBondContact O-N 2.88Å; L198-C202 WeakPolarHBondContact O-CB 3.44Å; L198-C202 PolarHBondContact O-N 2.97Å; L198-C202 PolarHBondContact O-SG 3.27Å; L198-C202 VanDerWaalsContact O-SG 3.33Å
199A98.8Very high98.7Very high45 Ų45100.4 Ų100.437%0.37253%0.534SS..Hα-helixtrans-63.5-35.317600000112.5S195 C196 A197 K203S195-A199 VanDerWaalsContact O-CB 3.3Å; S195-A199 WeakPolarHBondContact O-CB 3.37Å; S195-A199 PolarHBondContact O-N 3.49Å; C196-A199 PolarHBondContact O-N 2.99Å; A197-A199 VanDerWaalsContact C-N 3.31Å; A197-A199 PolarHBondContact O-N 3.41Å; A199-K203 WeakPolarHBondContact O-CB 3.41Å; A199-K203 VanDerWaalsContact O-CG 3.25Å; A199-K203 WeakPolarHBondContact O-CG 3.42Å; A199-K203 PolarHBondContact O-N 3.37Å; A199-K203 VanDerWaalsContact O-N 3.12Å
200K98.8Very high98.7Very high137 Ų137103 Ų10360%0.59654%0.539SS*.Hα-helixtrans-67-45.4173-71.5172.3-178.8-179.90111.1C196 A197 L198 K203 W204C196-K200 WeakPolarHBondContact O-CG 3.3Å; C196-K200 PolarHBondContact O-N 3.1Å; A197-K200 WeakPolarHBondContact O-CB 3.43Å; A197-K200 PolarHBondContact O-N 3.37Å; A197-K200 VanDerWaalsContact O-N 3.07Å; L198-K200 VanDerWaalsContact C-N 3.3Å; L198-K200 PolarHBondContact O-N 3.31Å; K200-K203 PolarHBondContact O-N 3.42Å; K200-W204 WeakPolarHBondContact O-CB 3.39Å; K200-W204 PolarHBondContact O-N 3.35Å
201E98.5Very high98.7Very high113 Ų113102.7 Ų102.753%0.52854%0.538SS..Hα-helixtrans-60.9-45.8176.6-69.7-56.5138.800111.9A197 L198 K203 W204 A205A197-E201 PolarHBondContact O-N 3.06Å; L198-E201 PolarHBondContact O-N 2.88Å; E201-K203 VanDerWaalsContact C-N 3.31Å; E201-K203 PolarHBondContact O-N 2.97Å; E201-W204 PolarHBondContact O-N 2.99Å; E201-A205 VanDerWaalsContact O-CB 3.32Å; E201-A205 WeakPolarHBondContact O-CB 3.41Å; E201-A205 PolarHBondContact O-N 2.92Å
202C98.6Very high98.7Very high68 Ų6898.7 Ų98.746%0.45953%0.525SS..Hα-helixtrans-59.9-41.4176-71.80000111.9L198 S206L198-C202 WeakPolarHBondContact O-CB 3.44Å; L198-C202 PolarHBondContact O-N 2.97Å; L198-C202 PolarHBondContact O-SG 3.27Å; L198-C202 VanDerWaalsContact O-SG 3.33Å; C202-S206 VanDerWaalsContact O-CB 3.25Å; C202-S206 WeakPolarHBondContact O-CB 3.33Å; C202-S206 PolarHBondContact O-N 3.08Å; C202-S206 PolarHBondContact O-OG 3.45Å
203K98.7Very high98.6Very high157 Ų15792.5 Ų92.568%0.68351%0.508SS*.Hα-helixtrans-65.7-44.5176.2-75.8174-178-176.70111.7A199 K200 E201 S206 A207A199-K203 WeakPolarHBondContact O-CB 3.41Å; A199-K203 VanDerWaalsContact O-CG 3.25Å; A199-K203 WeakPolarHBondContact O-CG 3.42Å; A199-K203 PolarHBondContact O-N 3.37Å; A199-K203 VanDerWaalsContact O-N 3.12Å; K200-K203 PolarHBondContact O-N 3.42Å; E201-K203 VanDerWaalsContact C-N 3.31Å; E201-K203 PolarHBondContact O-N 2.97Å; K203-S206 PolarHBondContact O-N 3.25Å; K203-A207 WeakPolarHBondContact O-CB 3.26Å; K203-A207 PolarHBondContact O-N 2.7Å
204W98.8Very high98.6Very high153 Ų15391 Ų9158%0.5850%0.501SS*.Hα-helixtrans-62.2-48.8178.2176.884000111.6K200 E201 S206 A207 R208K200-W204 WeakPolarHBondContact O-CB 3.39Å; K200-W204 PolarHBondContact O-N 3.35Å; E201-W204 PolarHBondContact O-N 2.99Å; W204-S206 VanDerWaalsContact C-N 3.31Å; W204-S206 PolarHBondContact O-N 3.44Å; W204-A207 PolarHBondContact O-N 3.12Å; W204-R208 WeakPolarHBondContact O-CB 3.49Å; W204-R208 PolarHBondContact O-N 3.08Å
205A98.6Very high98.6Very high49 Ų4993.1 Ų93.141%0.40550%0.501SS..Hα-helixtrans-60.9-40.9176.900000111.6E201 R208 A209E201-A205 VanDerWaalsContact O-CB 3.32Å; E201-A205 WeakPolarHBondContact O-CB 3.41Å; E201-A205 PolarHBondContact O-N 2.92Å; A205-R208 PolarHBondContact O-N 2.99Å; A205-A209 WeakPolarHBondContact O-CB 3.45Å; A205-A209 PolarHBondContact O-N 3.49Å
206S98.7Very high98.6Very high80 Ų8095 Ų9556%0.55950%0.504SS*.Hα-helixtrans-65.1-43.5177.2-59.90000112.3C202 K203 W204 A209 L210C202-S206 VanDerWaalsContact O-CB 3.25Å; C202-S206 WeakPolarHBondContact O-CB 3.33Å; C202-S206 PolarHBondContact O-N 3.08Å; C202-S206 PolarHBondContact O-OG 3.45Å; K203-S206 PolarHBondContact O-N 3.25Å; W204-S206 VanDerWaalsContact C-N 3.31Å; W204-S206 PolarHBondContact O-N 3.44Å; S206-A209 PolarHBondContact O-N 3.33Å; S206-L210 PolarHBondContact O-N 3.1Å; S206-L210 VanDerWaalsContact O-N 3.08Å
207A98.7Very high98.6Very high48 Ų4896.1 Ų96.140%0.39751%0.509SS..Hα-helixtrans-61.7-45.2175.800000111.2K203 W204 A209 L210 E211K203-A207 WeakPolarHBondContact O-CB 3.26Å; K203-A207 PolarHBondContact O-N 2.7Å; W204-A207 PolarHBondContact O-N 3.12Å; A207-A209 PolarHBondContact O-N 3.11Å; A207-L210 WeakPolarHBondContact O-CB 3.5Å; A207-L210 PolarHBondContact O-N 3Å; A207-E211 PolarHBondContact O-N 3.17Å
208R98.6Very high98.6Very high118 Ų11898.2 Ų98.245%0.44551%0.511SS..Hα-helixtrans-65.4-40.3178.7-168.5159.6-167.781.65.3112.8W204 A205 L210 E211 E212W204-R208 WeakPolarHBondContact O-CB 3.49Å; W204-R208 PolarHBondContact O-N 3.08Å; A205-R208 PolarHBondContact O-N 2.99Å; R208-L210 VanDerWaalsContact C-N 3.28Å; R208-L210 PolarHBondContact O-N 3Å; R208-E211 PolarHBondContact O-N 3.07Å; R208-E212 WeakPolarHBondContact O-CG 3.49Å; R208-E212 PolarHBondContact O-N 2.99Å
209A98.6Very high98.6Very high64 Ų6497.6 Ų97.653%0.52951%0.508SS..Hα-helixtrans-61.7-37.7174.600000112A205 S206 A207 G213A205-A209 WeakPolarHBondContact O-CB 3.45Å; A205-A209 PolarHBondContact O-N 3.49Å; S206-A209 PolarHBondContact O-N 3.33Å; A207-A209 PolarHBondContact O-N 3.11Å; A209-G213 PolarHBondContact O-N 3.44Å
210L98.6Very high98.6Very high112 Ų11299.1 Ų99.159%0.58651%0.51SS*.Hα-helixtrans-67.9-42.4176.3-170.3125.9000111.9S206 A207 R208 G213 H214S206-L210 PolarHBondContact O-N 3.1Å; S206-L210 VanDerWaalsContact O-N 3.08Å; A207-L210 WeakPolarHBondContact O-CB 3.5Å; A207-L210 PolarHBondContact O-N 3Å; R208-L210 VanDerWaalsContact C-N 3.28Å; R208-L210 PolarHBondContact O-N 3Å; L210-G213 PolarHBondContact O-N 3.47Å; L210-H214 WeakPolarHBondContact CD2-NE2 3.39Å; L210-H214 PolarHBondContact O-CD2 3.29Å; L210-H214 PolarHBondContact O-N 2.91Å
211E98.4Very high98.6Very high114 Ų11497.7 Ų97.753%0.53350%0.5SS..Hα-helixtrans-59.5-47.7174-73.5172.9-17400112.4A207 R208 G213 H214 R215A207-E211 PolarHBondContact O-N 3.17Å; R208-E211 PolarHBondContact O-N 3.07Å; E211-G213 VanDerWaalsContact C-N 3.32Å; E211-G213 PolarHBondContact O-N 3.46Å; E211-H214 PolarHBondContact O-N 2.88Å; E211-R215 PolarHBondContact O-N 3.3Å
212E98.3Very high98.6Very high91 Ų9197 Ų9743%0.42550%0.496SS..Hα-helixtrans-66.2-35.7176.5-68-59.215800111.9R208 R215 L216R208-E212 WeakPolarHBondContact O-CG 3.49Å; R208-E212 PolarHBondContact O-N 2.99Å; E212-R215 PolarHBondContact O-N 3.29Å; E212-L216 WeakPolarHBondContact O-CB 3.37Å; E212-L216 PolarHBondContact O-N 3Å
213G98.5Very high98.6Very high35 Ų3598 Ų9836%0.36150%0.496SS..Hα-helixtrans-57.4-48.3170.800000111.7A209 L210 E211 R215 L216 T217A209-G213 PolarHBondContact O-N 3.44Å; L210-G213 PolarHBondContact O-N 3.47Å; E211-G213 VanDerWaalsContact C-N 3.32Å; E211-G213 PolarHBondContact O-N 3.46Å; G213-R215 PolarHBondContact O-N 3.01Å; G213-L216 PolarHBondContact O-N 3.14Å; G213-T217 WeakPolarHBondContact O-CG2 3.32Å; G213-T217 PolarHBondContact O-N 3.43Å
214H98.6Very high98.6Very high115 Ų11593.1 Ų93.153%0.53248%0.478SS..Hα-helixtrans-60.3-44.7174.8-73.3-53.3000112.2L210 E211 L216 T217 E218L210-H214 WeakPolarHBondContact CD2-NE2 3.39Å; L210-H214 PolarHBondContact O-CD2 3.29Å; L210-H214 PolarHBondContact O-N 2.91Å; E211-H214 PolarHBondContact O-N 2.88Å; H214-L216 VanDerWaalsContact C-N 3.33Å; H214-L216 PolarHBondContact O-N 3.08Å; H214-T217 WeakPolarHBondContact CA-OG1 3.33Å; H214-T217 PolarHBondContact O-N 2.91Å; H214-T217 PolarHBondContact O-OG1 2.83Å; H214-E218 PolarHBondContact O-N 3.32Å
215R98.6Very high98.6Very high160 Ų16092 Ų9260%0.60448%0.477SS*.Hα-helixtrans-59.6-42.3177.1-166.9-179.2-176.8118.31.1112.3E211 E212 G213 E218 L219E211-R215 PolarHBondContact O-N 3.3Å; E212-R215 PolarHBondContact O-N 3.29Å; G213-R215 PolarHBondContact O-N 3.01Å; R215-E218 PolarHBondContact O-N 3.19Å; R215-L219 WeakPolarHBondContact O-CG 3.34Å; R215-L219 PolarHBondContact O-N 2.9Å
216L98.6Very high98.5Very high119 Ų11995.2 Ų95.262%0.62348%0.483SS*.Hα-helixtrans-63.8-44.1176.5-172.9149000111.2E212 G213 H214 E218 L219 N220E212-L216 WeakPolarHBondContact O-CB 3.37Å; E212-L216 PolarHBondContact O-N 3Å; G213-L216 PolarHBondContact O-N 3.14Å; H214-L216 VanDerWaalsContact C-N 3.33Å; H214-L216 PolarHBondContact O-N 3.08Å; L216-E218 VanDerWaalsContact C-N 3.29Å; L216-E218 PolarHBondContact O-N 3.42Å; L216-L219 PolarHBondContact O-N 3.26Å; L216-N220 WeakPolarHBondContact O-CB 3.4Å; L216-N220 PolarHBondContact O-N 3.47Å
217T98.5Very high98.5Very high85 Ų8595.8 Ų95.852%0.52148%0.476SS..Hα-helixtrans-61.5-38.3176.561.30000112.2G213 H214 N220 R221G213-T217 WeakPolarHBondContact O-CG2 3.32Å; G213-T217 PolarHBondContact O-N 3.43Å; H214-T217 WeakPolarHBondContact CA-OG1 3.33Å; H214-T217 PolarHBondContact O-N 2.91Å; H214-T217 PolarHBondContact O-OG1 2.83Å; T217-N220 PolarHBondContact O-N 2.93Å; T217-R221 WeakPolarHBondContact O-CB 3.19Å; T217-R221 PolarHBondContact O-N 3.43Å
218E98.5Very high98.5Very high89 Ų8997.8 Ų97.842%0.41648%0.48SS..Hα-helixtrans-67.4-43.1176.9-163.2-162.5151.900112.1H214 R215 L216 R221 K222H214-E218 PolarHBondContact O-N 3.32Å; R215-E218 PolarHBondContact O-N 3.19Å; L216-E218 VanDerWaalsContact C-N 3.29Å; L216-E218 PolarHBondContact O-N 3.42Å; E218-R221 WeakPolarHBondContact O-CB 3.47Å; E218-R221 PolarHBondContact O-N 3Å; E218-K222 WeakPolarHBondContact O-CG 3.42Å; E218-K222 PolarHBondContact O-N 3.28Å; E218-K222 WeakPolarHBondContact OE1-CE 3.33Å; E218-K222 IonicContact OE1-NZ 3.55Å; E218-K222 PolarHBondContact OE1-NZ 3.23Å
219L98.4Very high98.5Very high98 Ų9894.1 Ų94.151%0.51348%0.475SS..Hα-helixtrans-63.7-42.2175.4-75.2173.6000111.7R215 L216 R221 K222 L223R215-L219 WeakPolarHBondContact O-CG 3.34Å; R215-L219 PolarHBondContact O-N 2.9Å; L216-L219 PolarHBondContact O-N 3.26Å; L219-R221 VanDerWaalsContact C-N 3.32Å; L219-R221 PolarHBondContact O-N 2.98Å; L219-K222 WeakPolarHBondContact O-CB 3.46Å; L219-K222 PolarHBondContact O-N 3.5Å; L219-L223 PolarHBondContact O-N 3.14Å
