A0A067ZUL2_HUMAN Loading...

Nuclear pore complex-interacting protein

AlphaFold DB , UniProt , Accession A0A067ZUL2, Species HUMAN (Homo sapiens, Human), Gene NPIP, Length 192 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
1M36.4Very low54.9Low238 Ų238150.8 Ų150.8100%1.17276%0.758SS**  0105.80-79.1163.285.600108.3L3M1-L3 PolarHBondContact O-N 3.37Å
2S38.6Very low56.7Low126 Ų126143.3 Ų143.388%0.88173%0.726SS**  trans-84.8105-178.7-54.20000109.4L4S2-L4 PolarHBondContact O-N 2.96Å
3L41.5Very low58.7Low168 Ų168138.9 Ų138.988%0.8871%0.71SS**  trans-60.3118.4175.3-75.8157.3000109.7M1 R5M1-L3 PolarHBondContact O-N 3.37Å; L3-R5 PolarHBondContact O-N 3.47Å
4L50.3Low60.4Low157 Ų157135 Ų13582%0.82269%0.69SS**  trans-57106.5169.1-114.595000108.3S2 F6S2-L4 PolarHBondContact O-N 2.96Å; L4-F6 PolarHBondContact O-N 2.85Å
5R47.6Very low61.9Low246 Ų246131.7 Ų131.793%0.92868%0.679SS**  trans-72.795178.5-149.8174.3-167.2178.63108L3L3-R5 PolarHBondContact O-N 3.47Å
6F56.2Low63.2Low166 Ų166130.4 Ų130.473%0.72867%0.673SS**  trans-51.5135.2173.3-90.5-95000110.2L4 T8L4-F6 PolarHBondContact O-N 2.85Å; F6-T8 VanDerWaalsContact C-N 3.35Å; F6-T8 PolarHBondContact O-N 2.66Å
7P57Low64.6Low73 Ų73132.8 Ų132.847%0.47467%0.671SS.*  trans-70.693.1175.328.1-31.6000109.3S9 V12P7-S9 PolarHBondContact O-N 3.33Å; P7-S9 VanDerWaalsContact O-N 3.12Å; P7-V12 HydrophobicContact CB-CB 4.31Å; P7-V12 HydrophobicContact CB-CG1 4.06Å; P7-V12 HydrophobicContact CG-CG1 4.42Å
8T57.7Low66Low136 Ų136129.7 Ų129.783%0.83466%0.656SS**  trans-71.98.217638.10000114.1F6F6-T8 VanDerWaalsContact C-N 3.35Å; F6-T8 PolarHBondContact O-N 2.66Å
9S70.4Confident67.3Low64 Ų64127.2 Ų127.245%0.44865%0.648SS.*  trans-93.7103.7176-66.80000109P7 K11 V12P7-S9 PolarHBondContact O-N 3.33Å; P7-S9 VanDerWaalsContact O-N 3.12Å; S9-K11 PolarHBondContact O-N 2.72Å; S9-V12 WeakPolarHBondContact O-CB 3.14Å; S9-V12 PolarHBondContact O-N 3.26Å
10Y76.9Confident68.4Low153 Ų153129 Ų12960%0.665%0.647SS**Hα-helixtrans-44.2-31.6172.365.6-82.5000113.1V12 V13 I14Y10-V12 PolarHBondContact O-N 2.66Å; Y10-V13 PolarHBondContact O-N 3.47Å; Y10-I14 HydrophobicContact CD2-CD1 3.89Å; Y10-I14 WeakPolarHBondContact O-CB 3.43Å; Y10-I14 WeakPolarHBondContact O-CD1 3.43Å; Y10-I14 WeakPolarHBondContact O-CG1 3.04Å; Y10-I14 PolarHBondContact O-N 3.37Å
11K70.9Confident69.5Low132 Ų132127.5 Ų127.557%0.57464%0.641SS**Hα-helixtrans-56.1-43.9172.8-64.7-179.6178.4170.80113.1S9 I14 T15S9-K11 PolarHBondContact O-N 2.72Å; K11-I14 PolarHBondContact O-N 3.27Å; K11-T15 PolarHBondContact O-N 2.92Å; K11-T15 PolarHBondContact O-OG1 2.99Å
12V76.9Confident72Confident61 Ų61123.8 Ų123.837%0.3761%0.614SS.*Hα-helixtrans-68.1-42179.51780000110.5P7 S9 Y10 T15 L16P7-V12 HydrophobicContact CB-CB 4.31Å; P7-V12 HydrophobicContact CB-CG1 4.06Å; P7-V12 HydrophobicContact CG-CG1 4.42Å; S9-V12 WeakPolarHBondContact O-CB 3.14Å; S9-V12 PolarHBondContact O-N 3.26Å; Y10-V12 PolarHBondContact O-N 2.66Å; V12-T15 PolarHBondContact O-N 3.34Å; V12-L16 HydrophobicContact CG1-CD1 3.99Å; V12-L16 HydrophobicContact CG1-CG 4.47Å; V12-L16 WeakPolarHBondContact O-CB 3.29Å; V12-L16 VanDerWaalsContact O-CG 3.3Å; V12-L16 WeakPolarHBondContact O-CG 3.49Å; V12-L16 PolarHBondContact O-N 3.16Å
13V82.1Confident74.1Confident86 Ų86122 Ų12252%0.52160%0.597SS.*Hα-helixtrans-62.7-44.8177.1-179.10000110.8Y10 L16 W17Y10-V13 PolarHBondContact O-N 3.47Å; V13-L16 PolarHBondContact O-N 3.24Å; V13-W17 WeakPolarHBondContact O-CB 3.31Å; V13-W17 PolarHBondContact O-N 3.46Å
14I83.4Confident76Confident84 Ų84116 Ų11643%0.43157%0.57SS.*Hα-helixtrans-62.6-44.9176.8-68.1163.9000110.8Y10 K11 L16 W17 I18Y10-I14 HydrophobicContact CD2-CD1 3.89Å; Y10-I14 WeakPolarHBondContact O-CB 3.43Å; Y10-I14 WeakPolarHBondContact O-CD1 3.43Å; Y10-I14 WeakPolarHBondContact O-CG1 3.04Å; Y10-I14 PolarHBondContact O-N 3.37Å; K11-I14 PolarHBondContact O-N 3.27Å; I14-L16 PolarHBondContact O-N 2.88Å; I14-W17 PolarHBondContact O-N 2.93Å; I14-I18 HydrophobicContact CG2-CD1 3.7Å; I14-I18 HydrophobicContact CG2-CG1 4.38Å; I14-I18 VanDerWaalsContact O-CG1 3.25Å; I14-I18 WeakPolarHBondContact O-CG1 3.45Å; I14-I18 PolarHBondContact O-N 3.03Å
15T82.3Confident77.6Confident85 Ų85112.8 Ų112.852%0.52155%0.553SS.*Hα-helixtrans-61.8-44177.9-55.20000111.6K11 V12 W17 I18 V19K11-T15 PolarHBondContact O-N 2.92Å; K11-T15 PolarHBondContact O-OG1 2.99Å; V12-T15 PolarHBondContact O-N 3.34Å; T15-W17 PolarHBondContact O-N 2.98Å; T15-I18 PolarHBondContact O-N 3.4Å; T15-V19 VanDerWaalsContact O-CG2 3.29Å; T15-V19 WeakPolarHBondContact O-CG2 3.47Å; T15-V19 PolarHBondContact O-N 2.99Å
16L83.2Confident79.2Confident111 Ų111106.1 Ų106.158%0.58154%0.535SS*.Hα-helixtrans-63.4-41176.9-72.2170.2000112V12 V13 I14 V19 Y20V12-L16 HydrophobicContact CG1-CD1 3.99Å; V12-L16 HydrophobicContact CG1-CG 4.47Å; V12-L16 WeakPolarHBondContact O-CB 3.29Å; V12-L16 VanDerWaalsContact O-CG 3.3Å; V12-L16 WeakPolarHBondContact O-CG 3.49Å; V12-L16 PolarHBondContact O-N 3.16Å; V13-L16 PolarHBondContact O-N 3.24Å; I14-L16 PolarHBondContact O-N 2.88Å; L16-V19 PolarHBondContact O-N 3.15Å; L16-Y20 WeakPolarHBondContact O-CB 3.5Å; L16-Y20 PolarHBondContact O-N 3.2Å
17W87.4Confident80Confident171 Ų171105.8 Ų105.865%0.64853%0.533SS*.Hα-helixtrans-65.1-41.9177.7-169.768000112.3V13 I14 T15 Y20 L21V13-W17 WeakPolarHBondContact O-CB 3.31Å; V13-W17 PolarHBondContact O-N 3.46Å; I14-W17 PolarHBondContact O-N 2.93Å; T15-W17 PolarHBondContact O-N 2.98Å; W17-Y20 PolarHBondContact O-N 2.83Å; W17-L21 WeakPolarHBondContact O-CB 3.46Å; W17-L21 PolarHBondContact O-N 3.44Å
18I90Very high80.7Confident78 Ų78106.6 Ų106.640%0.454%0.537SS..Hα-helixtrans-62.4-48.6175.1-69.2167.9000110.3I14 T15 Y20 L21 W22I14-I18 HydrophobicContact CG2-CD1 3.7Å; I14-I18 HydrophobicContact CG2-CG1 4.38Å; I14-I18 VanDerWaalsContact O-CG1 3.25Å; I14-I18 WeakPolarHBondContact O-CG1 3.45Å; I14-I18 PolarHBondContact O-N 3.03Å; T15-I18 PolarHBondContact O-N 3.4Å; I18-Y20 VanDerWaalsContact C-N 3.3Å; I18-Y20 PolarHBondContact O-N 3.4Å; I18-L21 PolarHBondContact O-N 3.33Å; I18-W22 VanDerWaalsContact O-CD1 3.23Å; I18-W22 PolarHBondContact O-N 3.44Å