220N98.4Very high98.5Very high76 Ų7693.2 Ų93.241%0.40646%0.464SS..Hα-helixtrans-61.8-42.3176.1-166.264.3000111.1L216 T217 K222 L223 D224L216-N220 WeakPolarHBondContact O-CB 3.4Å; L216-N220 PolarHBondContact O-N 3.47Å; T217-N220 PolarHBondContact O-N 2.93Å; N220-K222 VanDerWaalsContact C-N 3.27Å; N220-K222 PolarHBondContact O-N 3.27Å; N220-L223 WeakPolarHBondContact O-CB 3.35Å; N220-L223 PolarHBondContact O-N 3.14Å; N220-D224 PolarHBondContact ND2-OD2 2.62Å; N220-D224 VanDerWaalsContact ND2-OD2 3.07Å; N220-D224 VanDerWaalsContact O-CG 3.32Å; N220-D224 PolarHBondContact O-N 3.4Å
221R98.7Very high98.5Very high107 Ų10793.1 Ų93.140%0.40446%0.461SS..Hα-helixtrans-60.3-34.6173-168.9-163.955.158.5-6.5112.6T217 E218 L219 K225T217-R221 WeakPolarHBondContact O-CB 3.19Å; T217-R221 PolarHBondContact O-N 3.43Å; E218-R221 WeakPolarHBondContact O-CB 3.47Å; E218-R221 PolarHBondContact O-N 3Å; L219-R221 VanDerWaalsContact C-N 3.32Å; L219-R221 PolarHBondContact O-N 2.98Å; R221-K225 WeakPolarHBondContact O-CG 3.35Å; R221-K225 PolarHBondContact O-N 3.41Å
222K98.6Very high98.5Very high100 Ų10091.4 Ų91.444%0.43546%0.458SS..Hα-helixtrans-71.2-43.6174.6-71.8172.6-174.8165.30111E218 L219 N220 D224 K225 E226E218-K222 WeakPolarHBondContact O-CG 3.42Å; E218-K222 PolarHBondContact O-N 3.28Å; E218-K222 WeakPolarHBondContact OE1-CE 3.33Å; E218-K222 IonicContact OE1-NZ 3.55Å; E218-K222 PolarHBondContact OE1-NZ 3.23Å; L219-K222 WeakPolarHBondContact O-CB 3.46Å; L219-K222 PolarHBondContact O-N 3.5Å; N220-K222 VanDerWaalsContact C-N 3.27Å; N220-K222 PolarHBondContact O-N 3.27Å; K222-D224 PolarHBondContact O-N 3.24Å; K222-K225 PolarHBondContact O-N 2.76Å; K222-E226 PolarHBondContact O-N 2.91Å
223L98.6Very high98.5Very high87 Ų8792.1 Ų92.146%0.45546%0.464SS..Hα-helixtrans-60.4-43.5176.4176.464.1000111.8L219 N220 E226 K227L219-L223 PolarHBondContact O-N 3.14Å; N220-L223 WeakPolarHBondContact O-CB 3.35Å; N220-L223 PolarHBondContact O-N 3.14Å; L223-E226 WeakPolarHBondContact O-CB 3.49Å; L223-E226 PolarHBondContact O-N 3.43Å; L223-K227 HydrophobicContact CD1-CG 4.47Å; L223-K227 HydrophobicContact CG-CD 4.48Å; L223-K227 WeakPolarHBondContact O-CG 3.42Å; L223-K227 PolarHBondContact O-N 3.06Å
224D98.5Very high98.5Very high56 Ų5697.9 Ų97.930%0.29948%0.475SS..Hα-helixtrans-65.9-40.2179.7-67-27.3000111.4N220 K222 E226 K227 D228N220-D224 PolarHBondContact ND2-OD2 2.62Å; N220-D224 VanDerWaalsContact ND2-OD2 3.07Å; N220-D224 VanDerWaalsContact O-CG 3.32Å; N220-D224 PolarHBondContact O-N 3.4Å; K222-D224 PolarHBondContact O-N 3.24Å; D224-E226 VanDerWaalsContact C-N 3.31Å; D224-E226 PolarHBondContact O-N 3.47Å; D224-K227 WeakPolarHBondContact O-CB 3.34Å; D224-K227 PolarHBondContact O-N 2.99Å; D224-K227 IonicContact OD1-NZ 3.88Å; D224-K227 PolarHBondContact OD1-NZ 2.91Å; D224-D228 VanDerWaalsContact O-CG 3.23Å; D224-D228 PolarHBondContact O-N 3.3Å
225K98.6Very high98.5Very high128 Ų12898.7 Ų98.756%0.55748%0.477SS*.Hα-helixtrans-58-42.8170.7-73.9177.7175.4-1740112.5R221 K222 D228 A229R221-K225 WeakPolarHBondContact O-CG 3.35Å; R221-K225 PolarHBondContact O-N 3.41Å; K222-K225 PolarHBondContact O-N 2.76Å; K225-D228 PolarHBondContact O-N 3.34Å; K225-A229 WeakPolarHBondContact O-CB 3.45Å; K225-A229 PolarHBondContact O-N 3.48Å
226E98.3Very high98.4Very high117 Ų11795.8 Ų95.855%0.54747%0.47SS..Hα-helixtrans-67.7-38.8177.8-168.759.4-141.100111.7K222 L223 D224 D228 A229 C230K222-E226 PolarHBondContact O-N 2.91Å; L223-E226 WeakPolarHBondContact O-CB 3.49Å; L223-E226 PolarHBondContact O-N 3.43Å; D224-E226 VanDerWaalsContact C-N 3.31Å; D224-E226 PolarHBondContact O-N 3.47Å; E226-D228 VanDerWaalsContact C-N 3.34Å; E226-D228 PolarHBondContact O-N 3.37Å; E226-A229 PolarHBondContact O-N 2.89Å; E226-C230 WeakPolarHBondContact O-CB 3.32Å; E226-C230 PolarHBondContact O-N 3.2Å; E226-C230 PolarHBondContact O-SG 3.4Å; E226-C230 VanDerWaalsContact O-SG 3.33Å
227K98.4Very high98.4Very high92 Ų9294.3 Ų94.340%0.446%0.462SS..Hα-helixtrans-61.5-43.2173.5-73.3175.3-169.8151.20111.3L223 D224 C230 Q231L223-K227 HydrophobicContact CD1-CG 4.47Å; L223-K227 HydrophobicContact CG-CD 4.48Å; L223-K227 WeakPolarHBondContact O-CG 3.42Å; L223-K227 PolarHBondContact O-N 3.06Å; D224-K227 WeakPolarHBondContact O-CB 3.34Å; D224-K227 PolarHBondContact O-N 2.99Å; D224-K227 IonicContact OD1-NZ 3.88Å; D224-K227 PolarHBondContact OD1-NZ 2.91Å; K227-C230 PolarHBondContact O-N 3.48Å; K227-Q231 WeakPolarHBondContact O-CB 3.43Å; K227-Q231 VanDerWaalsContact O-CG 3.25Å; K227-Q231 WeakPolarHBondContact O-CG 3.44Å; K227-Q231 PolarHBondContact O-N 3.43Å; K227-Q231 PolarHBondContact O-NE2 3Å
228D98.6Very high98.4Very high91 Ų9195.9 Ų95.949%0.48746%0.464SS..Hα-helixtrans-65.8-41.6178.6-66.7-18.5000111D224 K225 E226 Q231 T232D224-D228 VanDerWaalsContact O-CG 3.23Å; D224-D228 PolarHBondContact O-N 3.3Å; K225-D228 PolarHBondContact O-N 3.34Å; E226-D228 VanDerWaalsContact C-N 3.34Å; E226-D228 PolarHBondContact O-N 3.37Å; D228-Q231 PolarHBondContact O-N 3.49Å; D228-T232 PolarHBondContact O-N 2.92Å; D228-T232 PolarHBondContact O-OG1 2.91Å
229A98.5Very high98.4Very high41 Ų4195.3 Ų95.334%0.33946%0.461SS..Hα-helixtrans-62-48173.500000111.8K225 E226 Q231 T232 L233K225-A229 WeakPolarHBondContact O-CB 3.45Å; K225-A229 PolarHBondContact O-N 3.48Å; E226-A229 PolarHBondContact O-N 2.89Å; A229-Q231 VanDerWaalsContact C-N 3.32Å; A229-Q231 PolarHBondContact O-N 3.27Å; A229-T232 WeakPolarHBondContact O-CB 3.34Å; A229-T232 PolarHBondContact O-N 3.33Å; A229-T232 VanDerWaalsContact O-N 3.17Å; A229-L233 WeakPolarHBondContact O-CG 3.45Å; A229-L233 PolarHBondContact O-N 3.28Å
230C98.1Very high98.4Very high45 Ų4595.6 Ų95.630%0.30446%0.46SS..Hα-helixtrans-59.6-39.9175.4-780000112.5E226 K227 R234E226-C230 WeakPolarHBondContact O-CB 3.32Å; E226-C230 PolarHBondContact O-N 3.2Å; E226-C230 PolarHBondContact O-SG 3.4Å; E226-C230 VanDerWaalsContact O-SG 3.33Å; K227-C230 PolarHBondContact O-N 3.48Å; C230-R234 WeakPolarHBondContact O-CG 3.29Å; C230-R234 PolarHBondContact O-N 2.9Å
231Q98.4Very high98.4Very high110 Ų11099.1 Ų99.151%0.51447%0.468SS..Hα-helixtrans-63.6-42.7175.4-78.2171.462.100111.5K227 D228 A229 R234 K235K227-Q231 WeakPolarHBondContact O-CB 3.43Å; K227-Q231 VanDerWaalsContact O-CG 3.25Å; K227-Q231 WeakPolarHBondContact O-CG 3.44Å; K227-Q231 PolarHBondContact O-N 3.43Å; K227-Q231 PolarHBondContact O-NE2 3Å; D228-Q231 PolarHBondContact O-N 3.49Å; A229-Q231 VanDerWaalsContact C-N 3.32Å; A229-Q231 PolarHBondContact O-N 3.27Å; Q231-R234 PolarHBondContact O-N 3.45Å; Q231-K235 PolarHBondContact O-N 3.41Å
232T98.4Very high98.4Very high77 Ų7798.6 Ų98.647%0.47247%0.471SS..Hα-helixtrans-60.6-49.9176.7-54.30000110.9D228 A229 R234 K235 E236D228-T232 PolarHBondContact O-N 2.92Å; D228-T232 PolarHBondContact O-OG1 2.91Å; A229-T232 WeakPolarHBondContact O-CB 3.34Å; A229-T232 PolarHBondContact O-N 3.33Å; A229-T232 VanDerWaalsContact O-N 3.17Å; T232-R234 VanDerWaalsContact C-N 3.33Å; T232-R234 PolarHBondContact O-N 3.41Å; T232-K235 WeakPolarHBondContact O-CB 3.48Å; T232-K235 PolarHBondContact O-N 3.37Å; T232-K235 VanDerWaalsContact O-N 3.15Å; T232-E236 WeakPolarHBondContact O-CG 3.4Å; T232-E236 PolarHBondContact O-N 3.23Å
233L98.3Very high98.3Very high107 Ų10798.8 Ų98.856%0.5647%0.469SS*.Hα-helixtrans-61.9-37.3177.6-70.1173.8000113.1A229 E236 L237A229-L233 WeakPolarHBondContact O-CG 3.45Å; A229-L233 PolarHBondContact O-N 3.28Å; L233-E236 PolarHBondContact O-N 2.89Å; L233-L237 VanDerWaalsContact O-CB 3.31Å; L233-L237 WeakPolarHBondContact O-CB 3.33Å; L233-L237 PolarHBondContact O-N 3.19Å
234R98.3Very high98.3Very high156 Ų15696.8 Ų96.859%0.58947%0.465SS*.Hα-helixtrans-62.6-43.2174.6-78.2-178.8-168.31253.6111.7C230 Q231 T232 L237 E238C230-R234 WeakPolarHBondContact O-CG 3.29Å; C230-R234 PolarHBondContact O-N 2.9Å; Q231-R234 PolarHBondContact O-N 3.45Å; T232-R234 VanDerWaalsContact C-N 3.33Å; T232-R234 PolarHBondContact O-N 3.41Å; R234-L237 PolarHBondContact O-N 3.48Å; R234-E238 PolarHBondContact O-N 2.92Å
235K98.4Very high98.3Very high131 Ų13198.9 Ų98.957%0.5748%0.476SS*.Hα-helixtrans-63.1-46.3177-172.5-174.5175.4-166.40111Q231 T232 L237 E238 E239Q231-K235 PolarHBondContact O-N 3.41Å; T232-K235 WeakPolarHBondContact O-CB 3.48Å; T232-K235 PolarHBondContact O-N 3.37Å; T232-K235 VanDerWaalsContact O-N 3.15Å; K235-L237 VanDerWaalsContact C-N 3.3Å; K235-L237 PolarHBondContact O-N 3.32Å; K235-E238 PolarHBondContact O-N 3.33Å; K235-E239 VanDerWaalsContact CE-OE1 3.28Å; K235-E239 WeakPolarHBondContact CE-OE1 3.42Å; K235-E239 IonicContact NZ-OE1 2.62Å; K235-E239 WeakPolarHBondContact O-CG 3.46Å; K235-E239 PolarHBondContact O-N 3.39Å
236E98.3Very high98.2Very high100 Ų100100 Ų10047%0.46748%0.476SS..Hα-helixtrans-59.6-41.3175.8-70.8174.6-179.400112T232 L233 E239 E240T232-E236 WeakPolarHBondContact O-CG 3.4Å; T232-E236 PolarHBondContact O-N 3.23Å; L233-E236 PolarHBondContact O-N 2.89Å; E236-E239 PolarHBondContact O-N 3.07Å; E236-E240 PolarHBondContact O-N 2.89Å
237L98.4Very high98.2Very high87 Ų87100.5 Ų100.546%0.45548%0.48SS..Hα-helixtrans-64.1-41.9175.9179.965.1000112.3L233 R234 K235 E240 R241L233-L237 VanDerWaalsContact O-CB 3.31Å; L233-L237 WeakPolarHBondContact O-CB 3.33Å; L233-L237 PolarHBondContact O-N 3.19Å; R234-L237 PolarHBondContact O-N 3.48Å; K235-L237 VanDerWaalsContact C-N 3.3Å; K235-L237 PolarHBondContact O-N 3.32Å; L237-E240 PolarHBondContact O-N 2.89Å; L237-R241 WeakPolarHBondContact O-CB 3.41Å; L237-R241 VanDerWaalsContact O-CG 3.3Å; L237-R241 WeakPolarHBondContact O-CG 3.46Å; L237-R241 PolarHBondContact O-N 3.1Å
238E98.3Very high98.2Very high119 Ų119101.5 Ų101.556%0.55649%0.486SS*.Hα-helixtrans-63.9-43174.6-79.9171.9-163.200111.6R234 K235 E240 R241 M242R234-E238 PolarHBondContact O-N 2.92Å; K235-E238 PolarHBondContact O-N 3.33Å; E238-E240 PolarHBondContact O-N 3.34Å; E238-R241 PolarHBondContact O-N 3.47Å; E238-M242 VanDerWaalsContact O-CG 3.29Å; E238-M242 WeakPolarHBondContact O-CG 3.3Å; E238-M242 PolarHBondContact O-N 2.77Å
239E98.1Very high98.1Very high76 Ų7699.7 Ų99.736%0.35548%0.484SS..Hα-helixtrans-61.8-43.1175.3-69.7176-171.800111.9K235 E236 M242 R243K235-E239 VanDerWaalsContact CE-OE1 3.28Å; K235-E239 WeakPolarHBondContact CE-OE1 3.42Å; K235-E239 IonicContact NZ-OE1 2.62Å; K235-E239 WeakPolarHBondContact O-CG 3.46Å; K235-E239 PolarHBondContact O-N 3.39Å; E236-E239 PolarHBondContact O-N 3.07Å; E239-M242 PolarHBondContact O-N 2.87Å; E239-R243 WeakPolarHBondContact O-CG 3.28Å; E239-R243 PolarHBondContact O-N 3.22Å; E239-R243 IonicContact OE2-NH2 3.18Å; E239-R243 PolarHBondContact OE2-NH2 3.43Å