19V89.2Confident81.4Confident81 Ų81104.8 Ų104.849%0.49152%0.521SS..Hα-helixtrans-60.2-42.6178.91720000110.9T15 L16 L21 W22 V23T15-V19 VanDerWaalsContact O-CG2 3.29Å; T15-V19 WeakPolarHBondContact O-CG2 3.47Å; T15-V19 PolarHBondContact O-N 2.99Å; L16-V19 PolarHBondContact O-N 3.15Å; V19-L21 PolarHBondContact O-N 2.86Å; V19-W22 PolarHBondContact O-N 3.47Å; V19-V23 HydrophobicContact CG1-CG2 4.41Å; V19-V23 WeakPolarHBondContact O-CG2 3.4Å; V19-V23 PolarHBondContact O-N 2.84Å
20Y89.8Confident80.9Confident163 Ų163108.3 Ų108.364%0.63953%0.529SS*.Hα-helixtrans-62-42.7176.7-177.3-99.4000112.6L16 W17 I18 V23 S24L16-Y20 WeakPolarHBondContact O-CB 3.5Å; L16-Y20 PolarHBondContact O-N 3.2Å; W17-Y20 PolarHBondContact O-N 2.83Å; I18-Y20 VanDerWaalsContact C-N 3.3Å; I18-Y20 PolarHBondContact O-N 3.4Å; Y20-V23 PolarHBondContact O-N 3.24Å; Y20-S24 WeakPolarHBondContact O-CB 3.34Å; Y20-S24 PolarHBondContact O-N 2.96Å; Y20-S24 PolarHBondContact O-OG 3.49Å
21L90.8Very high79.7Confident98 Ų98111.1 Ų111.151%0.51354%0.538SS..Hα-helixtrans-63.1-41.8176.8-168.769.9000111.6W17 I18 V19 S24 L25W17-L21 WeakPolarHBondContact O-CB 3.46Å; W17-L21 PolarHBondContact O-N 3.44Å; I18-L21 PolarHBondContact O-N 3.33Å; V19-L21 PolarHBondContact O-N 2.86Å; L21-S24 PolarHBondContact O-N 3.4Å; L21-L25 WeakPolarHBondContact O-CB 3.49Å; L21-L25 PolarHBondContact O-N 2.93Å
22W89.2Confident78.9Confident160 Ų160108.8 Ų108.861%0.60654%0.539SS*.Hα-helixtrans-66.3-43.4177.3-86.898000113I18 V19 S24 L25 L26I18-W22 VanDerWaalsContact O-CD1 3.23Å; I18-W22 PolarHBondContact O-N 3.44Å; V19-W22 PolarHBondContact O-N 3.47Å; W22-S24 VanDerWaalsContact C-N 3.32Å; W22-L25 PolarHBondContact O-N 3.48Å; W22-L26 WeakPolarHBondContact O-CB 3.5Å; W22-L26 PolarHBondContact O-N 3.4Å
23V84.2Confident77.6Confident88 Ų88115.7 Ų115.753%0.53356%0.558SS.*Hα-helixtrans-64.7-40176.6172.50000110.8V19 Y20 L26 K27V19-V23 HydrophobicContact CG1-CG2 4.41Å; V19-V23 WeakPolarHBondContact O-CG2 3.4Å; V19-V23 PolarHBondContact O-N 2.84Å; Y20-V23 PolarHBondContact O-N 3.24Å; V23-L26 PolarHBondContact O-N 2.88Å; V23-K27 WeakPolarHBondContact O-CB 3.42Å; V23-K27 PolarHBondContact O-N 2.92Å
24S81.5Confident75.9Confident43 Ų43117.1 Ų117.130%0.30156%0.563SS.*Hα-helixtrans-63.1-45.8176.8-610000111.5Y20 L21 W22 K27 T28Y20-S24 WeakPolarHBondContact O-CB 3.34Å; Y20-S24 PolarHBondContact O-N 2.96Å; Y20-S24 PolarHBondContact O-OG 3.49Å; L21-S24 PolarHBondContact O-N 3.4Å; W22-S24 VanDerWaalsContact C-N 3.32Å; S24-K27 WeakPolarHBondContact O-CB 3.43Å; S24-K27 PolarHBondContact O-N 2.88Å; S24-T28 PolarHBondContact O-N 3.34Å; S24-T28 PolarHBondContact O-OG1 3.4Å
25L82.2Confident74.2Confident89 Ų89115.9 Ų115.947%0.46657%0.571SS.*Hα-helixtrans-62.8-43.8176.4-172.175.1000112L21 W22 K27 T28 I29L21-L25 WeakPolarHBondContact O-CB 3.49Å; L21-L25 PolarHBondContact O-N 2.93Å; W22-L25 PolarHBondContact O-N 3.48Å; L25-K27 VanDerWaalsContact C-N 3.26Å; L25-K27 PolarHBondContact O-N 2.96Å; L25-T28 PolarHBondContact O-N 3.5Å; L25-I29 HydrophobicContact CG-CD1 4.04Å; L25-I29 WeakPolarHBondContact O-CG1 3.46Å; L25-I29 PolarHBondContact O-N 3.35Å
26L81.8Confident72.7Confident107 Ų107118.4 Ų118.456%0.5658%0.576SS**Hα-helixtrans-59.3-41.9175.7-119.483.4000111W22 V23 I29 F30W22-L26 WeakPolarHBondContact O-CB 3.5Å; W22-L26 PolarHBondContact O-N 3.4Å; V23-L26 PolarHBondContact O-N 2.88Å; L26-I29 PolarHBondContact O-N 3.12Å; L26-F30 WeakPolarHBondContact O-CB 3.37Å; L26-F30 PolarHBondContact O-N 3.32Å
27K73.9Confident71.1Confident159 Ų159120.5 Ų120.569%0.69159%0.589SS**Hα-helixtrans-65-38.6178.7-168.5159.9176.5167.30111.6V23 S24 L25 W31V23-K27 WeakPolarHBondContact O-CB 3.42Å; V23-K27 PolarHBondContact O-N 2.92Å; S24-K27 WeakPolarHBondContact O-CB 3.43Å; S24-K27 PolarHBondContact O-N 2.88Å; L25-K27 VanDerWaalsContact C-N 3.26Å; L25-K27 PolarHBondContact O-N 2.96Å; K27-W31 VanDerWaalsContact O-CB 3.27Å; K27-W31 WeakPolarHBondContact O-CB 3.38Å; K27-W31 PolarHBondContact O-N 2.78Å
28T71.4Confident69.5Low89 Ų89114.9 Ų114.955%0.54658%0.584SS.*Hα-helixtrans-65.1-44.3174.9-22.50000112.2S24 L25 W31 S32S24-T28 PolarHBondContact O-N 3.34Å; S24-T28 PolarHBondContact O-OG1 3.4Å; L25-T28 PolarHBondContact O-N 3.5Å; T28-W31 PolarHBondContact O-N 2.93Å; T28-S32 PolarHBondContact O-N 2.98Å
29I71.2Confident67.8Low99 Ų99115 Ų11551%0.50859%0.592SS.*Hα-helixtrans-68.6-36.9-179.5-65.4167.5000111.5L25 L26 S32 R33L25-I29 HydrophobicContact CG-CD1 4.04Å; L25-I29 WeakPolarHBondContact O-CG1 3.46Å; L25-I29 PolarHBondContact O-N 3.35Å; L26-I29 PolarHBondContact O-N 3.12Å; I29-S32 PolarHBondContact O-OG 2.93Å; I29-R33 PolarHBondContact O-N 3.24Å
30F61.1Low66.2Low137 Ų137114.7 Ų114.760%0.60159%0.59SS**Hα-helixtrans-74.7-34.7179-136.4-92.8000111.7L26 R33 N34L26-F30 WeakPolarHBondContact O-CB 3.37Å; L26-F30 PolarHBondContact O-N 3.32Å; F30-R33 PolarHBondContact O-N 2.94Å; F30-N34 PolarHBondContact O-N 3.44Å
31W52Low64.7Low212 Ų212111.4 Ų111.480%0.80358%0.583SS**Hα-helixtrans-69.5-36.5175-151.424.6000112K27 T28 R33 N34 G35K27-W31 VanDerWaalsContact O-CB 3.27Å; K27-W31 WeakPolarHBondContact O-CB 3.38Å; K27-W31 PolarHBondContact O-N 2.78Å; T28-W31 PolarHBondContact O-N 2.93Å; W31-R33 PolarHBondContact O-N 2.9Å; W31-R33 VanDerWaalsContact O-N 3.14Å; W31-N34 PolarHBondContact O-N 2.96Å; W31-G35 PolarHBondContact O-N 3.47Å
32S54Low63Low84 Ų84111.5 Ų111.559%0.58759%0.588SS**Hα-helixtrans-67.3-11.5174.181.10000114.1T28 I29T28-S32 PolarHBondContact O-N 2.98Å; I29-S32 PolarHBondContact O-OG 2.93Å
33R49.6Very low61.4Low205 Ų205110.9 Ų110.977%0.77459%0.591SS**Hα-helixtrans-104-18.8-178.8-167.8159.4166.1176.3-8.1113.7I29 F30 W31I29-R33 PolarHBondContact O-N 3.24Å; F30-R33 PolarHBondContact O-N 2.94Å; W31-R33 PolarHBondContact O-N 2.9Å; W31-R33 VanDerWaalsContact O-N 3.14Å
34N45.6Very low60.1Low116 Ų116112 Ų11262%0.6259%0.591SS**Hα-helixtrans-103.2-1.1-179.3-78.17.4000114.2F30 W31F30-N34 PolarHBondContact O-N 3.44Å; W31-N34 PolarHBondContact O-N 2.96Å
35G48.4Very low59.2Low58 Ų58118.3 Ų118.360%0.59861%0.608SS**  trans-116.732-178.800000114.7W31W31-G35 PolarHBondContact O-N 3.47Å
36H50Low58Low138 Ų138116.8 Ų116.864%0.63961%0.608SS**  trans-104.655.8176.4-109.2-14.1000111.8
37D50.1Low56.8Low156 Ų156119.2 Ų119.283%0.83461%0.61SS**SBendtrans-92.9110.4167.6-84.1-28.5000110.3S39D37-S39 VanDerWaalsContact C-N 3.33Å; D37-S39 PolarHBondContact O-N 3.27Å
38G54.5Low56Low53 Ų53119.5 Ų119.555%0.54661%0.607SS.*SBendtrans74.9-31.3151.300000120.1T40 D41G38-T40 PolarHBondContact O-N 3.03Å; G38-D41 PolarHBondContact O-N 3.44Å
39S53.6Low55.3Low81 Ų81118.9 Ų118.957%0.56661%0.606SS**Hα-helixtrans-70.1-34-167.9178.80000114.5D37 V42 Q43D37-S39 VanDerWaalsContact C-N 3.33Å; D37-S39 PolarHBondContact O-N 3.27Å; S39-V42 PolarHBondContact O-N 2.96Å; S39-Q43 PolarHBondContact O-N 2.89Å
40T54.7Low54.8Low74 Ų74119 Ų11945%0.45461%0.608SS.*Hα-helixtrans-70.8-30.9-178.932.40000113.2G38 Q44G38-T40 PolarHBondContact O-N 3.03Å; T40-Q44 WeakPolarHBondContact O-CB 3.21Å; T40-Q44 PolarHBondContact O-N 3.21Å
41D58.6Low54.5Low94 Ų94119.2 Ų119.250%0.50361%0.605SS.*Hα-helixtrans-67.1-42.2176.3-167.2-83000111G38 Q44 R45G38-D41 PolarHBondContact O-N 3.44Å; D41-Q44 PolarHBondContact O-N 2.94Å; D41-R45 WeakPolarHBondContact O-CB 3.44Å; D41-R45 PolarHBondContact O-N 3.29Å; D41-R45 IonicContact OD1-CZ 3.83Å; D41-R45 IonicContact OD1-NE 3.83Å; D41-R45 IonicContact OD1-NH2 3.43Å; D41-R45 PolarHBondContact OD1-NH2 2.94Å
42V55.7Low54.8Low100 Ų100118.8 Ų118.861%0.60660%0.603SS**Hα-helixtrans-65.6-45.1-179.9-178.50000111.1S39 R45 A46S39-V42 PolarHBondContact O-N 2.96Å; V42-R45 PolarHBondContact O-N 3.36Å; V42-A46 WeakPolarHBondContact O-CB 3.48Å; V42-A46 PolarHBondContact O-N 2.9Å
43Q55Low54.7Low146 Ų146124.4 Ų124.468%0.68261%0.611SS**Hα-helixtrans-66.9-37.5176.5-70-140.7-21.500112.4S39 A46 W47S39-Q43 PolarHBondContact O-N 2.89Å; Q43-A46 PolarHBondContact O-N 3.27Å; Q43-W47 WeakPolarHBondContact O-CB 3.47Å; Q43-W47 PolarHBondContact O-N 3.44Å
44Q57.8Low54.8Low112 Ų112119.4 Ų119.452%0.52360%0.597SS.*Hα-helixtrans-71.4-31.7177.6-167160.4-0.900112.3T40 D41 R48T40-Q44 WeakPolarHBondContact O-CB 3.21Å; T40-Q44 PolarHBondContact O-N 3.21Å; D41-Q44 PolarHBondContact O-N 2.94Å; Q44-R48 WeakPolarHBondContact O-CG 3.49Å; Q44-R48 PolarHBondContact O-N 3.28Å
45R61Low55.2Low175 Ų175119.3 Ų119.366%0.6659%0.593SS**Hα-helixtrans-71.2-42.7172.5-169.6178.3-68.5-154.5-1.9111.8D41 V42 W47 R48 S49D41-R45 WeakPolarHBondContact O-CB 3.44Å; D41-R45 PolarHBondContact O-N 3.29Å; D41-R45 IonicContact OD1-CZ 3.83Å; D41-R45 IonicContact OD1-NE 3.83Å; D41-R45 IonicContact OD1-NH2 3.43Å; D41-R45 PolarHBondContact OD1-NH2 2.94Å; V42-R45 PolarHBondContact O-N 3.36Å; R45-W47 VanDerWaalsContact C-N 3.35Å; R45-W47 PolarHBondContact O-N 3Å; R45-R48 PolarHBondContact O-N 2.99Å; R45-S49 WeakPolarHBondContact O-CB 3.44Å; R45-S49 PolarHBondContact O-N 3.41Å
46A57.3Low55.4Low57 Ų57119 Ų11947%0.47159%0.589SS.*Hα-helixtrans-62.2-41.3173.200000111.8V42 Q43 S49 N50V42-A46 WeakPolarHBondContact O-CB 3.48Å; V42-A46 PolarHBondContact O-N 2.9Å; Q43-A46 PolarHBondContact O-N 3.27Å; A46-S49 PolarHBondContact O-N 2.95Å; A46-N50 PolarHBondContact O-N 2.87Å
47W57.9Low55.3Low158 Ų158119 Ų11960%0.59859%0.593SS**Hα-helixtrans-65.7-41176.5-17084.1000112.7Q43 R45 S49 N50 R51Q43-W47 WeakPolarHBondContact O-CB 3.47Å; Q43-W47 PolarHBondContact O-N 3.44Å; R45-W47 VanDerWaalsContact C-N 3.35Å; R45-W47 PolarHBondContact O-N 3Å; W47-S49 VanDerWaalsContact C-N 3.35Å; W47-S49 PolarHBondContact O-N 2.84Å; W47-N50 PolarHBondContact O-N 3.23Å; W47-R51 VanDerWaalsContact CH2-NH1 3.32Å; W47-R51 PolarHBondContact O-N 3.45Å; W47-R51 VanDerWaalsContact O-N 3.13Å
48R56.7Low55.2Low165 Ų165120.4 Ų120.462%0.62359%0.587SS**Hα-helixtrans-65-36174.4-79-177.2177172.31.1112.8Q44 R45Q44-R48 WeakPolarHBondContact O-CG 3.49Å; Q44-R48 PolarHBondContact O-N 3.28Å; R45-R48 PolarHBondContact O-N 2.99Å
49S57.6Low54.9Low76 Ų76122.5 Ų122.553%0.53159%0.593SS.*Hα-helixtrans-65.8-46.4175.3167.20000112R45 A46 W47 R51 R52 R53R45-S49 WeakPolarHBondContact O-CB 3.44Å; R45-S49 PolarHBondContact O-N 3.41Å; A46-S49 PolarHBondContact O-N 2.95Å; W47-S49 VanDerWaalsContact C-N 3.35Å; W47-S49 PolarHBondContact O-N 2.84Å; S49-R51 VanDerWaalsContact C-N 3.32Å; S49-R51 PolarHBondContact O-N 3.32Å; S49-R52 PolarHBondContact O-N 3.47Å; S49-R53 PolarHBondContact O-N 3.49Å
50N59.1Low54.7Low103 Ų103125.9 Ų125.955%0.55160%0.603SS**Hα-helixtrans-68.4-31.2-178.4-128-33.7000112.7A46 W47 R53 Q54A46-N50 PolarHBondContact O-N 2.87Å; W47-N50 PolarHBondContact O-N 3.23Å; N50-R53 PolarHBondContact O-N 3.29Å; N50-Q54 PolarHBondContact O-N 2.85Å
51R56Low54.4Low140 Ų140127.5 Ų127.553%0.52862%0.616SS.*Hα-helixtrans-64.4-42.1176.3-162.1174.6-163.51755.7112.7W47 S49 Q54 E55W47-R51 VanDerWaalsContact CH2-NH1 3.32Å; W47-R51 PolarHBondContact O-N 3.45Å; W47-R51 VanDerWaalsContact O-N 3.13Å; S49-R51 VanDerWaalsContact C-N 3.32Å; S49-R51 PolarHBondContact O-N 3.32Å; R51-Q54 PolarHBondContact O-N 3.36Å; R51-E55 WeakPolarHBondContact O-CG 3.47Å; R51-E55 PolarHBondContact O-N 3.46Å; R51-E55 VanDerWaalsContact O-N 3.08Å
52R57Low54.1Low203 Ų203131.1 Ų131.177%0.76663%0.632SS**Hα-helixtrans-67.6-35.8176.7-73.6-171.9179.8-169.10112.7S49 E55 G56S49-R52 PolarHBondContact O-N 3.47Å; R52-E55 PolarHBondContact O-N 2.92Å; R52-G56 PolarHBondContact O-N 3.34Å
53R53.2Low53.5Low202 Ų202134.5 Ų134.576%0.76264%0.641SS**Hα-helixtrans-68.2-36.1173.3-92.2-169.8177.6-165.20.2113.1S49 N50 L57S49-R53 PolarHBondContact O-N 3.49Å; N50-R53 PolarHBondContact O-N 3.29Å; R53-L57 PolarHBondContact O-N 2.99Å
54Q51.9Low53.5Low101 Ų101133.4 Ų133.447%0.47264%0.644SS.*Hα-helixtrans-71.2-32.2174.6-82.1-160.714.500113.4N50 R51 G56 L57 R58N50-Q54 PolarHBondContact O-N 2.85Å; R51-Q54 PolarHBondContact O-N 3.36Å; Q54-G56 VanDerWaalsContact C-N 3.28Å; Q54-G56 PolarHBondContact O-N 2.93Å; Q54-L57 PolarHBondContact O-N 3.47Å; Q54-R58 WeakPolarHBondContact O-CB 3.48Å; Q54-R58 VanDerWaalsContact O-CG 3.25Å; Q54-R58 WeakPolarHBondContact O-CG 3.46Å; Q54-R58 PolarHBondContact O-N 3.4Å
55E53.5Low52.6Low114 Ų114137.6 Ų137.653%0.53366%0.661SS.*Hα-helixtrans-65-31.7176.4-77.3163.9-175.100112R51 R52R51-E55 WeakPolarHBondContact O-CG 3.47Å; R51-E55 PolarHBondContact O-N 3.46Å; R51-E55 VanDerWaalsContact O-N 3.08Å; R52-E55 PolarHBondContact O-N 2.92Å