240E97.7Very high98.1Very high104 Ų104105.7 Ų105.749%0.48650%0.498SS..Hα-helixtrans-63.4-43.6174.9-88.1-55.1141.300112E236 L237 E238 M242 R243 A244E236-E240 PolarHBondContact O-N 2.89Å; L237-E240 PolarHBondContact O-N 2.89Å; E238-E240 PolarHBondContact O-N 3.34Å; E240-M242 VanDerWaalsContact C-N 3.27Å; E240-M242 PolarHBondContact O-N 3.35Å; E240-R243 VanDerWaalsContact CG-NH1 3.29Å; E240-R243 WeakPolarHBondContact O-CB 3.34Å; E240-R243 PolarHBondContact O-N 3.33Å; E240-R243 IonicContact OE1-CZ 3.63Å; E240-R243 IonicContact OE1-NE 3.24Å; E240-R243 IonicContact OE1-NH1 3.57Å; E240-R243 PolarHBondContact OE1-NH1 3.46Å; E240-R243 IonicContact OE2-NH1 2.68Å; E240-A244 WeakPolarHBondContact O-CB 3.26Å; E240-A244 PolarHBondContact O-N 2.99Å
241R98.3Very high98.1Very high151 Ų151107 Ų10757%0.5750%0.504SS*.Hα-helixtrans-56.7-43.2173.8-76.7171.8175.2173.5-1.5111.6L237 E238 A244 L245L237-R241 WeakPolarHBondContact O-CB 3.41Å; L237-R241 VanDerWaalsContact O-CG 3.3Å; L237-R241 WeakPolarHBondContact O-CG 3.46Å; L237-R241 PolarHBondContact O-N 3.1Å; E238-R241 PolarHBondContact O-N 3.47Å; R241-A244 PolarHBondContact O-N 3.49Å; R241-L245 WeakPolarHBondContact O-CG 3.47Å; R241-L245 PolarHBondContact O-N 2.97Å
242M98.4Very high98Very high95 Ų95107.3 Ų107.347%0.46851%0.506SS..Hα-helixtrans-67.1-36176-67.5-64.2-67.700112.2E238 E239 E240 L245 R246E238-M242 VanDerWaalsContact O-CG 3.29Å; E238-M242 WeakPolarHBondContact O-CG 3.3Å; E238-M242 PolarHBondContact O-N 2.77Å; E239-M242 PolarHBondContact O-N 2.87Å; E240-M242 VanDerWaalsContact C-N 3.27Å; E240-M242 PolarHBondContact O-N 3.35Å; M242-L245 HydrophobicContact SD-CD1 4.38Å; M242-R246 VanDerWaalsContact O-CG 3.31Å; M242-R246 WeakPolarHBondContact O-CG 3.46Å; M242-R246 PolarHBondContact O-N 3.37Å; M242-R246 PolarHBondContact O-NH1 2.91Å
243R98.3Very high98Very high104 Ų104109.3 Ų109.339%0.39251%0.51SS..Hα-helixtrans-65.5-45.4173.5-71.4-180-153.898.78.6111.1E239 E240 R246 M247E239-R243 WeakPolarHBondContact O-CG 3.28Å; E239-R243 PolarHBondContact O-N 3.22Å; E239-R243 IonicContact OE2-NH2 3.18Å; E239-R243 PolarHBondContact OE2-NH2 3.43Å; E240-R243 VanDerWaalsContact CG-NH1 3.29Å; E240-R243 WeakPolarHBondContact O-CB 3.34Å; E240-R243 PolarHBondContact O-N 3.33Å; E240-R243 IonicContact OE1-CZ 3.63Å; E240-R243 IonicContact OE1-NE 3.24Å; E240-R243 IonicContact OE1-NH1 3.57Å; E240-R243 PolarHBondContact OE1-NH1 3.46Å; E240-R243 IonicContact OE2-NH1 2.68Å; R243-R246 PolarHBondContact O-N 3.33Å; R243-M247 WeakPolarHBondContact O-CB 3.32Å; R243-M247 PolarHBondContact O-N 3.02Å
244A97.9Very high98Very high46 Ų46108.5 Ų108.538%0.3850%0.503SS..Hα-helixtrans-58.8-48.5177.300000111.5E240 R241 R246 M247 E248E240-A244 WeakPolarHBondContact O-CB 3.26Å; E240-A244 PolarHBondContact O-N 2.99Å; R241-A244 PolarHBondContact O-N 3.49Å; A244-R246 VanDerWaalsContact C-N 3.34Å; A244-R246 PolarHBondContact O-N 2.92Å; A244-M247 WeakPolarHBondContact O-CB 3.41Å; A244-M247 PolarHBondContact O-N 3.43Å; A244-M247 VanDerWaalsContact O-N 3.12Å; A244-E248 WeakPolarHBondContact O-CB 3.3Å; A244-E248 PolarHBondContact O-N 3.35Å
245L98Very high98Very high99 Ų99105.8 Ų105.852%0.51850%0.5SS..Hα-helixtrans-58.2-42.2175.9-77.8166.2000112.8R241 M242 M247 E248 A249R241-L245 WeakPolarHBondContact O-CG 3.47Å; R241-L245 PolarHBondContact O-N 2.97Å; M242-L245 HydrophobicContact SD-CD1 4.38Å; L245-M247 VanDerWaalsContact C-N 3.34Å; L245-E248 PolarHBondContact O-N 2.88Å; L245-A249 WeakPolarHBondContact O-CB 3.41Å; L245-A249 PolarHBondContact O-N 3.19Å
246R97.9Very high97.9Very high152 Ų152102.2 Ų102.257%0.57449%0.494SS*.Hα-helixtrans-66.2-38.8176.2-71.2-179.7-157.3100.7-6.3112.1M242 R243 A244 R250M242-R246 VanDerWaalsContact O-CG 3.31Å; M242-R246 WeakPolarHBondContact O-CG 3.46Å; M242-R246 PolarHBondContact O-N 3.37Å; M242-R246 PolarHBondContact O-NH1 2.91Å; R243-R246 PolarHBondContact O-N 3.33Å; A244-R246 VanDerWaalsContact C-N 3.34Å; A244-R246 PolarHBondContact O-N 2.92Å; R246-R250 WeakPolarHBondContact O-CB 3.27Å; R246-R250 PolarHBondContact O-N 3.38Å; R246-R250 VanDerWaalsContact O-N 3.08Å
247M97.8Very high97.9Very high128 Ų128102.1 Ų102.163%0.63149%0.494SS*.Hα-helixtrans-67.9-41.6177.9-175.6173.863.500111R243 A244 L245 R250 V251R243-M247 WeakPolarHBondContact O-CB 3.32Å; R243-M247 PolarHBondContact O-N 3.02Å; A244-M247 WeakPolarHBondContact O-CB 3.41Å; A244-M247 PolarHBondContact O-N 3.43Å; A244-M247 VanDerWaalsContact O-N 3.12Å; L245-M247 VanDerWaalsContact C-N 3.34Å; M247-R250 PolarHBondContact O-N 3.18Å; M247-V251 WeakPolarHBondContact O-CG2 3.47Å; M247-V251 PolarHBondContact O-N 3.45Å
248E97.1Very high97.9Very high112 Ų112104 Ų10452%0.52350%0.499SS..Hα-helixtrans-59.3-53174-176.7170.5-153.600111A244 L245 R250 V251 E252A244-E248 WeakPolarHBondContact O-CB 3.3Å; A244-E248 PolarHBondContact O-N 3.35Å; L245-E248 PolarHBondContact O-N 2.88Å; E248-R250 VanDerWaalsContact C-N 3.25Å; E248-R250 PolarHBondContact O-N 3.49Å; E248-V251 PolarHBondContact O-N 3.33Å; E248-E252 PolarHBondContact O-N 2.93Å
249A97.8Very high97.9Very high53 Ų53102.1 Ų102.144%0.43849%0.492SS..Hα-helixtrans-56.6-37.6176.600000113L245 E252 E253L245-A249 WeakPolarHBondContact O-CB 3.41Å; L245-A249 PolarHBondContact O-N 3.19Å; A249-E252 PolarHBondContact O-N 3.34Å; A249-E253 WeakPolarHBondContact O-CB 3.48Å; A249-E253 PolarHBondContact O-N 2.66Å
250R97.8Very high97.8Very high167 Ų167102.2 Ų102.263%0.6350%0.499SS*.Hα-helixtrans-67.3-39176.2-174.1-177.5-178.8-166.50.3112.3R246 M247 E248 Q254R246-R250 WeakPolarHBondContact O-CB 3.27Å; R246-R250 PolarHBondContact O-N 3.38Å; R246-R250 VanDerWaalsContact O-N 3.08Å; M247-R250 PolarHBondContact O-N 3.18Å; E248-R250 VanDerWaalsContact C-N 3.25Å; E248-R250 PolarHBondContact O-N 3.49Å; R250-Q254 WeakPolarHBondContact O-CG 3.49Å; R250-Q254 PolarHBondContact O-N 3.4Å; R250-Q254 VanDerWaalsContact O-N 3.11Å
251V98.2Very high97.8Very high73 Ų73102.2 Ų102.244%0.44250%0.498SS..Hα-helixtrans-69.3-39.7176.7171.40000110.3M247 E248 Q254 L255M247-V251 WeakPolarHBondContact O-CG2 3.47Å; M247-V251 PolarHBondContact O-N 3.45Å; E248-V251 PolarHBondContact O-N 3.33Å; V251-Q254 PolarHBondContact O-N 3.39Å; V251-L255 HydrophobicContact CG1-CD1 4.11Å; V251-L255 WeakPolarHBondContact O-CG 3.44Å; V251-L255 PolarHBondContact O-N 3.41Å
252E97.4Very high97.8Very high117 Ų117100.7 Ų100.755%0.54749%0.493SS..Hα-helixtrans-60.8-42.9173.4-71.1-179.8164.600112.2E248 A249 L255 A256E248-E252 PolarHBondContact O-N 2.93Å; A249-E252 PolarHBondContact O-N 3.34Å; E252-L255 PolarHBondContact O-N 3.19Å; E252-A256 WeakPolarHBondContact O-CB 3.34Å; E252-A256 PolarHBondContact O-N 2.89Å
253E97.9Very high97.7Very high119 Ų119101.2 Ų101.256%0.55649%0.494SS*.Hα-helixtrans-58.5-49174.3-176.4176.7-155.100111.3A249 L255 A256 E257A249-E253 WeakPolarHBondContact O-CB 3.48Å; A249-E253 PolarHBondContact O-N 2.66Å; E253-L255 VanDerWaalsContact C-N 3.33Å; E253-L255 PolarHBondContact O-N 3.25Å; E253-A256 PolarHBondContact O-N 3.46Å; E253-E257 WeakPolarHBondContact O-CG 3.45Å; E253-E257 PolarHBondContact O-N 2.84Å
254Q98.1Very high97.7Very high89 Ų89101.1 Ų101.142%0.41650%0.498SS..Hα-helixtrans-61.5-39.5176.6-71.3-169.7-42.500112.7R250 V251 E257 F258R250-Q254 WeakPolarHBondContact O-CG 3.49Å; R250-Q254 PolarHBondContact O-N 3.4Å; R250-Q254 VanDerWaalsContact O-N 3.11Å; V251-Q254 PolarHBondContact O-N 3.39Å; Q254-E257 WeakPolarHBondContact O-CB 3.49Å; Q254-E257 PolarHBondContact O-N 3.25Å; Q254-F258 WeakPolarHBondContact O-CD2 3.47Å; Q254-F258 PolarHBondContact O-N 3.47Å
255L97.9Very high97.6Very high100 Ų100104.1 Ų104.152%0.52451%0.507SS..Hα-helixtrans-63.7-43175.7-76.6168000111.5V251 E252 E253 F258 D259V251-L255 HydrophobicContact CG1-CD1 4.11Å; V251-L255 WeakPolarHBondContact O-CG 3.44Å; V251-L255 PolarHBondContact O-N 3.41Å; E252-L255 PolarHBondContact O-N 3.19Å; E253-L255 VanDerWaalsContact C-N 3.33Å; E253-L255 PolarHBondContact O-N 3.25Å; L255-F258 PolarHBondContact O-N 3.07Å; L255-D259 WeakPolarHBondContact O-CB 3.39Å; L255-D259 PolarHBondContact O-N 3.29Å
256A97.6Very high97.6Very high55 Ų55105.1 Ų105.146%0.45550%0.504SS..Hα-helixtrans-63-41.7175.200000111.7E252 E253 D259 T260E252-A256 WeakPolarHBondContact O-CB 3.34Å; E252-A256 PolarHBondContact O-N 2.89Å; E253-A256 PolarHBondContact O-N 3.46Å; A256-D259 PolarHBondContact O-N 3.4Å; A256-T260 WeakPolarHBondContact O-CG2 3.35Å; A256-T260 PolarHBondContact O-N 3.46Å; A256-T260 PolarHBondContact O-OG1 3.04Å
257E97.4Very high97.5Very high98 Ų98100.3 Ų100.346%0.45849%0.494SS..Hα-helixtrans-56.2-53.8172.4-72.3174.8173.500110.9E253 Q254 D259 T260 E261E253-E257 WeakPolarHBondContact O-CG 3.45Å; E253-E257 PolarHBondContact O-N 2.84Å; Q254-E257 WeakPolarHBondContact O-CB 3.49Å; Q254-E257 PolarHBondContact O-N 3.25Å; E257-D259 VanDerWaalsContact C-N 3.29Å; E257-D259 PolarHBondContact O-N 3.28Å; E257-T260 PolarHBondContact O-N 3.09Å; E257-T260 VanDerWaalsContact O-N 3.14Å; E257-T260 PolarHBondContact O-OG1 3.48Å; E257-E261 WeakPolarHBondContact O-CG 3.36Å; E257-E261 PolarHBondContact O-N 2.93Å
258F97.9Very high97.5Very high128 Ų128101.8 Ų101.856%0.56149%0.492SS*.Hα-helixtrans-59.3-37.4177.8-77.4-58.9000113.2Q254 L255 E261 R262Q254-F258 WeakPolarHBondContact O-CD2 3.47Å; Q254-F258 PolarHBondContact O-N 3.47Å; L255-F258 PolarHBondContact O-N 3.07Å; F258-E261 PolarHBondContact O-N 2.81Å; F258-R262 VanDerWaalsContact O-CB 3.23Å; F258-R262 WeakPolarHBondContact O-CB 3.35Å; F258-R262 PolarHBondContact O-N 2.89Å
259D97.9Very high97.4Very high78 Ų78101.2 Ų101.242%0.41749%0.492SS..Hα-helixtrans-65.8-42.4176.4-87.3-24.9000112.1L255 A256 E257 R262 E263L255-D259 WeakPolarHBondContact O-CB 3.39Å; L255-D259 PolarHBondContact O-N 3.29Å; A256-D259 PolarHBondContact O-N 3.4Å; E257-D259 VanDerWaalsContact C-N 3.29Å; E257-D259 PolarHBondContact O-N 3.28Å; D259-R262 PolarHBondContact O-N 3.49Å; D259-R262 IonicContact OD1-CZ 3.2Å; D259-R262 IonicContact OD1-NE 2.64Å; D259-R262 IonicContact OD1-NH1 3.28Å; D259-R262 IonicContact OD1-NH2 3.08Å; D259-R262 PolarHBondContact OD1-NH2 2.81Å; D259-E263 WeakPolarHBondContact O-CB 3.32Å; D259-E263 PolarHBondContact O-N 3.25Å