56G52.9Low52Low50 Ų50139 Ų13952%0.51567%0.672SS.*Hα-helixtrans-74.8-25.117300000115.4R52 Q54 S59R52-G56 PolarHBondContact O-N 3.34Å; Q54-G56 VanDerWaalsContact C-N 3.28Å; Q54-G56 PolarHBondContact O-N 2.93Å; G56-S59 PolarHBondContact O-OG 2.93Å
57L48.1Very low51.4Low138 Ų138147.9 Ų147.972%0.72369%0.693SS**Hα-helixtrans-90.3-19176.5-71.8170.7000113.2R53 Q54 S59R53-L57 PolarHBondContact O-N 2.99Å; Q54-L57 PolarHBondContact O-N 3.47Å; L57-S59 VanDerWaalsContact C-N 3.31Å; L57-S59 PolarHBondContact O-N 2.98Å
58R48Very low50.9Low187 Ų187146.8 Ų146.871%0.70670%0.704SS**THydrogen-bonded Turntrans-77-10.5-178.9-83.3176.2-179.5-135.21.8114.4Q54Q54-R58 WeakPolarHBondContact O-CB 3.48Å; Q54-R58 VanDerWaalsContact O-CG 3.25Å; Q54-R58 WeakPolarHBondContact O-CG 3.46Å; Q54-R58 PolarHBondContact O-N 3.4Å
59S48Very low50.3Low97 Ų97143.7 Ų143.768%0.67871%0.707SS**THydrogen-bonded Turntrans-85.7-6.9179.455.10000114.6G56 L57G56-S59 PolarHBondContact O-OG 2.93Å; L57-S59 VanDerWaalsContact C-N 3.31Å; L57-S59 PolarHBondContact O-N 2.98Å
60I49.2Very low50.1Low152 Ų152145.4 Ų145.478%0.77972%0.719SS**SBendtrans-113.5-2.4-172.8-56.3-179.9000114
61C48.8Very low49.5Very low107 Ų107149.8 Ų149.872%0.72373%0.733SS**  trans-131.786.9-178.9-165.10000113.2
62M52Low49.3Very low171 Ų171155.2 Ų155.284%0.84275%0.754SS**  trans-102.597.2155.9-80.2-131.366.600108.8
63H42Very low48.9Very low171 Ų171147.7 Ų147.779%0.79274%0.74SS**  trans-145.4109.6150.8-93.7-66.2000111.6
64T54.7Low49.1Very low123 Ų123144.6 Ų144.676%0.75574%0.738SS**  trans6.6105.5161.353.60000118.8
65K39.8Very low49.3Very low200 Ų200147.3 Ų147.387%0.8775%0.749SS**  trans-123.7105.8145-86.1-175.4177.8178.60110R67K65-R67 PolarHBondContact O-N 2.86Å
66K48.6Very low49.4Very low205 Ų205147.9 Ų147.989%0.89175%0.754SS**  trans-53.2121.4163.9-79.5-176.5176.2178.50108
67R43.6Very low49.6Very low242 Ų242149.6 Ų149.691%0.91375%0.754SS**  trans-107.397.3163-76.2-167.2176.6-162.1-0.6108.5K65K65-R67 PolarHBondContact O-N 2.86Å
68V47.5Very low50.4Low136 Ų136148.5 Ų148.582%0.82475%0.749SS**  trans-78.4115.3154.2178.70000106.4
69S45.3Very low51.2Low100 Ų100146.4 Ų146.470%0.69975%0.745SS**  trans-179120.913440.30000109.7
70S53.8Low52.3Low111 Ų111146.1 Ų146.178%0.77674%0.735SS**  trans-61.8118.6172.8460000111.8
71F46.1Very low53.4Low195 Ų195142.9 Ų142.986%0.85572%0.723SS**  trans-123.293.1148.6-93.2-85.8000108.5G73F71-G73 PolarHBondContact O-N 2.82Å; F71-G73 VanDerWaalsContact O-N 3.15Å
72R52.3Low54.7Low254 Ų254141.2 Ų141.296%0.95871%0.706SS**  trans-84.362.9169-164.7178.4-172.2-119.44.7108.5
73G48.4Very low56Low46 Ų46136.9 Ų136.947%0.47469%0.689SS.*  trans-103.1118.7177.400000111.7F71 K75F71-G73 PolarHBondContact O-N 2.82Å; F71-G73 VanDerWaalsContact O-N 3.15Å; G73-K75 PolarHBondContact O-N 3.27Å
74N56.5Low57.8Low136 Ų136134 Ų13473%0.72768%0.679SS**  trans4336.7157.7-77.74000120.1I76N74-I76 PolarHBondContact O-N 3.34Å
75K55.5Low59.2Low159 Ų159136.1 Ų136.169%0.69167%0.673SS**Hα-helixtrans-71.1-13.9171.6-67.5-174-178.5178.90114.3G73 K79G73-K75 PolarHBondContact O-N 3.27Å; K75-K79 WeakPolarHBondContact O-CG 3.35Å
76I56.5Low61.3Low126 Ų126134.8 Ų134.865%0.64666%0.662SS**Hα-helixtrans-80.4-51.5-176.2-62.1169.8000109.9N74 L78 K79 D80N74-I76 PolarHBondContact O-N 3.34Å; I76-L78 PolarHBondContact O-N 2.79Å; I76-K79 PolarHBondContact O-N 3.29Å; I76-D80 WeakPolarHBondContact CG2-OD2 3.45Å; I76-D80 VanDerWaalsContact O-CG 3.29Å; I76-D80 PolarHBondContact O-N 3.42Å; I76-D80 VanDerWaalsContact O-N 3.17Å
77V57.6Low63Low85 Ų85129.3 Ų129.352%0.51564%0.64SS.*Hα-helixtrans-63-42.2-174.3-174.80000113.5D80 V81V77-D80 PolarHBondContact O-N 3.47Å; V77-V81 HydrophobicContact CG1-CG2 4.43Å; V77-V81 VanDerWaalsContact O-CG2 3.29Å; V77-V81 WeakPolarHBondContact O-CG2 3.36Å; V77-V81 PolarHBondContact O-N 2.84Å
78L64.5Low65Low115 Ų115121.4 Ų121.460%0.60262%0.618SS**Hα-helixtrans-68.6-37.3-178.9-17763.6000112.3I76 D80 V81 I82I76-L78 PolarHBondContact O-N 2.79Å; L78-D80 VanDerWaalsContact C-N 3.32Å; L78-V81 PolarHBondContact O-N 3.07Å; L78-I82 HydrophobicContact CD1-CD1 4.1Å; L78-I82 HydrophobicContact CD1-CG1 4.38Å; L78-I82 HydrophobicContact CG-CD1 3.88Å; L78-I82 WeakPolarHBondContact O-CB 3.34Å; L78-I82 WeakPolarHBondContact O-CD1 3.4Å; L78-I82 WeakPolarHBondContact O-CG1 3.37Å; L78-I82 PolarHBondContact O-N 3.34Å
79K65Low66.7Low144 Ų144118.3 Ų118.363%0.62660%0.595SS**Hα-helixtrans-63.4-42.5175.9-76.6-178.2178.7-1760110.4K75 I76 I82 T83K75-K79 WeakPolarHBondContact O-CG 3.35Å; I76-K79 PolarHBondContact O-N 3.29Å; K79-I82 PolarHBondContact O-N 3.49Å; K79-T83 WeakPolarHBondContact O-CG2 3.34Å; K79-T83 PolarHBondContact O-N 3.4Å; K79-T83 PolarHBondContact O-OG1 2.9Å; K79-T83 VanDerWaalsContact O-OG1 3.08Å
80D70.4Confident68.8Low90 Ų90117.6 Ų117.648%0.48159%0.586SS.*Hα-helixtrans-68.8-36.1-179.2-63.4-23.1000112.7I76 V77 L78 T83 L84I76-D80 WeakPolarHBondContact CG2-OD2 3.45Å; I76-D80 VanDerWaalsContact O-CG 3.29Å; I76-D80 PolarHBondContact O-N 3.42Å; I76-D80 VanDerWaalsContact O-N 3.17Å; V77-D80 PolarHBondContact O-N 3.47Å; L78-D80 VanDerWaalsContact C-N 3.32Å; D80-T83 VanDerWaalsContact CA-OG1 3.31Å; D80-T83 WeakPolarHBondContact CA-OG1 3.47Å; D80-T83 PolarHBondContact O-OG1 3.44Å; D80-L84 WeakPolarHBondContact O-CB 3.39Å; D80-L84 PolarHBondContact O-N 2.98Å
81V71.8Confident70.5Confident85 Ų85118 Ų11852%0.51557%0.574SS.*Hα-helixtrans-68.4-39.5173.7172.80000111.3V77 L78 R85V77-V81 HydrophobicContact CG1-CG2 4.43Å; V77-V81 VanDerWaalsContact O-CG2 3.29Å; V77-V81 WeakPolarHBondContact O-CG2 3.36Å; V77-V81 PolarHBondContact O-N 2.84Å; L78-V81 PolarHBondContact O-N 3.07Å; V81-R85 VanDerWaalsContact O-CB 3.29Å; V81-R85 WeakPolarHBondContact O-CB 3.3Å; V81-R85 PolarHBondContact O-N 3.31Å
82I76.9Confident72.5Confident71 Ų71112.3 Ų112.336%0.36456%0.555SS.*Hα-helixtrans-68.8-41.5178.2-68.1167.2000111.1L78 K79 R86L78-I82 HydrophobicContact CD1-CD1 4.1Å; L78-I82 HydrophobicContact CD1-CG1 4.38Å; L78-I82 HydrophobicContact CG-CD1 3.88Å; L78-I82 WeakPolarHBondContact O-CB 3.34Å; L78-I82 WeakPolarHBondContact O-CD1 3.4Å; L78-I82 WeakPolarHBondContact O-CG1 3.37Å; L78-I82 PolarHBondContact O-N 3.34Å; K79-I82 PolarHBondContact O-N 3.49Å; I82-R86 WeakPolarHBondContact O-CB 3.3Å; I82-R86 VanDerWaalsContact O-CG 3.29Å; I82-R86 WeakPolarHBondContact O-CG 3.49Å; I82-R86 PolarHBondContact O-N 2.98Å