260T97.4Very high97.4Very high79 Ų79106.1 Ų106.149%0.48550%0.504SS..Hα-helixtrans-65-41.8174.664.90000111.8A256 E257 E263 Q264A256-T260 WeakPolarHBondContact O-CG2 3.35Å; A256-T260 PolarHBondContact O-N 3.46Å; A256-T260 PolarHBondContact O-OG1 3.04Å; E257-T260 PolarHBondContact O-N 3.09Å; E257-T260 VanDerWaalsContact O-N 3.14Å; E257-T260 PolarHBondContact O-OG1 3.48Å; T260-E263 PolarHBondContact O-N 3.37Å; T260-Q264 VanDerWaalsContact O-CG 3.26Å; T260-Q264 WeakPolarHBondContact O-CG 3.42Å; T260-Q264 PolarHBondContact O-N 3.46Å
261E97Very high97.3Very high103 Ų103105.3 Ų105.348%0.48151%0.505SS..Hα-helixtrans-62.1-44.2175.2-72.3-175.5174.200111.8E257 F258 E263 Q264 L265E257-E261 WeakPolarHBondContact O-CG 3.36Å; E257-E261 PolarHBondContact O-N 2.93Å; F258-E261 PolarHBondContact O-N 2.81Å; E261-E263 VanDerWaalsContact C-N 3.34Å; E261-E263 PolarHBondContact O-N 3.29Å; E261-Q264 WeakPolarHBondContact O-CB 3.45Å; E261-Q264 PolarHBondContact O-N 3.5Å; E261-L265 WeakPolarHBondContact O-CG 3.47Å; E261-L265 PolarHBondContact O-N 2.84Å
262R97.4Very high97.1Very high120 Ų120107 Ų10745%0.45351%0.508SS..Hα-helixtrans-60.4-43.9176.5-177.4179.166.5177.7-1.1111.3F258 D259 L265 R266F258-R262 VanDerWaalsContact O-CB 3.23Å; F258-R262 WeakPolarHBondContact O-CB 3.35Å; F258-R262 PolarHBondContact O-N 2.89Å; D259-R262 PolarHBondContact O-N 3.49Å; D259-R262 IonicContact OD1-CZ 3.2Å; D259-R262 IonicContact OD1-NE 2.64Å; D259-R262 IonicContact OD1-NH1 3.28Å; D259-R262 IonicContact OD1-NH2 3.08Å; D259-R262 PolarHBondContact OD1-NH2 2.81Å; R262-L265 PolarHBondContact O-N 3.16Å; R262-R266 WeakPolarHBondContact O-CG 3.26Å; R262-R266 PolarHBondContact O-N 3.29Å
263E96.9Very high97Very high105 Ų105106.7 Ų106.749%0.49151%0.506SS..Hα-helixtrans-68.3-38.2178.4-165.355.5-146.100111.8D259 T260 E261 L265 R266 S267D259-E263 WeakPolarHBondContact O-CB 3.32Å; D259-E263 PolarHBondContact O-N 3.25Å; T260-E263 PolarHBondContact O-N 3.37Å; E261-E263 VanDerWaalsContact C-N 3.34Å; E261-E263 PolarHBondContact O-N 3.29Å; E263-L265 PolarHBondContact O-N 3.46Å; E263-R266 PolarHBondContact O-N 2.85Å; E263-R266 IonicContact OE2-NH1 3.74Å; E263-R266 PolarHBondContact OE2-NH1 3.37Å; E263-S267 WeakPolarHBondContact O-CB 3.39Å; E263-S267 PolarHBondContact O-N 3.18Å
264Q97.4Very high96.8Very high102 Ų102103.4 Ų103.448%0.47750%0.499SS..Hα-helixtrans-59.3-46.8171.2-72.9175.225.900111.5T260 E261 S267 R268T260-Q264 VanDerWaalsContact O-CG 3.26Å; T260-Q264 WeakPolarHBondContact O-CG 3.42Å; T260-Q264 PolarHBondContact O-N 3.46Å; E261-Q264 WeakPolarHBondContact O-CB 3.45Å; E261-Q264 PolarHBondContact O-N 3.5Å; Q264-S267 PolarHBondContact O-N 3.28Å; Q264-S267 PolarHBondContact O-OG 2.85Å; Q264-R268 WeakPolarHBondContact O-CG 3.36Å; Q264-R268 PolarHBondContact O-N 3.38Å
265L97.1Very high96.7Very high109 Ų109103.9 Ų103.957%0.57150%0.501SS*.Hα-helixtrans-63.5-42.3177-72.5174.9000112.2E261 R262 E263 S267 R268 L269E261-L265 WeakPolarHBondContact O-CG 3.47Å; E261-L265 PolarHBondContact O-N 2.84Å; R262-L265 PolarHBondContact O-N 3.16Å; E263-L265 PolarHBondContact O-N 3.46Å; L265-S267 VanDerWaalsContact C-N 3.32Å; L265-S267 PolarHBondContact O-N 2.88Å; L265-R268 PolarHBondContact O-N 3.46Å; L265-L269 WeakPolarHBondContact O-CB 3.44Å; L265-L269 PolarHBondContact O-N 3.06Å
266R97.3Very high96.4Very high121 Ų121101.9 Ų101.946%0.45750%0.495SS..Hα-helixtrans-58.9-42.7172.6-76.7178.8-178.5149.2-2.2112.1R262 E263 R268 L269 K270R262-R266 WeakPolarHBondContact O-CG 3.26Å; R262-R266 PolarHBondContact O-N 3.29Å; E263-R266 PolarHBondContact O-N 2.85Å; E263-R266 IonicContact OE2-NH1 3.74Å; E263-R266 PolarHBondContact OE2-NH1 3.37Å; R266-R268 VanDerWaalsContact C-N 3.32Å; R266-R268 PolarHBondContact O-N 2.89Å; R266-L269 PolarHBondContact O-N 2.92Å; R266-K270 WeakPolarHBondContact O-CB 3.32Å; R266-K270 PolarHBondContact O-N 3.19Å
267S96.7Very high96.1Very high51 Ų51101.6 Ų101.636%0.35749%0.49SS..Hα-helixtrans-64.1-37.1177.882.10000112.3E263 Q264 L265 K271E263-S267 WeakPolarHBondContact O-CB 3.39Å; E263-S267 PolarHBondContact O-N 3.18Å; Q264-S267 PolarHBondContact O-N 3.28Å; Q264-S267 PolarHBondContact O-OG 2.85Å; L265-S267 VanDerWaalsContact C-N 3.32Å; L265-S267 PolarHBondContact O-N 2.88Å; S267-K271 WeakPolarHBondContact O-CG 3.35Å; S267-K271 PolarHBondContact O-N 2.82Å; S267-K271 VanDerWaalsContact O-N 3.16Å
268R96.8Very high95.8Very high158 Ų158100.9 Ų100.960%0.59649%0.489SS*.Hα-helixtrans-69.3-45.7174.6-70.9179.3-174.2178.64.3111.4Q264 L265 R266 K270 K271 E272Q264-R268 WeakPolarHBondContact O-CG 3.36Å; Q264-R268 PolarHBondContact O-N 3.38Å; L265-R268 PolarHBondContact O-N 3.46Å; R266-R268 VanDerWaalsContact C-N 3.32Å; R266-R268 PolarHBondContact O-N 2.89Å; R268-K270 VanDerWaalsContact C-N 3.32Å; R268-K270 PolarHBondContact O-N 3.26Å; R268-K271 WeakPolarHBondContact O-CB 3.35Å; R268-K271 PolarHBondContact O-N 2.88Å; R268-K271 VanDerWaalsContact O-N 3.16Å; R268-E272 PolarHBondContact O-N 2.95Å
269L96.1Very high95.5Very high101 Ų10198.9 Ų98.953%0.52948%0.484SS..Hα-helixtrans-57-47.9175.7-179.264.4000110.5L265 R266 K271 E272 E273L265-L269 WeakPolarHBondContact O-CB 3.44Å; L265-L269 PolarHBondContact O-N 3.06Å; R266-L269 PolarHBondContact O-N 2.92Å; L269-K271 VanDerWaalsContact C-N 3.3Å; L269-K271 PolarHBondContact O-N 3.46Å; L269-E272 CarbonylContact O-C 3.6Å; L269-E272 PolarHBondContact O-N 2.76Å; L269-E272 VanDerWaalsContact O-N 3.1Å; L269-E273 HydrophobicContact CD1-CG 4.21Å; L269-E273 HydrophobicContact CG-CG 4.22Å; L269-E273 WeakPolarHBondContact O-CB 3.37Å; L269-E273 WeakPolarHBondContact O-CG 3.32Å; L269-E273 PolarHBondContact O-N 2.91Å
270K96.6Very high95Very high155 Ų155101.2 Ų101.267%0.67449%0.492SS*.Hα-helixtrans-59.5-37.5177.3-172.5175.9-177.8176.90113R266 R268 A274R266-K270 WeakPolarHBondContact O-CB 3.32Å; R266-K270 PolarHBondContact O-N 3.19Å; R268-K270 VanDerWaalsContact C-N 3.32Å; R268-K270 PolarHBondContact O-N 3.26Å; K270-A274 VanDerWaalsContact O-CB 3.31Å; K270-A274 WeakPolarHBondContact O-CB 3.42Å; K270-A274 PolarHBondContact O-N 3.21Å
271K96.2Very high94.7Very high151 Ų151102.9 Ų102.966%0.65749%0.494SS*.Hα-helixtrans-66.2-43.8174.1-73.3171-177.3178.40111.6S267 R268 L269 A274 H275S267-K271 WeakPolarHBondContact O-CG 3.35Å; S267-K271 PolarHBondContact O-N 2.82Å; S267-K271 VanDerWaalsContact O-N 3.16Å; R268-K271 WeakPolarHBondContact O-CB 3.35Å; R268-K271 PolarHBondContact O-N 2.88Å; R268-K271 VanDerWaalsContact O-N 3.16Å; L269-K271 VanDerWaalsContact C-N 3.3Å; L269-K271 PolarHBondContact O-N 3.46Å; K271-A274 PolarHBondContact O-N 2.87Å; K271-H275 WeakPolarHBondContact O-CB 3Å; K271-H275 PolarHBondContact O-N 2.86Å
272E94.1Very high94.3Very high107 Ų107103 Ų10350%0.550%0.495SS..Hα-helixtrans-70.2-37.6178.6-164.160.9-135.900112.1R268 L269 H275 C276R268-E272 PolarHBondContact O-N 2.95Å; L269-E272 CarbonylContact O-C 3.6Å; L269-E272 PolarHBondContact O-N 2.76Å; L269-E272 VanDerWaalsContact O-N 3.1Å; E272-H275 PolarHBondContact O-N 3.37Å; E272-H275 IonicContact OE1-ND1 2.68Å; E272-H275 PolarHBondContact OE1-ND1 3.39Å; E272-C276 WeakPolarHBondContact O-CB 3.31Å; E272-C276 PolarHBondContact O-N 2.92Å; E272-C276 PolarHBondContact O-SG 3.47Å
273E95.1Very high93.8Very high112 Ų112100.7 Ų100.752%0.52349%0.494SS..Hα-helixtrans-62.4-43.6172.3-75.6175.7165.800111.2L269 C276 S277L269-E273 HydrophobicContact CD1-CG 4.21Å; L269-E273 HydrophobicContact CG-CG 4.22Å; L269-E273 WeakPolarHBondContact O-CB 3.37Å; L269-E273 WeakPolarHBondContact O-CG 3.32Å; L269-E273 PolarHBondContact O-N 2.91Å; E273-C276 PolarHBondContact O-N 2.9Å; E273-S277 VanDerWaalsContact O-CB 3.31Å; E273-S277 WeakPolarHBondContact O-CB 3.41Å; E273-S277 PolarHBondContact O-N 3.36Å
274A94.2Very high93.4Very high49 Ų49101 Ų10141%0.40550%0.496SS..Hα-helixtrans-61.3-46.3173.600000111.2K270 K271 C276 S277 D278K270-A274 VanDerWaalsContact O-CB 3.31Å; K270-A274 WeakPolarHBondContact O-CB 3.42Å; K270-A274 PolarHBondContact O-N 3.21Å; K271-A274 PolarHBondContact O-N 2.87Å; A274-C276 PolarHBondContact O-N 2.89Å; A274-S277 WeakPolarHBondContact O-CB 3.4Å; A274-S277 PolarHBondContact O-N 2.94Å; A274-D278 VanDerWaalsContact O-CG 3.27Å; A274-D278 PolarHBondContact O-N 3.34Å
275H94.9Very high92.9Very high99 Ų99100.6 Ų100.646%0.45849%0.494SS..Hα-helixtrans-60.3-44.3175.1177.4-107.3000112.5K271 E272 D278 L279K271-H275 WeakPolarHBondContact O-CB 3Å; K271-H275 PolarHBondContact O-N 2.86Å; E272-H275 PolarHBondContact O-N 3.37Å; E272-H275 IonicContact OE1-ND1 2.68Å; E272-H275 PolarHBondContact OE1-ND1 3.39Å; H275-D278 PolarHBondContact O-N 3.31Å; H275-L279 WeakPolarHBondContact O-CB 3.38Å; H275-L279 PolarHBondContact O-N 3.29Å
276C91.7Very high92.2Very high58 Ų58100.8 Ų100.839%0.39250%0.495SS..Hα-helixtrans-62.5-41.8174.7-73.90000112E272 E273 A274 L279 Q280E272-C276 WeakPolarHBondContact O-CB 3.31Å; E272-C276 PolarHBondContact O-N 2.92Å; E272-C276 PolarHBondContact O-SG 3.47Å; E273-C276 PolarHBondContact O-N 2.9Å; A274-C276 PolarHBondContact O-N 2.89Å; C276-L279 PolarHBondContact O-N 3.06Å; C276-Q280 WeakPolarHBondContact O-CB 3.32Å; C276-Q280 VanDerWaalsContact O-CG 3.3Å; C276-Q280 WeakPolarHBondContact O-CG 3.48Å; C276-Q280 PolarHBondContact O-N 3.48Å
277S91.8Very high91.5Very high49 Ų49101 Ų10134%0.34350%0.499SS..Hα-helixtrans-60.9-46.3174.31700000111.1E273 A274 L279 Q280 Q281E273-S277 VanDerWaalsContact O-CB 3.31Å; E273-S277 WeakPolarHBondContact O-CB 3.41Å; E273-S277 PolarHBondContact O-N 3.36Å; A274-S277 WeakPolarHBondContact O-CB 3.4Å; A274-S277 PolarHBondContact O-N 2.94Å; S277-L279 VanDerWaalsContact C-N 3.33Å; S277-L279 PolarHBondContact O-N 3.33Å; S277-Q280 WeakPolarHBondContact O-CB 3.49Å; S277-Q280 PolarHBondContact O-N 3.41Å; S277-Q281 WeakPolarHBondContact O-CG 3.45Å; S277-Q281 PolarHBondContact O-N 3.48Å
278D92.3Very high90.8Very high84 Ų84106 Ų10645%0.44951%0.51SS..Hα-helixtrans-61.2-43.2176.4-69.3-15.3000111.2A274 H275 Q281 Q282A274-D278 VanDerWaalsContact O-CG 3.27Å; A274-D278 PolarHBondContact O-N 3.34Å; H275-D278 PolarHBondContact O-N 3.31Å; D278-Q281 WeakPolarHBondContact O-CB 3.5Å; D278-Q281 PolarHBondContact O-N 3.43Å; D278-Q282 WeakPolarHBondContact O-CG 3.38Å; D278-Q282 PolarHBondContact O-N 3.49Å
279L90.1Very high90Very high85 Ų85103.2 Ų103.245%0.44550%0.502SS..Hα-helixtrans-66.5-38.2177.1-149.575000111.7H275 C276 S277 Q282 V283H275-L279 WeakPolarHBondContact O-CB 3.38Å; H275-L279 PolarHBondContact O-N 3.29Å; C276-L279 PolarHBondContact O-N 3.06Å; S277-L279 VanDerWaalsContact C-N 3.33Å; S277-L279 PolarHBondContact O-N 3.33Å; L279-Q282 WeakPolarHBondContact O-CB 3.38Å; L279-Q282 PolarHBondContact O-N 3Å; L279-V283 WeakPolarHBondContact O-CG2 3.32Å; L279-V283 PolarHBondContact O-N 3.33Å