83T80.1Confident74.1Confident81 Ų81107.6 Ų107.650%0.49754%0.537SS..Hα-helixtrans-66.5-42.9176.451.90000111K79 D80 R85 R86 H87K79-T83 WeakPolarHBondContact O-CG2 3.34Å; K79-T83 PolarHBondContact O-N 3.4Å; K79-T83 PolarHBondContact O-OG1 2.9Å; K79-T83 VanDerWaalsContact O-OG1 3.08Å; D80-T83 VanDerWaalsContact CA-OG1 3.31Å; D80-T83 WeakPolarHBondContact CA-OG1 3.47Å; D80-T83 PolarHBondContact O-OG1 3.44Å; T83-R85 PolarHBondContact O-N 3.38Å; T83-R86 PolarHBondContact O-N 2.93Å; T83-H87 WeakPolarHBondContact O-CB 3.47Å; T83-H87 PolarHBondContact O-N 2.91Å
84L79.5Confident75.8Confident109 Ų109107.8 Ų107.857%0.57153%0.534SS*.Hα-helixtrans-61.6-45.4176-173.764.6000111.6D80 R86 H87 V88D80-L84 WeakPolarHBondContact O-CB 3.39Å; D80-L84 PolarHBondContact O-N 2.98Å; L84-R86 PolarHBondContact O-N 2.97Å; L84-H87 PolarHBondContact O-N 3.39Å; L84-V88 WeakPolarHBondContact O-CG2 3.37Å; L84-V88 PolarHBondContact O-N 2.96Å
85R83.5Confident77.2Confident168 Ų168108.7 Ų108.763%0.63453%0.532SS*.Hα-helixtrans-59-47.4175.4-179.9-179.9167.2-173.50.8111.6V81 T83 H87 V88 E89V81-R85 VanDerWaalsContact O-CB 3.29Å; V81-R85 WeakPolarHBondContact O-CB 3.3Å; V81-R85 PolarHBondContact O-N 3.31Å; T83-R85 PolarHBondContact O-N 3.38Å; R85-H87 VanDerWaalsContact C-N 3.31Å; R85-H87 PolarHBondContact O-N 3.22Å; R85-V88 PolarHBondContact O-N 3.02Å; R85-E89 IonicContact CZ-OE1 3.33Å; R85-E89 IonicContact NE-OE1 3.53Å; R85-E89 PolarHBondContact NE-OE1 3.45Å; R85-E89 IonicContact NH2-OE1 2.88Å; R85-E89 PolarHBondContact NH2-OE1 2.79Å; R85-E89 WeakPolarHBondContact O-CB 3.43Å; R85-E89 WeakPolarHBondContact O-CG 3.25Å; R85-E89 PolarHBondContact O-N 3.22Å
86R83.7Confident78.4Confident172 Ų172106 Ų10665%0.64952%0.524SS*.Hα-helixtrans-61.1-40.7177.7-75.6176.4177.6-172.40.2111.9I82 T83 L84 E89 T90I82-R86 WeakPolarHBondContact O-CB 3.3Å; I82-R86 VanDerWaalsContact O-CG 3.29Å; I82-R86 WeakPolarHBondContact O-CG 3.49Å; I82-R86 PolarHBondContact O-N 2.98Å; T83-R86 PolarHBondContact O-N 2.93Å; L84-R86 PolarHBondContact O-N 2.97Å; R86-E89 PolarHBondContact O-N 2.92Å; R86-T90 WeakPolarHBondContact O-CG2 3.25Å; R86-T90 PolarHBondContact O-N 2.96Å; R86-T90 PolarHBondContact O-OG1 3.32Å
87H84.1Confident79.5Confident90 Ų90108.7 Ų108.742%0.41753%0.526SS..Hα-helixtrans-67.8-39.1178.2173.5-104.4000112.8T83 L84 R85 T90 K91T83-H87 WeakPolarHBondContact O-CB 3.47Å; T83-H87 PolarHBondContact O-N 2.91Å; L84-H87 PolarHBondContact O-N 3.39Å; R85-H87 VanDerWaalsContact C-N 3.31Å; R85-H87 PolarHBondContact O-N 3.22Å; H87-T90 PolarHBondContact O-OG1 3.49Å; H87-K91 VanDerWaalsContact CE1-CE 3.4Å; H87-K91 WeakPolarHBondContact CE1-CE 3.29Å; H87-K91 PolarHBondContact CE1-NZ 2.82Å; H87-K91 VanDerWaalsContact NE2-CE 3.25Å; H87-K91 WeakPolarHBondContact NE2-CE 3.38Å; H87-K91 PolarHBondContact O-N 3.41Å; H87-K91 VanDerWaalsContact O-N 3.1Å
88V86.3Confident80.4Confident76 Ų76112.1 Ų112.146%0.46153%0.534SS..Hα-helixtrans-67.6-43.8173.9173.50000110.6L84 R85 T90 K91 V92L84-V88 WeakPolarHBondContact O-CG2 3.37Å; L84-V88 PolarHBondContact O-N 2.96Å; R85-V88 PolarHBondContact O-N 3.02Å; V88-T90 VanDerWaalsContact C-N 3.34Å; V88-T90 PolarHBondContact O-N 3.04Å; V88-K91 PolarHBondContact O-N 3.02Å; V88-V92 HydrophobicContact CG1-CG2 4.31Å; V88-V92 VanDerWaalsContact O-CG2 3.31Å; V88-V92 WeakPolarHBondContact O-CG2 3.46Å; V88-V92 PolarHBondContact O-N 2.93Å
89E83.6Confident80.8Confident72 Ų72115.8 Ų115.834%0.33654%0.54SS..Hα-helixtrans-60.4-40.5177-77.2-179.1-168.500112.1R85 R86 V92 R93R85-E89 IonicContact CZ-OE1 3.33Å; R85-E89 IonicContact NE-OE1 3.53Å; R85-E89 PolarHBondContact NE-OE1 3.45Å; R85-E89 IonicContact NH2-OE1 2.88Å; R85-E89 PolarHBondContact NH2-OE1 2.79Å; R85-E89 WeakPolarHBondContact O-CB 3.43Å; R85-E89 WeakPolarHBondContact O-CG 3.25Å; R85-E89 PolarHBondContact O-N 3.22Å; R86-E89 PolarHBondContact O-N 2.92Å; E89-V92 PolarHBondContact O-N 3.46Å; E89-R93 WeakPolarHBondContact O-CB 3.28Å; E89-R93 VanDerWaalsContact O-CG 3.23Å; E89-R93 WeakPolarHBondContact O-CG 3.38Å; E89-R93 PolarHBondContact O-N 2.77Å
90T89.3Confident81Confident84 Ų84115.8 Ų115.852%0.51554%0.54SS..Hα-helixtrans-67.9-41.5176.960.70000111.8R86 H87 V88 V92 R93 A94R86-T90 WeakPolarHBondContact O-CG2 3.25Å; R86-T90 PolarHBondContact O-N 2.96Å; R86-T90 PolarHBondContact O-OG1 3.32Å; H87-T90 PolarHBondContact O-OG1 3.49Å; V88-T90 VanDerWaalsContact C-N 3.34Å; V88-T90 PolarHBondContact O-N 3.04Å; T90-V92 PolarHBondContact O-N 2.92Å; T90-R93 PolarHBondContact O-N 2.88Å; T90-A94 WeakPolarHBondContact O-CB 3.24Å; T90-A94 PolarHBondContact O-N 3.13Å
91K88.3Confident80.8Confident120 Ų120115.3 Ų115.352%0.52254%0.54SS..Hα-helixtrans-61.9-42.4174.4-79.5-169.4172.2179.80112.3H87 V88 A94 K95H87-K91 VanDerWaalsContact CE1-CE 3.4Å; H87-K91 WeakPolarHBondContact CE1-CE 3.29Å; H87-K91 PolarHBondContact CE1-NZ 2.82Å; H87-K91 VanDerWaalsContact NE2-CE 3.25Å; H87-K91 WeakPolarHBondContact NE2-CE 3.38Å; H87-K91 PolarHBondContact O-N 3.41Å; H87-K91 VanDerWaalsContact O-N 3.1Å; V88-K91 PolarHBondContact O-N 3.02Å; K91-A94 PolarHBondContact O-N 3.26Å; K91-K95 WeakPolarHBondContact O-CG 3.42Å; K91-K95 PolarHBondContact O-N 3.44Å
92V89.6Confident80.2Confident75 Ų75114.9 Ų114.946%0.45554%0.538SS..Hα-helixtrans-65.8-45.2176.5171.70000110.6V88 E89 T90 A94 K95 I96V88-V92 HydrophobicContact CG1-CG2 4.31Å; V88-V92 VanDerWaalsContact O-CG2 3.31Å; V88-V92 WeakPolarHBondContact O-CG2 3.46Å; V88-V92 PolarHBondContact O-N 2.93Å; E89-V92 PolarHBondContact O-N 3.46Å; T90-V92 PolarHBondContact O-N 2.92Å; V92-A94 VanDerWaalsContact C-N 3.34Å; V92-A94 PolarHBondContact O-N 3.41Å; V92-K95 PolarHBondContact O-N 2.96Å; V92-I96 HydrophobicContact CG1-CD1 3.76Å; V92-I96 HydrophobicContact CG1-CG1 4.39Å; V92-I96 VanDerWaalsContact O-CG1 3.31Å; V92-I96 WeakPolarHBondContact O-CG1 3.32Å; V92-I96 PolarHBondContact O-N 3.4Å
93R84.8Confident79.4Confident156 Ų156116.2 Ų116.259%0.58955%0.549SS*.Hα-helixtrans-61.2-40.8176-75.2175.2-179.4-161.31.8112.2E89 T90 I96 R97E89-R93 WeakPolarHBondContact O-CB 3.28Å; E89-R93 VanDerWaalsContact O-CG 3.23Å; E89-R93 WeakPolarHBondContact O-CG 3.38Å; E89-R93 PolarHBondContact O-N 2.77Å; T90-R93 PolarHBondContact O-N 2.88Å; R93-I96 PolarHBondContact O-N 3.47Å; R93-R97 WeakPolarHBondContact O-CB 3.44Å; R93-R97 WeakPolarHBondContact O-CG 3.39Å; R93-R97 PolarHBondContact O-N 3.17Å
94A85.3Confident78.4Confident49 Ų49120.3 Ų120.341%0.40556%0.56SS.*Hα-helixtrans-64.2-42.3175.800000111.7T90 K91 V92 R97 K98T90-A94 WeakPolarHBondContact O-CB 3.24Å; T90-A94 PolarHBondContact O-N 3.13Å; K91-A94 PolarHBondContact O-N 3.26Å; V92-A94 VanDerWaalsContact C-N 3.34Å; V92-A94 PolarHBondContact O-N 3.41Å; A94-R97 PolarHBondContact O-N 2.81Å; A94-K98 WeakPolarHBondContact O-CB 3.37Å; A94-K98 WeakPolarHBondContact O-CG 3.33Å; A94-K98 PolarHBondContact O-N 2.94Å
95K84.1Confident77.3Confident156 Ų156120.9 Ų120.968%0.67856%0.563SS**Hα-helixtrans-63-42.8173.9-75.1-179.9178-175.40112.2K91 V92 K98 R99K91-K95 WeakPolarHBondContact O-CG 3.42Å; K91-K95 PolarHBondContact O-N 3.44Å; V92-K95 PolarHBondContact O-N 2.96Å; K95-K98 PolarHBondContact O-N 2.89Å; K95-R99 VanDerWaalsContact O-CB 3.31Å; K95-R99 WeakPolarHBondContact O-CB 3.45Å; K95-R99 PolarHBondContact O-N 3.26Å
96I81.6Confident75.9Confident103 Ų103119.3 Ų119.353%0.52857%0.567SS.*Hα-helixtrans-63.8-45176.1-68.1167.3000110.8V92 R93 R99 K100V92-I96 HydrophobicContact CG1-CD1 3.76Å; V92-I96 HydrophobicContact CG1-CG1 4.39Å; V92-I96 VanDerWaalsContact O-CG1 3.31Å; V92-I96 WeakPolarHBondContact O-CG1 3.32Å; V92-I96 PolarHBondContact O-N 3.4Å; R93-I96 PolarHBondContact O-N 3.47Å; I96-R99 PolarHBondContact O-N 3.27Å; I96-K100 VanDerWaalsContact O-CB 3.31Å; I96-K100 WeakPolarHBondContact O-CB 3.42Å; I96-K100 PolarHBondContact O-N 3.26Å
97R79.3Confident74.8Confident182 Ų182118.9 Ų118.969%0.68757%0.572SS**Hα-helixtrans-61.9-47.6176.3-75.7178.1179.3-179.1-1.3111.4R93 A94 R99 K100 V101R93-R97 WeakPolarHBondContact O-CB 3.44Å; R93-R97 WeakPolarHBondContact O-CG 3.39Å; R93-R97 PolarHBondContact O-N 3.17Å; A94-R97 PolarHBondContact O-N 2.81Å; R97-R99 PolarHBondContact O-N 3.4Å; R97-K100 PolarHBondContact O-N 2.78Å; R97-V101 WeakPolarHBondContact O-CB 3.27Å; R97-V101 VanDerWaalsContact O-CG2 3.25Å; R97-V101 WeakPolarHBondContact O-CG2 3.47Å; R97-V101 PolarHBondContact O-N 3.01Å
98K77.1Confident73.7Confident157 Ų157123.1 Ų123.168%0.68359%0.591SS**Hα-helixtrans-57.7-47.6175.1-76.5-173178.7-168.70111.4A94 K95 K100 V101 T102A94-K98 WeakPolarHBondContact O-CB 3.37Å; A94-K98 WeakPolarHBondContact O-CG 3.33Å; A94-K98 PolarHBondContact O-N 2.94Å; K95-K98 PolarHBondContact O-N 2.89Å; K98-K100 PolarHBondContact O-N 2.9Å; K98-V101 PolarHBondContact O-N 3.31Å; K98-T102 WeakPolarHBondContact O-CG2 3.33Å; K98-T102 PolarHBondContact O-N 3.46Å; K98-T102 PolarHBondContact O-OG1 3.34Å; K98-T102 VanDerWaalsContact O-OG1 3.05Å
99R71.9Confident72.2Confident192 Ų192126.6 Ų126.673%0.72561%0.607SS**Hα-helixtrans-60.3-44.7176.6-168.1177.3-177.2-163.51.3112K95 I96 R97 T102 T103K95-R99 VanDerWaalsContact O-CB 3.31Å; K95-R99 WeakPolarHBondContact O-CB 3.45Å; K95-R99 PolarHBondContact O-N 3.26Å; I96-R99 PolarHBondContact O-N 3.27Å; R97-R99 PolarHBondContact O-N 3.4Å; R99-T102 VanDerWaalsContact CA-OG1 3.31Å; R99-T102 WeakPolarHBondContact CA-OG1 3.3Å; R99-T102 PolarHBondContact O-N 3.42Å; R99-T102 PolarHBondContact O-OG1 3.08Å; R99-T103 WeakPolarHBondContact O-CB 3.46Å; R99-T103 PolarHBondContact O-N 3.22Å; R99-T103 PolarHBondContact O-OG1 3.41Å
100K70.5Confident70.9Confident143 Ų143132.6 Ų132.662%0.62263%0.632SS**Hα-helixtrans-65.3-38.3177.9-169176.1-176.7178.60112.1I96 R97 K98 K104I96-K100 VanDerWaalsContact O-CB 3.31Å; I96-K100 WeakPolarHBondContact O-CB 3.42Å; I96-K100 PolarHBondContact O-N 3.26Å; R97-K100 PolarHBondContact O-N 2.78Å; K98-K100 PolarHBondContact O-N 2.9Å; K100-K104 WeakPolarHBondContact O-CB 3.33Å; K100-K104 PolarHBondContact O-N 3.04Å
101V65.9Low69.4Low80 Ų80133.1 Ų133.149%0.48563%0.631SS.*Hα-helixtrans-67.2-47.2174.9169.10000110.4R97 K98 T103 K104 I105R97-V101 WeakPolarHBondContact O-CB 3.27Å; R97-V101 VanDerWaalsContact O-CG2 3.25Å; R97-V101 WeakPolarHBondContact O-CG2 3.47Å; R97-V101 PolarHBondContact O-N 3.01Å; K98-V101 PolarHBondContact O-N 3.31Å; V101-T103 VanDerWaalsContact C-N 3.29Å; V101-T103 PolarHBondContact O-N 3.37Å; V101-K104 PolarHBondContact O-N 3.23Å; V101-K104 VanDerWaalsContact O-N 3.09Å; V101-I105 HydrophobicContact CG1-CD1 3.58Å; V101-I105 HydrophobicContact CG1-CG1 4.36Å; V101-I105 VanDerWaalsContact O-CG1 3.28Å; V101-I105 WeakPolarHBondContact O-CG1 3.11Å; V101-I105 PolarHBondContact O-N 3.39Å
102T59.6Low67.9Low77 Ų77134.4 Ų134.447%0.47264%0.644SS.*Hα-helixtrans-64-34.2175.853.30000112.4K98 R99 I105 N106K98-T102 WeakPolarHBondContact O-CG2 3.33Å; K98-T102 PolarHBondContact O-N 3.46Å; K98-T102 PolarHBondContact O-OG1 3.34Å; K98-T102 VanDerWaalsContact O-OG1 3.05Å; R99-T102 VanDerWaalsContact CA-OG1 3.31Å; R99-T102 WeakPolarHBondContact CA-OG1 3.3Å; R99-T102 PolarHBondContact O-N 3.42Å; R99-T102 PolarHBondContact O-OG1 3.08Å; T102-I105 PolarHBondContact O-N 3.38Å; T102-N106 PolarHBondContact O-N 3.09Å; T102-N106 PolarHBondContact O-ND2 3.01Å
103T59.2Low66.2Low99 Ų99133.8 Ų133.861%0.60765%0.652SS**Hα-helixtrans-69.5-33.7173.8-60.40000111.9R99 V101R99-T103 WeakPolarHBondContact O-CB 3.46Å; R99-T103 PolarHBondContact O-N 3.22Å; R99-T103 PolarHBondContact O-OG1 3.41Å; V101-T103 VanDerWaalsContact C-N 3.29Å; V101-T103 PolarHBondContact O-N 3.37Å
104K58.8Low64.8Low167 Ų167135.8 Ų135.873%0.72667%0.665SS**Hα-helixtrans-73.5-32.3174.2-86-166.3166.4-1620113.5K100 V101 N106K100-K104 WeakPolarHBondContact O-CB 3.33Å; K100-K104 PolarHBondContact O-N 3.04Å; V101-K104 PolarHBondContact O-N 3.23Å; V101-K104 VanDerWaalsContact O-N 3.09Å; K104-N106 VanDerWaalsContact C-N 3.27Å; K104-N106 PolarHBondContact O-N 2.81Å