280Q89Confident88.8Confident127 Ų127103.4 Ų103.459%0.59350%0.503SS*.Hα-helixtrans-62.3-44.6172.2-80.1176.2-7.900111.4C276 S277 Q282 V283 E284C276-Q280 WeakPolarHBondContact O-CB 3.32Å; C276-Q280 VanDerWaalsContact O-CG 3.3Å; C276-Q280 WeakPolarHBondContact O-CG 3.48Å; C276-Q280 PolarHBondContact O-N 3.48Å; S277-Q280 WeakPolarHBondContact O-CB 3.49Å; S277-Q280 PolarHBondContact O-N 3.41Å; Q280-Q282 VanDerWaalsContact C-N 3.31Å; Q280-Q282 PolarHBondContact O-N 3.01Å; Q280-V283 PolarHBondContact O-N 2.96Å; Q280-E284 WeakPolarHBondContact O-CB 3.48Å; Q280-E284 WeakPolarHBondContact O-CG 3.46Å; Q280-E284 PolarHBondContact O-N 3.38Å
281Q89.6Confident87.6Confident114 Ų114102.3 Ų102.353%0.53350%0.5SS..Hα-helixtrans-59.6-42.1174-72.617723.600111.4S277 D278 E284 E285S277-Q281 WeakPolarHBondContact O-CG 3.45Å; S277-Q281 PolarHBondContact O-N 3.48Å; D278-Q281 WeakPolarHBondContact O-CB 3.5Å; D278-Q281 PolarHBondContact O-N 3.43Å; Q281-E284 PolarHBondContact O-N 3.29Å; Q281-E285 VanDerWaalsContact O-CB 3.31Å; Q281-E285 WeakPolarHBondContact O-CB 3.39Å; Q281-E285 PolarHBondContact O-N 2.8Å
282Q89.3Confident86Confident106 Ų106102.1 Ų102.150%0.49550%0.502SS..Hα-helixtrans-62.4-42.9174.4-71172.538.700111.9D278 L279 Q280 E285 L286D278-Q282 WeakPolarHBondContact O-CG 3.38Å; D278-Q282 PolarHBondContact O-N 3.49Å; L279-Q282 WeakPolarHBondContact O-CB 3.38Å; L279-Q282 PolarHBondContact O-N 3Å; Q280-Q282 VanDerWaalsContact C-N 3.31Å; Q280-Q282 PolarHBondContact O-N 3.01Å; Q282-E285 PolarHBondContact O-N 3.14Å; Q282-L286 WeakPolarHBondContact O-CB 3.41Å; Q282-L286 VanDerWaalsContact O-CG 3.22Å; Q282-L286 WeakPolarHBondContact O-CG 3.29Å; Q282-L286 PolarHBondContact O-N 3.34Å
283V87.8Confident84.3Confident71 Ų71102.3 Ų102.343%0.4351%0.51SS..Hα-helixtrans-64.5-42175.71690000111.2L279 Q280 L286 K287L279-V283 WeakPolarHBondContact O-CG2 3.32Å; L279-V283 PolarHBondContact O-N 3.33Å; Q280-V283 PolarHBondContact O-N 2.96Å; V283-L286 PolarHBondContact O-N 2.87Å; V283-K287 HydrophobicContact CG1-CD 4.28Å; V283-K287 HydrophobicContact CG1-CG 4.46Å; V283-K287 WeakPolarHBondContact O-CB 3.37Å; V283-K287 VanDerWaalsContact O-CG 3.3Å; V283-K287 WeakPolarHBondContact O-CG 3.3Å; V283-K287 PolarHBondContact O-N 3.35Å
284E87.1Confident82.2Confident112 Ų112103.3 Ų103.352%0.52352%0.515SS..Hα-helixtrans-66.4-39.3175.5-76.6-175.7-178.900112.2Q280 Q281 K287 R288Q280-E284 WeakPolarHBondContact O-CB 3.48Å; Q280-E284 WeakPolarHBondContact O-CG 3.46Å; Q280-E284 PolarHBondContact O-N 3.38Å; Q281-E284 PolarHBondContact O-N 3.29Å; E284-K287 PolarHBondContact O-N 3.45Å; E284-R288 VanDerWaalsContact O-CB 3.3Å; E284-R288 WeakPolarHBondContact O-CB 3.37Å; E284-R288 PolarHBondContact O-N 3.49Å
285E86.9Confident79.8Confident93 Ų93104 Ų10444%0.43553%0.526SS..Hα-helixtrans-64-43.8173.3-171.4-177.3172.400111Q281 Q282 R288 K289Q281-E285 VanDerWaalsContact O-CB 3.31Å; Q281-E285 WeakPolarHBondContact O-CB 3.39Å; Q281-E285 PolarHBondContact O-N 2.8Å; Q282-E285 PolarHBondContact O-N 3.14Å; E285-R288 PolarHBondContact O-N 3.13Å; E285-K289 HydrophobicContact CG-CD 4.34Å; E285-K289 WeakPolarHBondContact O-CB 3.46Å; E285-K289 VanDerWaalsContact O-CG 3.29Å; E285-K289 WeakPolarHBondContact O-CG 3.43Å; E285-K289 PolarHBondContact O-N 2.75Å; E285-K289 VanDerWaalsContact OE1-CE 3.23Å; E285-K289 WeakPolarHBondContact OE1-CE 3.25Å; E285-K289 IonicContact OE1-NZ 3.63Å; E285-K289 PolarHBondContact OE1-NZ 3.41Å
286L83.8Confident77.2Confident113 Ų113104.7 Ų104.759%0.59254%0.537SS*.Hα-helixtrans-63.9-39.7173.9-73.4171000111.9Q282 V283 K289 L290Q282-L286 WeakPolarHBondContact O-CB 3.41Å; Q282-L286 VanDerWaalsContact O-CG 3.22Å; Q282-L286 WeakPolarHBondContact O-CG 3.29Å; Q282-L286 PolarHBondContact O-N 3.34Å; V283-L286 PolarHBondContact O-N 2.87Å; L286-K289 PolarHBondContact O-N 2.94Å; L286-L290 VanDerWaalsContact O-CB 3.28Å; L286-L290 WeakPolarHBondContact O-CB 3.32Å; L286-L290 PolarHBondContact O-N 3.27Å
287K82.6Confident74.4Confident127 Ų127110.4 Ų110.455%0.55256%0.556SS**Hα-helixtrans-63.8-42.6172.6-79.3178.1178.7-179.40111.7V283 E284 L290 E291V283-K287 HydrophobicContact CG1-CD 4.28Å; V283-K287 HydrophobicContact CG1-CG 4.46Å; V283-K287 WeakPolarHBondContact O-CB 3.37Å; V283-K287 VanDerWaalsContact O-CG 3.3Å; V283-K287 WeakPolarHBondContact O-CG 3.3Å; V283-K287 PolarHBondContact O-N 3.35Å; E284-K287 PolarHBondContact O-N 3.45Å; K287-L290 CarbonylContact O-C 3.59Å; K287-L290 WeakPolarHBondContact O-CB 3.49Å; K287-L290 PolarHBondContact O-N 3.39Å; K287-L290 VanDerWaalsContact O-N 3.15Å; K287-E291 WeakPolarHBondContact O-CB 3.34Å; K287-E291 WeakPolarHBondContact O-CG 3.49Å; K287-E291 PolarHBondContact O-N 3.32Å
288R80.6Confident71.4Confident156 Ų156113 Ų11359%0.58958%0.58SS**Hα-helixtrans-63.7-41.7176.1-158.5-167.4-41.2-106.1-3.9111.2E284 E285 L290 E291 E292E284-R288 VanDerWaalsContact O-CB 3.3Å; E284-R288 WeakPolarHBondContact O-CB 3.37Å; E284-R288 PolarHBondContact O-N 3.49Å; E285-R288 PolarHBondContact O-N 3.13Å; R288-L290 VanDerWaalsContact C-N 3.34Å; R288-E291 CarbonylContact O-C 3.56Å; R288-E291 PolarHBondContact O-N 3.36Å; R288-E292 VanDerWaalsContact O-CB 3.27Å; R288-E292 WeakPolarHBondContact O-CB 3.3Å; R288-E292 PolarHBondContact O-N 2.96Å
289K80Confident68.1Low99 Ų99114.4 Ų114.443%0.4360%0.596SS.*Hα-helixtrans-64.4-37.2171.6-72.8171.3-176.7166.40111.7E285 L286 E292 V293E285-K289 HydrophobicContact CG-CD 4.34Å; E285-K289 WeakPolarHBondContact O-CB 3.46Å; E285-K289 VanDerWaalsContact O-CG 3.29Å; E285-K289 WeakPolarHBondContact O-CG 3.43Å; E285-K289 PolarHBondContact O-N 2.75Å; E285-K289 VanDerWaalsContact OE1-CE 3.23Å; E285-K289 WeakPolarHBondContact OE1-CE 3.25Å; E285-K289 IonicContact OE1-NZ 3.63Å; E285-K289 PolarHBondContact OE1-NZ 3.41Å; L286-K289 PolarHBondContact O-N 2.94Å; K289-E292 PolarHBondContact O-N 3.47Å; K289-V293 VanDerWaalsContact O-CG2 3.26Å; K289-V293 WeakPolarHBondContact O-CG2 3.5Å; K289-V293 PolarHBondContact O-N 2.87Å
290L72.1Confident65.2Low105 Ų105115 Ų11555%0.5561%0.608SS.*Hα-helixtrans-69.7-39.9175.3-166.174.2000111.7L286 K287 R288 V293 Q294L286-L290 VanDerWaalsContact O-CB 3.28Å; L286-L290 WeakPolarHBondContact O-CB 3.32Å; L286-L290 PolarHBondContact O-N 3.27Å; K287-L290 CarbonylContact O-C 3.59Å; K287-L290 WeakPolarHBondContact O-CB 3.49Å; K287-L290 PolarHBondContact O-N 3.39Å; K287-L290 VanDerWaalsContact O-N 3.15Å; R288-L290 VanDerWaalsContact C-N 3.34Å; L290-V293 CarbonylContact O-C 3.52Å; L290-V293 PolarHBondContact O-N 3.29Å; L290-Q294 WeakPolarHBondContact O-CB 3.37Å; L290-Q294 PolarHBondContact O-N 3.42Å
291E69.9Low62.4Low131 Ų131115.7 Ų115.761%0.61262%0.616SS**Hα-helixtrans-67.7-32.8172.1-78.9177-179.100111.8K287 R288 Q294 G295K287-E291 WeakPolarHBondContact O-CB 3.34Å; K287-E291 WeakPolarHBondContact O-CG 3.49Å; K287-E291 PolarHBondContact O-N 3.32Å; R288-E291 CarbonylContact O-C 3.56Å; R288-E291 PolarHBondContact O-N 3.36Å; E291-Q294 CarbonylContact O-C 3.51Å; E291-Q294 PolarHBondContact O-N 3.3Å; E291-G295 VanDerWaalsContact O-CA 3.32Å; E291-G295 WeakPolarHBondContact O-CA 3.42Å; E291-G295 PolarHBondContact O-N 3.41Å
292E64.1Low59.4Low147 Ų147119 Ų11969%0.68763%0.631SS**Hα-helixtrans-69.5-34.5172.4-169.5173.4-162.900111.4R288 K289R288-E292 VanDerWaalsContact O-CB 3.27Å; R288-E292 WeakPolarHBondContact O-CB 3.3Å; R288-E292 PolarHBondContact O-N 2.96Å; K289-E292 PolarHBondContact O-N 3.47Å
293V58.6Low56.6Low112 Ų112117.9 Ų117.968%0.67964%0.64SS**Hα-helixtrans-75.9-32.6171.5173.10000112.2K289 L290K289-V293 VanDerWaalsContact O-CG2 3.26Å; K289-V293 WeakPolarHBondContact O-CG2 3.5Å; K289-V293 PolarHBondContact O-N 2.87Å; L290-V293 CarbonylContact O-C 3.52Å; L290-V293 PolarHBondContact O-N 3.29Å
294Q50Low53.8Low133 Ų133121.5 Ų121.562%0.62166%0.663SS**Hα-helixtrans-79.5-20.7171.7-87.4179.7-32.900113.1L290 E291 V296 F297L290-Q294 WeakPolarHBondContact O-CB 3.37Å; L290-Q294 PolarHBondContact O-N 3.42Å; E291-Q294 CarbonylContact O-C 3.51Å; E291-Q294 PolarHBondContact O-N 3.3Å; Q294-V296 PolarHBondContact O-N 2.82Å; Q294-V296 VanDerWaalsContact O-N 3.12Å; Q294-F297 PolarHBondContact O-N 3.37Å
295G43.7Very low51.1Low62 Ų62119.6 Ų119.664%0.63967%0.673SS**THydrogen-bonded Turntrans-70.7-0.9-179.700000115E291E291-G295 VanDerWaalsContact O-CA 3.32Å; E291-G295 WeakPolarHBondContact O-CA 3.42Å; E291-G295 PolarHBondContact O-N 3.41Å
296V40.8Very low48.6Very low114 Ų114126.2 Ų126.269%0.69169%0.694SS**THydrogen-bonded Turntrans-90.8-3168.5-177.90000112.1Q294Q294-V296 PolarHBondContact O-N 2.82Å; Q294-V296 VanDerWaalsContact O-N 3.12Å
297F32.5Very low46.1Very low179 Ų179126.8 Ų126.879%0.78570%0.697SS**SBendtrans-12588.7173.5-74.5-81.5000113.2Q294Q294-F297 PolarHBondContact O-N 3.37Å
298A28.8Very low44.1Very low103 Ų103131 Ų13185%0.85171%0.71SS**  trans75.4133.9144.400000121.6
299S23.6Very low42Very low113 Ų113129.8 Ų129.879%0.7972%0.72SS**  trans-91.7158.2171.753.10000114
300S29Very low39.8Very low99 Ų99136.1 Ų136.169%0.69274%0.741SS**  trans116.3129.6137.6-131.20000120.6
301N28.8Very low38Very low141 Ų141140.5 Ų140.575%0.75476%0.755SS**  trans79.3117.6149.2-59.9-4.2000119.8
302E26.6Very low36.4Very low182 Ų182140.3 Ų140.385%0.8576%0.763SS**  90.6116.154.3-85.7-94.6148.200114.4
303A30.5Very low35.7Very low83 Ų83138.5 Ų138.569%0.68676%0.764SS**  trans141.2102.713500000117.4
304T30.2Very low34.4Very low148 Ų148138 Ų13891%0.90877%0.771SS**  46.7136.1125.2-130000120.8
305G30.6Very low33.4Very low71 Ų71135.2 Ų135.273%0.73278%0.778SS**  cis175.2160.97.800000105.8
306R33Very low33.3Very low233 Ų233137.7 Ų137.788%0.87979%0.786SS**  178.1147.353.8-153.5-174.7-79-133.91.3108.8
307D32.8Very low32.9Very low124 Ų124140.6 Ų140.666%0.66380%0.797SS**  trans69.3131.1147.7-98.613.5000120.8
308R40.2Very low33.2Very low215 Ų215137.1 Ų137.181%0.81180%0.795SS**  cis-154.2137.720-68.9-175.2168.4176.4-4.9113.8
309V35.3Very low33.4Very low132 Ų132138.2 Ų138.280%0.879%0.79SS**  41.1122.6124.8-170.40000118.9
310R34.4Very low33.7Very low231 Ų231139.8 Ų139.887%0.87279%0.79SS**  -163.9115.782.3-167.2170.4-169.61622.1115
311K35.1Very low33.9Very low197 Ų197140.2 Ų140.286%0.85779%0.793SS**  trans49.7112.7144.3-90.1-176.8168.8-1770122.4
312V35.3Very low34.2Very low127 Ų127141.1 Ų141.177%0.7780%0.796SS**  trans-79.5180136.8-150.10000106.6