105I56.3Low63.3Low121 Ų121144.6 Ų144.662%0.62169%0.688SS**Hα-helixtrans-72.7-19.9-179.6-68.4167.3000111.9V101 T102 H107V101-I105 HydrophobicContact CG1-CD1 3.58Å; V101-I105 HydrophobicContact CG1-CG1 4.36Å; V101-I105 VanDerWaalsContact O-CG1 3.28Å; V101-I105 WeakPolarHBondContact O-CG1 3.11Å; V101-I105 PolarHBondContact O-N 3.39Å; T102-I105 PolarHBondContact O-N 3.38Å; I105-H107 PolarHBondContact O-N 3.23Å
106N54.7Low61.8Low134 Ų134143.3 Ų143.372%0.71768%0.682SS**SBendtrans-9544.4-178.5-70.4-20.9000114.6T102 K104T102-N106 PolarHBondContact O-N 3.09Å; T102-N106 PolarHBondContact O-ND2 3.01Å; K104-N106 VanDerWaalsContact C-N 3.27Å; K104-N106 PolarHBondContact O-N 2.81Å
107H59.6Low60.7Low163 Ų163141.5 Ų141.576%0.75568%0.677SS**  trans-134.851.7169.7-16068.8000112.8I105I105-H107 PolarHBondContact O-N 3.23Å
108H61.2Low60.1Low180 Ų180135.3 Ų135.383%0.83366%0.664SS**  trans-136.725.3165-88.2-67.4000114.2K110H108-K110 PolarHBondContact O-N 2.91Å; H108-K110 VanDerWaalsContact O-N 3.13Å
109D56.2Low59.8Low149 Ų149136.8 Ų136.880%0.79767%0.665SS**  trans-76.8102.1161-73.3-15.6000108.2I111D109-I111 PolarHBondContact O-N 2.96Å
110K55.7Low59.8Low197 Ų197134.8 Ų134.886%0.85766%0.662SS**  trans-58.390.6161.6-79.7177.6176.3176.70107.5H108 N112H108-K110 PolarHBondContact O-N 2.91Å; H108-K110 VanDerWaalsContact O-N 3.13Å; K110-N112 VanDerWaalsContact C-N 3.29Å; K110-N112 PolarHBondContact O-N 3.36Å
111I58.2Low60Low96 Ų96133.3 Ų133.349%0.49266%0.657SS.*  trans-67.694.2172.4-63.2164.8000105.9D109 G113 K116D109-I111 PolarHBondContact O-N 2.96Å; I111-G113 PolarHBondContact O-N 2.88Å; I111-K116 HydrophobicContact CD1-CD 4.24Å; I111-K116 VanDerWaalsContact CD1-NZ 3.26Å; I111-K116 HydrophobicContact CG2-CD 3.85Å; I111-K116 HydrophobicContact CG2-CG 4.24Å
112N56.9Low61Low147 Ų147136.4 Ų136.479%0.78666%0.664SS**  trans-52.3112.3166-84.4-18000108K110 K114K110-N112 VanDerWaalsContact C-N 3.29Å; K110-N112 PolarHBondContact O-N 3.36Å; N112-K114 PolarHBondContact O-N 2.81Å
113G53.1Low62.3Low62 Ų62137.8 Ų137.864%0.63967%0.666SS**THydrogen-bonded Turntrans-70.424.5-155.600000117.8I111 T117I111-G113 PolarHBondContact O-N 2.88Å; G113-T117 PolarHBondContact O-OG1 3.41Å
114K56Low63.4Low198 Ų198139.1 Ų139.186%0.86166%0.664SS**THydrogen-bonded Turntrans-109.7-24.8-173.1-67.1-172.7178.4-178.30115.3N112N112-K114 PolarHBondContact O-N 2.81Å
115R53.3Low64.8Low234 Ų234137 Ų13788%0.88366%0.657SS**Hα-helixtrans-96.4-20.3-171.4-144.7172.4-172.9163.41.1115.5
116K53.4Low66.4Low128 Ų128139.9 Ų139.956%0.55766%0.66SS**Hα-helixtrans-87-17.4-179.1-65.9-167.8-176.3177.60113.8I111 K120I111-K116 HydrophobicContact CD1-CD 4.24Å; I111-K116 VanDerWaalsContact CD1-NZ 3.26Å; I111-K116 HydrophobicContact CG2-CD 3.85Å; I111-K116 HydrophobicContact CG2-CG 4.24Å; K116-K120 WeakPolarHBondContact O-CB 3.4Å; K116-K120 PolarHBondContact O-N 3.36Å
117T58.7Low68Low66 Ų66136.1 Ų136.141%0.40565%0.647SS.*Hα-helixtrans-74.6-43.5-175.4-14.60000111.7G113 R119 K120 Q121G113-T117 PolarHBondContact O-OG1 3.41Å; T117-R119 PolarHBondContact O-N 3.05Å; T117-K120 PolarHBondContact O-N 3.49Å; T117-Q121 WeakPolarHBondContact O-CB 3.33Å; T117-Q121 VanDerWaalsContact O-CG 3.25Å; T117-Q121 WeakPolarHBondContact O-CG 3.48Å; T117-Q121 PolarHBondContact O-N 3.46Å
118A65.1Low69.5Low51 Ų51132.6 Ų132.642%0.42163%0.631SS.*Hα-helixtrans-64.4-42.4-179.500000113.1Q121 K122A118-Q121 PolarHBondContact O-N 2.85Å; A118-K122 WeakPolarHBondContact O-CB 3.41Å; A118-K122 WeakPolarHBondContact O-CG 3.46Å; A118-K122 PolarHBondContact O-N 3.02Å
119R71.6Confident71Confident188 Ų188128.2 Ų128.271%0.70961%0.611SS**Hα-helixtrans-68.8-40177-170.2177176.71790.1111.7T117 K122 M123T117-R119 PolarHBondContact O-N 3.05Å; R119-K122 PolarHBondContact O-N 3.46Å; R119-M123 HydrophobicContact CG-CE 4.28Å; R119-M123 WeakPolarHBondContact O-CG 3.34Å; R119-M123 PolarHBondContact O-N 3.1Å
120K72.3Confident72.6Confident151 Ų151126.4 Ų126.466%0.65760%0.601SS**Hα-helixtrans-64-43.6174.1-88.8-172.8171.6-174.20112.1K116 T117 M123 F124K116-K120 WeakPolarHBondContact O-CB 3.4Å; K116-K120 PolarHBondContact O-N 3.36Å; T117-K120 PolarHBondContact O-N 3.49Å; K120-M123 HydrophobicContact CG-CE 4.16Å; K120-M123 PolarHBondContact O-N 3.35Å; K120-F124 WeakPolarHBondContact O-CB 3.42Å; K120-F124 PolarHBondContact O-N 2.99Å
121Q74.9Confident74.1Confident112 Ų112125.2 Ų125.252%0.52359%0.591SS.*Hα-helixtrans-61.9-44176-76.8171.2-16.600111.4T117 A118 M123 F124 Q125T117-Q121 WeakPolarHBondContact O-CB 3.33Å; T117-Q121 VanDerWaalsContact O-CG 3.25Å; T117-Q121 WeakPolarHBondContact O-CG 3.48Å; T117-Q121 PolarHBondContact O-N 3.46Å; A118-Q121 PolarHBondContact O-N 2.85Å; Q121-M123 PolarHBondContact O-N 3.32Å; Q121-F124 PolarHBondContact O-N 3.44Å; Q121-Q125 WeakPolarHBondContact O-CB 3.47Å; Q121-Q125 WeakPolarHBondContact O-CG 3.48Å; Q121-Q125 PolarHBondContact O-N 3.01Å
122K85.4Confident75.5Confident145 Ų145128.7 Ų128.763%0.6360%0.598SS**Hα-helixtrans-61.5-40.3174.2-75.5-178.3180-1730112.9A118 R119 R126A118-K122 WeakPolarHBondContact O-CB 3.41Å; A118-K122 WeakPolarHBondContact O-CG 3.46Å; A118-K122 PolarHBondContact O-N 3.02Å; R119-K122 PolarHBondContact O-N 3.46Å; K122-R126 WeakPolarHBondContact O-CB 3.36Å; K122-R126 WeakPolarHBondContact O-CG 3.35Å; K122-R126 PolarHBondContact O-N 3.28Å
123M86.9Confident76.9Confident105 Ų105128.7 Ų128.752%0.51759%0.587SS.*Hα-helixtrans-67.6-39175.3-72-175.5-59.900112R119 K120 Q121 R126 A127R119-M123 HydrophobicContact CG-CE 4.28Å; R119-M123 WeakPolarHBondContact O-CG 3.34Å; R119-M123 PolarHBondContact O-N 3.1Å; K120-M123 HydrophobicContact CG-CE 4.16Å; K120-M123 PolarHBondContact O-N 3.35Å; Q121-M123 PolarHBondContact O-N 3.32Å; M123-R126 PolarHBondContact O-N 3.48Å; M123-A127 WeakPolarHBondContact O-CB 3.38Å; M123-A127 PolarHBondContact O-N 3.49Å
124F83.6Confident78.3Confident128 Ų128128.7 Ų128.756%0.56158%0.581SS**Hα-helixtrans-66.1-43.7176.7-174.1-103.4000111.9K120 Q121 A127 Q128K120-F124 WeakPolarHBondContact O-CB 3.42Å; K120-F124 PolarHBondContact O-N 2.99Å; Q121-F124 PolarHBondContact O-N 3.44Å; F124-A127 PolarHBondContact O-N 3.02Å; F124-Q128 HydrophobicContact CE1-CG 4.26Å; F124-Q128 HydrophobicContact CZ-CG 4.46Å; F124-Q128 WeakPolarHBondContact O-CG 3.39Å; F124-Q128 PolarHBondContact O-N 3.4Å