313P49.4Very low34.5Very low109 Ų109141.4 Ų141.471%0.70880%0.795SS**  cis-151.3171.114.645.2-23.2000120.6
314A30.8Very low34.5Very low101 Ų101143.4 Ų143.484%0.83580%0.798SS**  47.3145.812900000122.4
315G29.1Very low34.9Very low75 Ų75144 Ų14477%0.77379%0.791SS**  trans145.386.1139.100000114
316S42.1Very low34.9Very low114 Ų114146.7 Ų146.780%0.79779%0.788SS**  trans-59135.5153.557.80000110.1
317L32.3Very low35.2Very low175 Ų175143.2 Ų143.292%0.91679%0.785SS**  trans-142.7114.6145.3-79.7178.4000108.2
318S39.7Very low35.3Very low106 Ų106146.5 Ų146.574%0.74180%0.797SS**  trans-72162.6154.352.20000109.9
319V31.8Very low35Very low126 Ų126139.7 Ų139.776%0.76479%0.794SS**  trans151.796.1140167.70000108.9
320D30.9Very low34.9Very low147 Ų147140.3 Ų140.379%0.78679%0.792SS**  46147.6119-77.7-21.1000124.8
321S32.6Very low35.2Very low108 Ų108137.6 Ų137.676%0.75579%0.789SS**  trans87.4126.2155.9-55.30000114.9
322I36.4Very low35.1Very low160 Ų160133.3 Ų133.382%0.82179%0.79SS**  -157.8114.955.6-75161000109.8
323K32Very low35.4Very low188 Ų188132.4 Ų132.482%0.81779%0.79SS**  12.8123.4120.9-68.4-173.6173.3-171.10119.1
324V31.4Very low34.8Very low124 Ų124136.3 Ų136.375%0.75280%0.798SS**  60.6139.888.8-1510000115.8
325E37.3Very low35.2Very low162 Ų162140.1 Ų140.176%0.75780%0.799SS**  trans94.5145.5155.2-59.3-168.9-174.900115.4
326D31.4Very low36Very low127 Ų127142.1 Ų142.168%0.67980%0.798SS**  cis-172.8168.9-11-104.6-20.3000105
327I39.4Very low35.9Very low160 Ų160146 Ų14682%0.82180%0.801SS**  157.8109.9124.8-76.5164.7000110.6
328E34.4Very low36.6Very low193 Ų193143.2 Ų143.290%0.90279%0.793SS**  trans-74.2158.5152.6-76.2178.2124.400112.5
329G34.1Very low36.2Very low72 Ų72146.9 Ų146.974%0.74280%0.799SS**  trans87.6138.1149.900000116.6
330D32.8Very low36.2Very low145 Ų145145.2 Ų145.278%0.77579%0.793SS**  cis-164.2165.717.9-155.221.4000112.8
331H40.8Very low36.3Very low174 Ų174147.8 Ų147.881%0.80679%0.792SS**  trans-32.7144.2-172.4-68.4-73.3000124
332A32.9Very low36.2Very low106 Ų106148.6 Ų148.688%0.87680%0.797SS**  -165.3150.4113.800000113.1
333S41.8Very low37Very low109 Ų109147 Ų14776%0.76280%0.797SS**  trans-78.6144.2-163.4-174.70000116.6
334E36.1Very low36.9Very low190 Ų190141.3 Ų141.389%0.88879%0.792SS**  174139.7106.2-90.7-167155.500113.4
335Q40.9Very low37.1Very low182 Ų182144.7 Ų144.785%0.8580%0.799SS**  trans-85.9179.5178-109.1-172-17.700112.2
336P46.1Very low37.2Very low116 Ų116141 Ų14175%0.75380%0.796SS**  cis-135.7171.8-5.924.61000117.7
337K38.4Very low37.3Very low197 Ų197143 Ų14386%0.85781%0.807SS**  trans-52.5-176.6173.7-97.1174.2-178.2172.30119
338P47.9Very low37Very low116 Ų116138.7 Ų138.775%0.75380%0.802SS**  cis-141.1167.7-17.330.4-9.3000116.2
339Q30.2Very low37Very low183 Ų183137.7 Ų137.786%0.85580%0.802SS**  trans-152.3141.9149.4-153.4165.5-10.700114.7
340S33Very low37Very low91 Ų91142 Ų14264%0.63680%0.802SS**  trans-64.5154.7175.11620000114.4
341Y31.8Very low37Very low200 Ų200142 Ų14278%0.78480%0.8SS**  169.4145.1123.8-94.2-72000112.2
342C30.7Very low36.5Very low125 Ų125138.9 Ų138.985%0.84580%0.797SS**  trans-132.6157.8155.9-85.80000110.4
343P53Low36.3Very low126 Ų126139 Ų13982%0.81879%0.792SS**  trans-117.6179.8-159.532.2-11.9000115.8
344G31.5Very low35.9Very low69 Ų69138.9 Ų138.971%0.71179%0.786SS**  trans-68.3179.6178.100000115.6
345E35.4Very low35.6Very low196 Ų196138.3 Ų138.392%0.91678%0.783SS**  -161.4168.351-66-179127.100115.1
346A38.1Very low35.1Very low83 Ų83134.9 Ų134.969%0.68678%0.779SS**  trans78.7121.8140.600000125.4
347N33.6Very low34.4Very low171 Ų171136.9 Ų136.991%0.91478%0.778SS**  173.7146.9113.7-90.4-22.3000114.8
348G32.7Very low34.2Very low69 Ų69135.4 Ų135.471%0.71177%0.772SS**  trans-97.4171.117800000115.2
349L35.2Very low33.2Very low172 Ų172137.2 Ų137.290%0.90177%0.772SS**  171.4145.594.1-89169.5000113.7
350H34.8Very low33.1Very low161 Ų161132.3 Ų132.375%0.74576%0.758SS**  trans74.9124.2131.5-146.3-108.3000127.5
351M31.7Very low32.9Very low147 Ų147133.2 Ų133.272%0.72476%0.763SS**  trans63.9118.9142.4-69.1-63.8158.100129.5
352S30.5Very low32.9Very low108 Ų108131 Ų13176%0.75576%0.76SS**  55.5140121-151.10000126.3
353S29.2Very low32.9Very low108 Ų108130.3 Ų130.376%0.75575%0.748SS**  trans92.4135.9147.6-153.30000117.7
354V33.2Very low31.8Very low107 Ų107127.5 Ų127.565%0.64874%0.742SS**  cis-172.7156.8-1.2134.20000109.4
355H29.4Very low31.8Very low177 Ų177130.2 Ų130.282%0.81974%0.74SS**  trans75.8111.1157.3-75.4-38.8000124
356S30.2Very low31.8Very low110 Ų110128.4 Ų128.477%0.76973%0.731SS**  120.8135.1112.3-142.50000118.4
357E32Very low31.5Very low159 Ų159128.6 Ų128.674%0.74373%0.733SS**  trans79.2104.6164.3-69.4-160.9115.600121
358K33.6Very low31.5Very low166 Ų166128 Ų12872%0.72273%0.725SS**  80.2123.7120-139.4167.2-173.5178.10115.8
359M27.8Very low31.5Very low153 Ų153130.9 Ų130.975%0.75473%0.729SS**  cis-159.7137.47.7-145.713173.300108
360S27.3Very low31.3Very low81 Ų81127 Ų12757%0.56672%0.716SS**  trans35.6118.7134.6-146.10000118.3
361C30.1Very low31.2Very low110 Ų110127 Ų12774%0.74372%0.72SS**  46136.567-54.60000111.8
362Q31.8Very low31.3Very low153 Ų153123.5 Ų123.572%0.71571%0.711SS**  163157.687.4-87-165.9-1.400105.2
363N30.6Very low31.4Very low111 Ų111126.4 Ų126.459%0.59471%0.712SS**  cis-168.5146.2-7.9-105.7-13.4000101.4
364G29.8Very low31.7Very low66 Ų66126.7 Ų126.768%0.6871%0.714SS**  86.2156.669.300000108.1
365N31.6Very low31.6Very low127 Ų127124.9 Ų124.968%0.67972%0.717SS**  cis-160.6136.60.2-101.70.8000102.9
366E33.9Very low31.8Very low157 Ų157121.5 Ų121.573%0.73472%0.72SS**  57.7128.4100.8-55-153.1144.600116.2
367A32.9Very low31.9Very low88 Ų88120.7 Ų120.773%0.72772%0.72SS**  159.5112.9115.200000107
368Q34.1Very low32.3Very low159 Ų159122.5 Ų122.574%0.74373%0.726SS**  107.2151.961-95.1-167.426.700110.6
369T31Very low33Very low129 Ų129120.2 Ų120.279%0.79173%0.728SS**  trans84.7134.916771.50000116.9
370S31.4Very low33.2Very low90 Ų90117.2 Ų117.263%0.62972%0.722SS**  cis179.4145-11.947.70000108.5
371L33.3Very low33.7Very low160 Ų160122.3 Ų122.384%0.83874%0.737SS**  trans65.3138.9151.5-60.3153.4000117.3
372S33.2Very low33.7Very low74 Ų74122.8 Ų122.852%0.51774%0.741SS.*  cis-176.1147.711.3-1110000110
373H33.2Very low33.9Very low169 Ų169127.2 Ų127.278%0.78275%0.751SS**  trans62.6142.8148.2-59.7-47.6000119.6
374S34.7Very low34Very low114 Ų114127.6 Ų127.680%0.79776%0.763SS**  cis-175.6152-3.5-76.80000102.8
375G30.8Very low34.2Very low69 Ų69129.9 Ų129.971%0.71177%0.768SS**  cis-178.9155.82.700000108
376A35.3Very low35.2Very low107 Ų107130 Ų13088%0.88478%0.776SS**  trans57.5141.5139.500000120.5
377A31.6Very low35.1Very low93 Ų93127.9 Ų127.977%0.76978%0.777SS**  cis-166.9146.3-9.100000107
378F40.1Very low35.1Very low197 Ų197130.6 Ų130.686%0.86479%0.785SS**  trans-69.3164.4156.9-64.1-86.8000109.5
379P48.3Very low34.9Very low117 Ų117128.3 Ų128.376%0.7679%0.786SS**  -138.5148.783.510.914.2000111.9
380S33.2Very low35.9Very low91 Ų91127.8 Ų127.864%0.63679%0.786SS**  cis101.4121.548.378.80000113.4
381Q37.2Very low35.8Very low188 Ų188129.6 Ų129.688%0.87979%0.793SS**  trans66.5146.6150.5-63.6178.30.700117.1
382S30.7Very low35.8Very low119 Ų119129.8 Ų129.883%0.83279%0.793SS**  cis-166.6165.531.738.50000110.5
383R34.3Very low35.9Very low246 Ų246131.4 Ų131.493%0.92881%0.812SS**  trans-78.3152176.9-67.6172.4164.5178.2-5112.7
384S33.6Very low35.9Very low119 Ų119132.2 Ų132.283%0.83281%0.813SS**  trans-166.6130.8139560000112.7
385S34Very low35.7Very low115 Ų115131.8 Ų131.880%0.80481%0.808SS**  trans-85.6166.3156.9-47.80000109.3
386P52.3Low35.6Very low129 Ų129133.9 Ų133.984%0.83881%0.808SS**  -149173.173.534.4-11.6000116.8
387C32.2Very low35.3Very low113 Ų113135.3 Ų135.376%0.76481%0.806SS**  trans-58.1146.4179.1-50.10000115.5
388T32.1Very low35.3Very low145 Ų145134.4 Ų134.489%0.8981%0.805SS**  173.1134.2121.124.70000112
389S31.3Very low34.9Very low110 Ų110130.6 Ų130.677%0.76980%0.803SS**  trans-99.5166.8156.7-70.40000107.1
390P51.6Low34.3Very low119 Ų119131.9 Ų131.977%0.77381%0.808SS**  cis-151.6-173.436.631.1-3.8000117.2
391V29.4Very low34.3Very low128 Ų128132.4 Ų132.478%0.77681%0.812SS**  trans126.2127.4140.4-175.80000116.8
392L33.8Very low34.1Very low163 Ų163132.6 Ų132.685%0.85381%0.813SS**  trans-20.4139167.6-86.967.4000119.1
393A34.7Very low34.1Very low109 Ų109130.9 Ų130.990%0.90181%0.814SS**  -152.9155.6129.400000111.1
394K32.8Very low34Very low186 Ų186122.3 Ų122.381%0.80980%0.802SS**  trans-122.4156.3-153.2-148.9-177.3-179177.30108.5
395C30.5Very low34.2Very low104 Ų104128.1 Ų128.170%0.70381%0.808SS**  trans74.3145.9158.4-56.70000116.4
396T28.7Very low34.1Very low114 Ų114131.6 Ų131.670%0.69981%0.811SS**  cis-176.2162.8-1.319.80000108.3
397T29.4Very low33.1Very low137 Ų137130 Ų13084%0.8480%0.803SS**  trans79.5125.1144.447.20000123.2
398G31.6Very low33.6Very low73 Ų73130.1 Ų130.175%0.75380%0.803SS**  trans106.585.4142.500000115.9
399S32.5Very low34Very low117 Ų117133.9 Ų133.982%0.81880%0.802SS**  51.4102.586.5-177.70000115.7
400V33.9Very low34.3Very low145 Ų145137.9 Ų137.988%0.87981%0.809SS**  -160.2138.8127.8172.10000109.3
401S33.1Very low33.7Very low101 Ų101137 Ų13771%0.70681%0.811SS**  trans-67148.1-176.3-43.40000116.2
402Q33.9Very low34.2Very low192 Ų192134.1 Ų134.190%0.89781%0.808SS**  150.5126.5116.9-85.3-171.9-14.400113.5
403G30.7Very low35Very low84 Ų84134.3 Ų134.387%0.86681%0.808SS**  trans90.4115.9137.200000119
404G31.5Very low35.5Very low66 Ų66136.7 Ų136.768%0.6881%0.805SS**  trans122104.3142.800000116.7
405Y37.6Very low36.2Very low241 Ų241137.2 Ų137.295%0.94581%0.81SS**  trans45.8112149.4-67.1-89.6000119.3
406Q31.9Very low37.2Very low188 Ų188143.3 Ų143.388%0.87982%0.819SS**  trans-127.1126.5162-93.1-85.8-6.700111
407S33Very low38.1Very low96 Ų96147.3 Ų147.367%0.67183%0.827SS**  trans-65.1152.2171.8179.90000111.2Y409S407-Y409 PolarHBondContact O-N 2.94Å
408P41.6Very low38.9Very low115 Ų115150.3 Ų150.375%0.74783%0.831SS**SBendtrans-94.678.4-168.337.3-31000111.1
409Y39.7Very low39.2Very low223 Ų223151.9 Ų151.988%0.87584%0.837SS**  trans-149.7132.1155.9-103.4-86.5000108.6S407S407-Y409 PolarHBondContact O-N 2.94Å
410Q38.7Very low39.5Very low195 Ų195150.7 Ų150.791%0.91183%0.834SS**  trans102.784.1166.8-155.31672.900117.6
411A39.8Very low39.6Very low100 Ų100154.7 Ų154.783%0.82683%0.834SS**  trans-176.3121.9131.100000107.5
412G40Very low39.8Very low68 Ų68157.8 Ų157.870%0.70184%0.836SS**  cis90.783.13600000109N414G412-N414 PolarHBondContact O-N 2.92Å
413I49.4Very low40.3Very low167 Ų167157.6 Ų157.686%0.85683%0.833SS**SBendtrans32.180.9147.1-82.1150.3000114.5
414N45.4Very low40.4Very low159 Ų159163 Ų16385%0.8583%0.832SS**  trans-177.357.7153.5-92.9-29.9000112.1G412G412-N414 PolarHBondContact O-N 2.92Å
415Q47.8Very low40.6Very low196 Ų196169.2 Ų169.292%0.91684%0.844SS**  trans-142.367.8162.7-80.2-166.821.200110.7
416R51.6Low40.4Very low233 Ų233161.2 Ų161.288%0.87984%0.835SS**  trans-132.292.1157.7-72.3-173.5-159.7-124.12.1106.4
417F47.1Very low40.3Very low197 Ų197158.2 Ų158.286%0.86483%0.834SS**SBendtrans157.273.2153-92.5-71.4000108.6
418H46.3Very low40.2Very low200 Ų200163.3 Ų163.393%0.92685%0.845SS**  trans-168.889.7153.6-85.5-54.2000108.1
419A38.6Very low39.7Very low106 Ų106166.3 Ų166.388%0.87685%0.849SS**  trans173.286.2149.500000109.3
420A36.9Very low39.8Very low92 Ų92161.4 Ų161.476%0.7685%0.845SS**  trans-144.986.6154.100000106.3
421W37Very low39.4Very low230 Ų230159.5 Ų159.587%0.87184%0.841SS**  trans-163.9141.3158.3-116.883000109.3
422H36.5Very low39Very low165 Ų165160.8 Ų160.876%0.76484%0.843SS**  trans94.395.6178.7-66.7-81.2000118.4
423K45.6Very low38.5Very low189 Ų189166.1 Ų166.182%0.82285%0.85SS**  trans-103.9157.3144.1-73.8-160.1172.2-153.50109.6
424F32.9Very low37.6Very low196 Ų196164.8 Ų164.886%0.8685%0.85SS**  trans81.394.6163.2-85.2-86.3000118.8
425Q35.5Very low36.9Very low197 Ų197164.9 Ų164.992%0.92185%0.845SS**  trans-151.1126.6131.8-138.4157.724.700108.8
426G33.1Very low36.8Very low73 Ų73161 Ų16175%0.75384%0.837SS**  trans-72.1146.5178.200000111.4
427S29.6Very low35.8Very low125 Ų125153.4 Ų153.487%0.87482%0.824SS**  trans-103.4112.3169.8-165.60000108.6
428F31.4Very low35.1Very low203 Ų203152.1 Ų152.189%0.8982%0.82SS**PPolyproline II helixtrans-76.1149.8160.9-99.9-93.5000109.6
429E31Very low35.2Very low179 Ų179147.4 Ų147.484%0.83681%0.808SS**PPolyproline II helixtrans-85.3148.3170.5-148.2-157.7-175.100110.1
430P42.5Very low35.2Very low120 Ų120148.2 Ų148.278%0.77980%0.801SS**PPolyproline II helixtrans-96.3145.4174.734.3-27.8000114.2
431D29.7Very low35.7Very low155 Ų155148.3 Ų148.383%0.82979%0.794SS**PPolyproline II helixtrans-49.4157.8-179-99.9-45.8000119.7
432S31.3Very low35.3Very low126 Ų126144.1 Ų144.188%0.88179%0.788SS**  trans-156.387.7136.8-76.90000112.9
433Q30.2Very low35.1Very low180 Ų180143.3 Ų143.384%0.84179%0.789SS**  trans17131.8135.6-159.7172.4700121.5
434V29.5Very low34.5Very low140 Ų140139 Ų13985%0.84878%0.783SS**  -177.1136.1114.4158.40000110.6
435Q30.7Very low35.3Very low160 Ų160135.3 Ų135.375%0.74878%0.778SS**  trans-105.2174.5-178.5-124.8-154.149.600110.7
436P45.5Very low35.2Very low116 Ų116135.3 Ų135.375%0.75378%0.775SS**  -154.115961.838.1-14.6000121
437A30.7Very low34.9Very low73 Ų73139.2 Ų139.260%0.60377%0.774SS**  trans62108.5137.700000122.3
438Q33.5Very low35Very low169 Ų169141.8 Ų141.879%0.7978%0.776SS**  86.6157.587.9-75.2-81.3-13.100114.3
439P48.6Very low34.9Very low102 Ų102136.8 Ų136.866%0.66277%0.767SS**  cis-140.5154.4-10.435.4-14.5000117.8
440V37.3Very low36Very low123 Ų123133.8 Ų133.875%0.74576%0.763SS**  71.7153.6128.6169.90000119.9
441P48.9Very low35.4Very low93 Ų93134.2 Ų134.260%0.60476%0.763SS**  cis-149-179.1-34.741.7-21.9000117.7
442L27.8Very low35.4Very low142 Ų142132.6 Ų132.674%0.74376%0.759SS**  93.4142.3128.1-102.3152.5000123.7
443L33Very low35.4Very low149 Ų149131.7 Ų131.778%0.7875%0.752SS**  trans90128.7157.9-57.1165.1000116.5
444S32Very low35.4Very low99 Ų99128.2 Ų128.269%0.69275%0.748SS**  cis134.3155.60.759.30000108.7
445P50.4Low35.7Very low118 Ų118127 Ų12777%0.76675%0.746SS**  trans-111.7156.9-153.939.4-28.9000115
446K31.7Very low35.7Very low196 Ų196124.7 Ų124.785%0.85275%0.747SS**  trans-177.9115.7153.7-133.4129.3171.4170.40111.6
447E28.3Very low35.8Very low156 Ų156124.3 Ų124.373%0.72975%0.745SS**  59.1114.695.7-75.5-82.6161.600116.3
448L31.8Very low35.8Very low178 Ų178129.5 Ų129.593%0.93276%0.757SS**  trans-156.4123.7140-79-176.6000109.7
449S29.5Very low35.8Very low98 Ų98125.8 Ų125.869%0.68576%0.755SS**  trans-101.1-168.5166.7-53.60000109.7
450P53.5Low35Very low116 Ų116126 Ų12675%0.75376%0.759SS**  cis-143.1-166.9-7.427.7-0.8000115.9
451V28.7Very low35.2Very low129 Ų129125.6 Ų125.678%0.78276%0.759SS**  trans99.3120.7156-177.60000114.6
452T30.9Very low34.7Very low121 Ų121127.5 Ų127.574%0.74277%0.768SS**  cis-143.5143.741.241.60000115.2
453S30Very low35.3Very low107 Ų107130 Ų13075%0.74877%0.773SS**  trans-6.4143.4147.147.30000118.9
454S31.7Very low35.4Very low107 Ų107131.2 Ų131.275%0.74878%0.775SS**  -170.1150.252.2530000114.9
455S35.5Very low35.7Very low115 Ų115132.7 Ų132.780%0.80477%0.773SS**  trans69.3102.8151.362.60000122.5
456S31.3Very low35.4Very low111 Ų111132.1 Ų132.178%0.77678%0.778SS**  trans-61.4173.6149.8-128.70000112.5
457P47.4Very low35.9Very low108 Ų108133.3 Ų133.370%0.70178%0.777SS**  cis-137.5160.13035.1-12.2000119.1
458E29.9Very low36.6Very low182 Ų182130.3 Ų130.385%0.8577%0.773SS**  trans30.7139.7141-80.5173117.600120.1
459A33.3Very low37.4Very low92 Ų92128.5 Ų128.576%0.7677%0.77SS**  cis-163150.527.800000110.4
460S31.6Very low38.2Very low105 Ų105130.3 Ų130.373%0.73478%0.776SS**  trans-96.2148.6147.497.90000106.9
461P42.5Very low37.8Very low115 Ų115130.4 Ų130.475%0.74778%0.775SS**  -144.9145.96732.4-11.6000116.1K463P461-K463 PolarHBondContact O-N 3.02Å
462V37.8Very low38.6Very low133 Ų133133.3 Ų133.381%0.80678%0.78SS**  trans-11.6111.8143.91790000114.4
463K39.9Very low39Very low195 Ų195134.3 Ų134.385%0.84879%0.786SS**  trans170.793139.1-95.9166.1-175.8-178.90109.3P461P461-K463 PolarHBondContact O-N 3.02Å
464Q36.2Very low39.6Very low174 Ų174137.8 Ų137.881%0.81380%0.795SS**  trans-164.4130.7143-120.5173.1-15.800112.5
465M38.4Very low40.2Very low131 Ų131137.8 Ų137.865%0.64580%0.795SS**  trans65.884.3154.7-72.6178.9-63.200117.6R467M465-R467 VanDerWaalsContact C-N 3.32Å; M465-R467 PolarHBondContact O-N 3.2Å
466A42.9Very low40.5Very low106 Ų106143.8 Ų143.888%0.87680%0.8SS**  -54.5105.1119.600000108.8
467R42.3Very low40.8Very low220 Ų220148 Ų14883%0.8381%0.805SS**  trans-176.6102.1158.4-102.2167.2-175.5-177.51.5108.1M465M465-R467 VanDerWaalsContact C-N 3.32Å; M465-R467 PolarHBondContact O-N 3.2Å
468S42.9Very low40Very low94 Ų94148.9 Ų148.966%0.65781%0.809SS**  trans155.682.5142.9-174.70000110.4
469T48.4Very low40Very low140 Ų140146 Ų14686%0.85981%0.809SS**SBendtrans-105.3138.8142.9-48.60000104.4
470V46.2Very low39.8Very low136 Ų136148 Ų14882%0.82481%0.811SS**SBendtrans91.854.6-170-161.40000114.6
471T45.9Very low39.9Very low118 Ų118150.8 Ų150.872%0.72481%0.812SS**  trans-155.745.7142.7-23.90000112.7
472Q45.1Very low39.4Very low189 Ų189153.3 Ų153.388%0.88381%0.814SS**SBendtrans-13140.1176-72.5-167.31.200113.8
473V38.8Very low39Very low143 Ų143153 Ų15387%0.86782%0.818SS**SBendtrans-1290.2170-173.60000113.3
474L42.9Very low38.6Very low179 Ų179146.9 Ų146.994%0.93781%0.81SS**SBendtrans-130.340.7-178.1-93149.7000113.4
475S44.4Very low38.3Very low108 Ų108144.1 Ų144.176%0.75581%0.81SS**  trans-149.157.3174.2-173.40000112.5
476R42.2Very low38.1Very low240 Ų240145.9 Ų145.991%0.90682%0.819SS**  trans-141.343.4165.3-76.2-151.3175.8-120.4-0.9113.5
477F36.8Very low37.6Very low199 Ų199149.3 Ų149.387%0.87381%0.814SS**SBendtrans-138.8120.3155.2-104.2-88.7000109.4
478T31.4Very low37.2Very low128 Ų128148.5 Ų148.579%0.78582%0.819SS**  trans83.598.6166.978.20000118.1
479S29.7Very low36.6Very low122 Ų122147.7 Ų147.785%0.85383%0.826SS**  163.8127113.456.10000113.3
480V30.1Very low36.2Very low132 Ų132147.8 Ų147.880%0.883%0.827SS**  trans178.8100.4136.2152.90000104.1
481Q32.9Very low36Very low164 Ų164147.1 Ų147.177%0.76683%0.825SS**  57122.499.2-91.9-169.519.700112.4
482Q32.7Very low35.4Very low168 Ų168149.2 Ų149.279%0.78583%0.832SS**  -169.5163.152.8-115.4166.822.200114.3
483S29.3Very low35Very low126 Ų126147.5 Ų147.588%0.88183%0.829SS**  trans83.1126.117181.20000116.5
484G31.4Very low35Very low67 Ų67146 Ų14669%0.69183%0.825SS**  cis-175.1163.3-0.500000110.7
485S30.5Very low35.5Very low116 Ų116142.8 Ų142.881%0.81182%0.815SS**  trans73.5107.1164.2700000121.9
486M32.5Very low35.1Very low168 Ų168147.8 Ų147.883%0.82882%0.823SS**  81.8120.8121.3-69.4-168.113900123
487K33.7Very low34.6Very low179 Ų179139 Ų13978%0.77881%0.807SS**  trans91.794.7141.3-73.2179.1177.8-177.30120.4
488Q32.5Very low34.9Very low202 Ų202136.2 Ų136.294%0.94481%0.807SS**  29.9125.9129.1-77.7178.6-34.600121.2
489G31.2Very low35.4Very low78 Ų78137.6 Ų137.680%0.80481%0.809SS**  trans178.7122.4152.900000111.8
490T39.3Very low35.8Very low142 Ų142143 Ų14387%0.87181%0.813SS**  trans-66.1163.6-169.836.90000116.8
491P43.5Very low36.4Very low121 Ų121148 Ų14879%0.78682%0.817SS**  trans-90.1146.3-169.336.2-31.6000112.5
492N33.7Very low36.5Very low162 Ų162145 Ų14587%0.86681%0.813SS**  trans-142.5119.8159.1-150.2-10.6000110.4
493N34.8Very low36.7Very low154 Ų154145.1 Ų145.182%0.82482%0.819SS**  trans-89.6131.3172.3-79.4-52.7000108.3
494S39.8Very low36.9Very low112 Ų112143.8 Ų143.878%0.78382%0.815SS**  trans-149.5118.2157.9-1740000110.1
495P53.3Low37.2Very low110 Ų110145 Ų14571%0.71482%0.819SS**  trans-107.995.5175.534.1-19.9000109.1
496F35.4Very low38.1Very low214 Ų214144.9 Ų144.994%0.93982%0.815SS**  trans169.6136154.6-97.5-70000110.6
497G32.9Very low38.2Very low54 Ų54144.9 Ų144.956%0.55782%0.818SS**  trans109.3103.2167.100000112.9
498T43Very low38.1Very low142 Ų142141.7 Ų141.787%0.87182%0.818SS**  75103.970.661.10000114.5
499D41.1Very low38.9Very low156 Ų156137.9 Ų137.983%0.83481%0.811SS**  trans-164.5102156.832.4-13.5000111.6
500Y39.3Very low38.9Very low237 Ų237138.5 Ų138.593%0.92981%0.808SS**  trans-76.2118.7155.1-106.2-96000108.8
501R42.4Very low38.6Very low237 Ų237138.5 Ų138.589%0.89481%0.808SS**  trans171.3141.3156-109.9-174.2-149.6-1040.7107.1
502S34.5Very low38Very low99 Ų99136.4 Ų136.469%0.69281%0.809SS**  cis-158.4152.918.6-760000109.3
503L37Very low38Very low172 Ų172140.9 Ų140.990%0.90181%0.813SS**  trans-56.4143.4163.5-59161.5000111.7
504A34Very low37.8Very low97 Ų97137.6 Ų137.680%0.80281%0.808SS**  168120.5122.600000111.4
505A37.7Very low37.7Very low93 Ų93139 Ų13977%0.76981%0.812SS**  trans-75.4159.2153.100000109.3
506P49Very low36.6Very low113 Ų113137.8 Ų137.873%0.73482%0.819SS**  -147.3150.610824.3-2.2000116.6
507L33.3Very low36.8Very low169 Ų169132.3 Ų132.389%0.88581%0.814SS**  trans76.9116.7144.6-61.3161.7000120.8
508S32.5Very low37.1Very low111 Ų111136.3 Ų136.378%0.77683%0.827SS**  trans-84.6174.2152.5-60.90000109.5
509P49.7Very low37.1Very low123 Ų123135.2 Ų135.280%0.79982%0.822SS**  cis-144.1161.120.240.1-20000117.5
510A31Very low37Very low90 Ų90137.5 Ų137.574%0.74483%0.828SS**  trans-176118141.700000112.3
511T32.9Very low36.7Very low143 Ų143129.4 Ų129.488%0.87782%0.817SS**  trans21.1119.8143.642.60000120.8
512G31Very low36.5Very low77 Ų77125.5 Ų125.579%0.79482%0.819SS**  108.3110.5115.600000118
513R33.8Very low36.6Very low255 Ų255132.4 Ų132.496%0.96283%0.83SS**  trans95.5134.3146.3-129.5175.6-160.9-1794.3117.9
514A30.6Very low36.4Very low85 Ų85129.1 Ų129.170%0.70282%0.821SS**  trans98.6115.8157.200000118.5
515T37.4Very low36.5Very low142 Ų142130.6 Ų130.687%0.87182%0.823SS**  trans67.584.9141.159.70000118.2
516G30.7Very low36.6Very low85 Ų85132.6 Ų132.688%0.87683%0.826SS**  trans-93.2112.9157.100000110.6
517A38.6Very low36.2Very low99 Ų99134.7 Ų134.782%0.81883%0.829SS**  trans-94.3134.7163.100000109.1
518V39.9Very low36.2Very low137 Ų137131.8 Ų131.883%0.8382%0.823SS**  trans-144.2163.7163-142.30000107.8
519P43.7Very low36.8Very low120 Ų120136.8 Ų136.878%0.77983%0.825SS**  -109.2165.7-104.634.5-15.9000112.9G521P519-G521 PolarHBondContact O-N 3.01Å
520Q39Very low36.5Very low203 Ų203137.4 Ų137.495%0.94983%0.826SS**PPolyproline II helixtrans-66.7118-179.9-68.9-178.8-37.500112.3
521G31.6Very low37Very low68 Ų68142.3 Ų142.370%0.70183%0.833SS**PPolyproline II helixtrans-92.1126160.300000110.4P519P519-G521 PolarHBondContact O-N 3.01Å
522V38.2Very low37.6Very low155 Ų155145.7 Ų145.794%0.93983%0.83SS**PPolyproline II helixtrans-52.7127.8176.6-83.40000113.2
523R36.8Very low38.3Very low243 Ų243145.4 Ų145.492%0.91783%0.827SS**  trans-114.4136.6165.4-77.1-158.7175.2-139.31110.7
524S33.8Very low38.9Very low103 Ų103140.8 Ų140.872%0.7282%0.821SS**PPolyproline II helixtrans-64.4157.1174.9-48.80000112.8T526S524-T526 PolarHBondContact O-N 2.85Å
525P35.9Very low40.3Very low129 Ų129142.1 Ų142.184%0.83882%0.823SS**PPolyproline II helixtrans-69.8122.6-174.3-11.326.8000111.4
526T38.7Very low41.2Very low135 Ų135140.8 Ų140.883%0.82882%0.816SS**PPolyproline II helixtrans-91.2117169-56.40000108.1S524S524-T526 PolarHBondContact O-N 2.85Å
527I41.1Very low42.3Very low157 Ų157142.6 Ų142.681%0.80581%0.813SS**PPolyproline II helixtrans-73.5125174.2-56.3167.7000107.8R529I527-R529 PolarHBondContact O-N 2.97Å
528S33.3Very low43.2Very low108 Ų108145.4 Ų145.476%0.75581%0.813SS**  trans-64.3113.7177.3-66.40000111.3V530S528-V530 VanDerWaalsContact C-N 3.27Å; S528-V530 PolarHBondContact O-N 3.08Å; S528-V530 VanDerWaalsContact O-N 3.1Å
529R44.8Very low43.7Very low216 Ų216144 Ų14482%0.81581%0.806SS**  trans-82.567.1172.9-172.5-176.9177.1148.8-3110.2I527I527-R529 PolarHBondContact O-N 2.97Å
530V43.1Very low44.2Very low135 Ų135144.1 Ų144.182%0.81881%0.807SS**  trans-12467166.4-178.60000108S528S528-V530 VanDerWaalsContact C-N 3.27Å; S528-V530 PolarHBondContact O-N 3.08Å; S528-V530 VanDerWaalsContact O-N 3.1Å
531E42.8Very low44.3Very low194 Ų194144.2 Ų144.291%0.90780%0.804SS**  trans-160.485.7151.8-131.5-159.8-178.300108.1
532R45.9Very low44.9Very low214 Ų214150.5 Ų150.581%0.80881%0.812SS**  trans-138.598.2162.3-154.7-177.9-117.4-113.61.7105.7
533G43.8Very low45.1Very low70 Ų70149 Ų14972%0.72281%0.806SS**PPolyproline II helixtrans-53.4147.5176.400000111.3
534N47Very low45Very low158 Ų158143 Ų14385%0.84580%0.801SS**PPolyproline II helixtrans-54.8131.4175.6-67.8-35.6000110.2
535P60.8Low45.3Very low114 Ų114146.4 Ų146.474%0.7481%0.81SS**PPolyproline II helixtrans-66.6145.9168.429.1-32.2000109.5
536P55.2Low45.3Very low113 Ų113144.5 Ų144.573%0.73481%0.806SS**PPolyproline II helixtrans-64.9150.5178.927.8-33.6000110.9
537P53.7Low45.1Very low124 Ų124147.4 Ų147.481%0.80581%0.81SS**PPolyproline II helixtrans-67136.4-17826.5-32.5000111.4
538I57.7Low44.6Very low158 Ų158144.2 Ų144.281%0.8181%0.807SS**PPolyproline II helixtrans-64.5129.8174.1-60167.7000108.6
539P51Low45.1Very low106 Ų106145.1 Ų145.169%0.68881%0.81SS**PPolyproline II helixtrans-66.7142.1178.124.3-30.6000111.3
540P54.6Low44.7Very low123 Ų123142.9 Ų142.980%0.79981%0.813SS**PPolyproline II helixtrans-66.5136.4-176.926.1-32.9000111.5K542P540-K542 PolarHBondContact O-N 3.49Å
541K40.1Very low44.2Very low205 Ų205142 Ų14289%0.89181%0.813SS**PPolyproline II helixtrans-61.3127172.7-68.1-175.6176.3-1800109.5
542K44Very low44.4Very low200 Ų200138.5 Ų138.587%0.8781%0.807SS**PPolyproline II helixtrans-59.8135.6173.2-66.6179.8-179.8176.50109.8P540 S544P540-K542 PolarHBondContact O-N 3.49Å; K542-S544 PolarHBondContact O-N 3.03Å
543P43.5Very low43.7Very low124 Ų124133.1 Ų133.181%0.80581%0.809SS**PPolyproline II helixtrans-68.6124.5172.626.6-29.6000109.5L545P543-L545 PolarHBondContact O-N 3.1Å
544S33.5Very low43.3Very low118 Ų118134.8 Ų134.883%0.82582%0.816SS**PPolyproline II helixtrans-56.2124.3172.145.90000110.9K542K542-S544 PolarHBondContact O-N 3.03Å
545L41.2Very low42.9Very low174 Ų174133.7 Ų133.791%0.91182%0.815SS**PPolyproline II helixtrans-66.9133.5172.2-150.783.9000109.9P543P543-L545 PolarHBondContact O-N 3.1Å
546A34.8Very low42.4Very low89 Ų89132.9 Ų132.974%0.73681%0.809SS**PPolyproline II helixtrans-70.6127.3176.600000112.4
547Q36.2Very low41.5Very low195 Ų195137 Ų13791%0.91182%0.815SS**  41120.3127-134.7175.84.800121.4
548A29.9Very low40.5Very low91 Ų91136.8 Ų136.875%0.75282%0.817SS**  163.2164.2120.500000111.6
549P44Very low39.2Very low127 Ų127132.5 Ų132.583%0.82581%0.812SS**  cis-127.7-172.3-4836.6-18.9000113.1
550L36.3Very low38.4Very low168 Ų168135.5 Ų135.588%0.8882%0.822SS**  trans-50.8153.2-167.2-69.4141.4000120.1
551S32Very low37.3Very low117 Ų117137.3 Ų137.382%0.81882%0.82SS**  trans-149.8155.9145.4-79.50000111.4
552P46.2Very low36.8Very low120 Ų120137 Ų13778%0.77982%0.819SS**  trans-105.7167.3-148.338.7-32.1000116
553A32.2Very low36.5Very low101 Ų101131.5 Ų131.584%0.83581%0.805SS**  trans76.4107.315300000120
554A35.6Very low36Very low105 Ų105134 Ų13487%0.86881%0.806SS**  -176.7121.511200000111.5
555V38.7Very low35.9Very low136 Ų136134.6 Ų134.682%0.82481%0.805SS**  trans-77.7165.4166.8158.30000108.1
556P50.2Low35.6Very low96 Ų96130.3 Ų130.362%0.62379%0.794SS**  cis-143.7172.82612.217.6000120.7
557K36.5Very low35.5Very low200 Ų200134.1 Ų134.187%0.8780%0.802SS**  trans74.7134.7145.9-77.9160.3179.8169.50116.3
558S32.3Very low35.3Very low120 Ų120130.3 Ų130.384%0.83980%0.797SS**  cis-174.8154.711.748.20000105
559G30.7Very low35.4Very low68 Ų68129.2 Ų129.270%0.70179%0.794SS**  cis178.81615.600000107.6
560N33.2Very low34.7Very low169 Ų169128.5 Ų128.590%0.90479%0.792SS**  trans81.887.1165.5-69.828.7000120
561H32Very low34.5Very low161 Ų161126.6 Ų126.675%0.74579%0.792SS**  trans-67.6155.1143.2-88.7-95.4000112.9
562F30.1Very low34.4Very low198 Ų198124.3 Ų124.387%0.86879%0.787SS**  177.7106.2116.5-100.2-79.7000106
563S37.6Very low33.8Very low85 Ų85126.6 Ų126.659%0.59479%0.791SS**  60.4136.875.6-44.90000111.4
564E32.7Very low33.9Very low177 Ų177127.2 Ų127.283%0.82779%0.79SS**  cis-176.7153.429.2-149.4175.5-179.200104.8
565T30.8Very low33.6Very low130 Ų130127.8 Ų127.880%0.79879%0.787SS**  170.1156.680.6-57.60000109.4
566A35.1Very low33.3Very low83 Ų83127.1 Ų127.169%0.68678%0.783SS**  trans-86.9-167.7-16300000118.1
567L34.2Very low32.4Very low169 Ų169131 Ų13189%0.88579%0.793SS**  trans100.2148.3164.9-53.1175000114.3
568S31.2Very low32.3Very low116 Ų116130.2 Ų130.281%0.81179%0.793SS**  cis171.2147-16.7177.40000105
569G30.9Very low32.4Very low68 Ų68128.3 Ų128.370%0.70179%0.792SS**  trans87.5116.8165.500000115.8
570S29.8Very low32.7Very low112 Ų112131.7 Ų131.778%0.78380%0.798SS**  94.5118.477.3-173.70000113
571C32.2Very low33.3Very low128 Ų128133.2 Ų133.287%0.86580%0.797SS**  trans56.1123.6148.4-62.30000121.5
572G31.1Very low33.6Very low69 Ų69134 Ų13471%0.71180%0.801SS**  113.9104.4125.900000118.7
573L32.7Very low34Very low168 Ų168132.4 Ų132.488%0.8880%0.801SS**  trans64.3124.8136.1-54.1178.1000122
574S33.7Very low34Very low114 Ų114134.8 Ų134.880%0.79781%0.807SS**  trans66.5108.6139.863.90000120.7
575S30.4Very low34.6Very low117 Ų117134.9 Ų134.982%0.81881%0.809SS**  trans-178.2137.1146.2-132.10000105.8
576T31.4Very low35.2Very low121 Ų121133.5 Ų133.574%0.74280%0.8SS**  cis-159.1153.626.7410000105.3
577Q32.2Very low35.7Very low177 Ų177135.3 Ų135.383%0.82780%0.803SS**  166.2122.784.7176.1176.413.100107.1
578E33.4Very low36.2Very low185 Ų185132.2 Ų132.286%0.86480%0.795SS**  -175.9121.3127.4-108.5172.8169.200109.8
579G35.9Very low37.4Very low79 Ų79132.7 Ų132.781%0.81480%0.798SS**  trans-80.2138.3168.800000110
580V35.8Very low38.2Very low139 Ų139140.6 Ų140.684%0.84283%0.825SS**  trans-131123159.8-175.50000107.3E582V580-E582 PolarHBondContact O-N 2.68Å
581K46Very low38.7Very low202 Ų202142.1 Ų142.188%0.87883%0.827SS**  trans-58118.8172.3-85.9174.5168.1-179.70110.4
582E38.2Very low39Very low176 Ų176142.8 Ų142.882%0.82283%0.825SS**  0.8121129.5-164.9177.1-158.400116.7V580V580-E582 PolarHBondContact O-N 2.68Å
583L38.2Very low39.4Very low165 Ų165146.9 Ų146.986%0.86483%0.831SS**  -169.6100.4117.9-110.3145.6000108.8
584D38.3Very low39.8Very low135 Ų135145.6 Ų145.672%0.72283%0.828SS**  trans-103.7131.4158.4-166.921.4000106.7V586D584-V586 WeakPolarHBondContact OD1-CG2 3.48Å
585M45.1Very low40.2Very low179 Ų179147.6 Ų147.688%0.88283%0.83SS**  trans-148.2109.4157.3-131.8-178.168.800109.4
586V44.4Very low40.9Very low101 Ų101149.7 Ų149.761%0.61283%0.831SS**  trans-89.8131.4-178.9169.20000108.7D584D584-V586 WeakPolarHBondContact OD1-CG2 3.48Å
587V43.7Very low41.6Very low122 Ų122151.7 Ų151.774%0.73984%0.838SS**  trans77.4114.5145.1175.40000119.4
588S45.4Very low42.3Very low104 Ų104149.8 Ų149.873%0.72784%0.838SS**  -172.8136.2102.7-760000110.9N590S588-N590 PolarHBondContact O-N 3.21Å
589S55.9Low43Very low125 Ų125146.8 Ų146.887%0.87484%0.836SS**  trans-80.998.6161.7-71.20000109
590N49.4Very low43.7Very low235 Ų235153 Ų153100%1.25784%0.838SS**  trans169.50141.2-97-6000109.5S588S588-N590 PolarHBondContact O-N 3.21Å

Retrieved 590 of 590 residues in 724.2 ms (Link to these results)