125Q86.7Confident79.4Confident122 Ų122123.2 Ų123.257%0.5756%0.558SS**Hα-helixtrans-60.1-46.8173.3-74.8173.3-11.100111.5Q121 A127 Q128 E129Q121-Q125 WeakPolarHBondContact O-CB 3.47Å; Q121-Q125 WeakPolarHBondContact O-CG 3.48Å; Q121-Q125 PolarHBondContact O-N 3.01Å; Q125-A127 VanDerWaalsContact C-N 3.33Å; Q125-A127 PolarHBondContact O-N 3.46Å; Q125-Q128 PolarHBondContact O-N 3.27Å; Q125-E129 WeakPolarHBondContact O-CB 3.31Å; Q125-E129 PolarHBondContact O-N 2.9Å
126R90.6Very high80.8Confident182 Ų182115.6 Ų115.669%0.68754%0.535SS*.Hα-helixtrans-61-39.6175-81.9-175.7175.2-174.4-1.7112.8K122 M123 E129 L130K122-R126 WeakPolarHBondContact O-CB 3.36Å; K122-R126 WeakPolarHBondContact O-CG 3.35Å; K122-R126 PolarHBondContact O-N 3.28Å; M123-R126 PolarHBondContact O-N 3.48Å; R126-E129 PolarHBondContact O-N 3.25Å; R126-L130 WeakPolarHBondContact O-CB 3.36Å; R126-L130 WeakPolarHBondContact O-CG 3.31Å; R126-L130 PolarHBondContact O-N 3.33Å
127A89.4Confident81.6Confident55 Ų55116.2 Ų116.246%0.45554%0.535SS..Hα-helixtrans-65.3-39.8176.600000111.7M123 F124 Q125 R131M123-A127 WeakPolarHBondContact O-CB 3.38Å; M123-A127 PolarHBondContact O-N 3.49Å; F124-A127 PolarHBondContact O-N 3.02Å; Q125-A127 VanDerWaalsContact C-N 3.33Å; Q125-A127 PolarHBondContact O-N 3.46Å; A127-R131 WeakPolarHBondContact O-CB 3.41Å; A127-R131 PolarHBondContact O-N 2.92Å
128Q91.2Very high82.1Confident88 Ų88118.7 Ų118.741%0.41154%0.541SS..Hα-helixtrans-65.7-40173.7-74.6-172.6-20.100112.4F124 Q125 R131 R132F124-Q128 HydrophobicContact CE1-CG 4.26Å; F124-Q128 HydrophobicContact CZ-CG 4.46Å; F124-Q128 WeakPolarHBondContact O-CG 3.39Å; F124-Q128 PolarHBondContact O-N 3.4Å; Q125-Q128 PolarHBondContact O-N 3.27Å; Q128-R131 WeakPolarHBondContact O-CB 3.27Å; Q128-R131 PolarHBondContact O-N 2.9Å; Q128-R132 WeakPolarHBondContact O-CG 3.18Å; Q128-R132 PolarHBondContact O-N 3.42Å
129E91.4Very high82.3Confident88 Ų88120.7 Ų120.741%0.41154%0.541SS..Hα-helixtrans-65-43.2176.9-169.6-176169.200111.8Q125 R126 R131 R132 R133Q125-E129 WeakPolarHBondContact O-CB 3.31Å; Q125-E129 PolarHBondContact O-N 2.9Å; R126-E129 PolarHBondContact O-N 3.25Å; E129-R131 VanDerWaalsContact C-N 3.3Å; E129-R131 PolarHBondContact O-N 3.35Å; E129-R132 PolarHBondContact O-N 2.87Å; E129-R133 WeakPolarHBondContact O-CG 3.38Å; E129-R133 PolarHBondContact O-N 3.23Å; E129-R133 IonicContact OE1-CZ 3.2Å; E129-R133 IonicContact OE1-NH1 3.37Å; E129-R133 PolarHBondContact OE1-NH1 2.84Å; E129-R133 IonicContact OE1-NH2 2.66Å; E129-R133 PolarHBondContact OE1-NH2 3.39Å
130L91Very high82.1Confident112 Ų112117.2 Ų117.259%0.58654%0.544SS*.Hα-helixtrans-60.9-40.2173.2-74.9171.9000111.9R126 R133 A134R126-L130 WeakPolarHBondContact O-CB 3.36Å; R126-L130 WeakPolarHBondContact O-CG 3.31Å; R126-L130 PolarHBondContact O-N 3.33Å; L130-R133 PolarHBondContact O-N 3.47Å; L130-A134 WeakPolarHBondContact O-CB 3.31Å; L130-A134 PolarHBondContact O-N 3.43Å
131R86.4Confident82.1Confident172 Ų172116.5 Ų116.565%0.64954%0.541SS*.Hα-helixtrans-62.4-46.2175.1-177.2179172170.43.6111.6A127 Q128 E129 R133 A134 E135A127-R131 WeakPolarHBondContact O-CB 3.41Å; A127-R131 PolarHBondContact O-N 2.92Å; Q128-R131 WeakPolarHBondContact O-CB 3.27Å; Q128-R131 PolarHBondContact O-N 2.9Å; E129-R131 VanDerWaalsContact C-N 3.3Å; E129-R131 PolarHBondContact O-N 3.35Å; R131-R133 PolarHBondContact O-N 3.5Å; R131-A134 PolarHBondContact O-N 2.91Å; R131-E135 WeakPolarHBondContact CG-OE1 3.31Å; R131-E135 IonicContact CZ-OE1 3.81Å; R131-E135 IonicContact NE-OE1 3.54Å; R131-E135 PolarHBondContact NE-OE1 3.47Å; R131-E135 IonicContact NH2-OE1 2.98Å; R131-E135 WeakPolarHBondContact O-CG 3.31Å; R131-E135 PolarHBondContact O-N 2.85Å
132R87.4Confident81.7Confident169 Ų169112.4 Ų112.464%0.63852%0.522SS*.Hα-helixtrans-59.9-45.1175.8-72179.2-178.1-178.60.5111.6Q128 E129 A134 E135 D136Q128-R132 WeakPolarHBondContact O-CG 3.18Å; Q128-R132 PolarHBondContact O-N 3.42Å; E129-R132 PolarHBondContact O-N 2.87Å; R132-A134 VanDerWaalsContact C-N 3.34Å; R132-A134 PolarHBondContact O-N 3.1Å; R132-E135 PolarHBondContact O-N 3Å; R132-D136 WeakPolarHBondContact O-CB 3.25Å; R132-D136 VanDerWaalsContact O-CG 3.28Å; R132-D136 PolarHBondContact O-N 2.86Å
133R85.6Confident81.1Confident147 Ų147109 Ų10956%0.55552%0.515SS*.Hα-helixtrans-60.5-40.2175.4-75.8-174.7177.8130.68.9112.9E129 L130 R131 D136 Y137E129-R133 WeakPolarHBondContact O-CG 3.38Å; E129-R133 PolarHBondContact O-N 3.23Å; E129-R133 IonicContact OE1-CZ 3.2Å; E129-R133 IonicContact OE1-NH1 3.37Å; E129-R133 PolarHBondContact OE1-NH1 2.84Å; E129-R133 IonicContact OE1-NH2 2.66Å; E129-R133 PolarHBondContact OE1-NH2 3.39Å; L130-R133 PolarHBondContact O-N 3.47Å; R131-R133 PolarHBondContact O-N 3.5Å; R133-D136 PolarHBondContact O-N 3.4Å; R133-Y137 VanDerWaalsContact O-CB 3.29Å; R133-Y137 WeakPolarHBondContact O-CB 3.4Å; R133-Y137 PolarHBondContact O-N 2.86Å
134A82.9Confident80.2Confident61 Ų61108.9 Ų108.950%0.50452%0.522SS..Hα-helixtrans-67.3-41.6176.700000111.8L130 R131 R132 Y137 H138L130-A134 WeakPolarHBondContact O-CB 3.31Å; L130-A134 PolarHBondContact O-N 3.43Å; R131-A134 PolarHBondContact O-N 2.91Å; R132-A134 VanDerWaalsContact C-N 3.34Å; R132-A134 PolarHBondContact O-N 3.1Å; A134-Y137 PolarHBondContact O-N 3.45Å; A134-H138 WeakPolarHBondContact O-CB 3.36Å; A134-H138 PolarHBondContact O-N 3.37Å
135E79.9Confident79.4Confident83 Ų83107.2 Ų107.239%0.38853%0.526SS..Hα-helixtrans-63.3-41.8174.6-72.8172.9-166.700111.2R131 R132 H138 K139R131-E135 WeakPolarHBondContact CG-OE1 3.31Å; R131-E135 IonicContact CZ-OE1 3.81Å; R131-E135 IonicContact NE-OE1 3.54Å; R131-E135 PolarHBondContact NE-OE1 3.47Å; R131-E135 IonicContact NH2-OE1 2.98Å; R131-E135 WeakPolarHBondContact O-CG 3.31Å; R131-E135 PolarHBondContact O-N 2.85Å; R132-E135 PolarHBondContact O-N 3Å; E135-H138 PolarHBondContact O-N 2.88Å; E135-K139 VanDerWaalsContact O-CG 3.31Å; E135-K139 WeakPolarHBondContact O-CG 3.38Å; E135-K139 PolarHBondContact O-N 2.85Å
136D81.4Confident78.5Confident75 Ų75103.1 Ų103.140%0.40151%0.513SS..Hα-helixtrans-70.5-37.5177.6-67.5-23.1000112.2R132 R133 H138 K139 C140R132-D136 WeakPolarHBondContact O-CB 3.25Å; R132-D136 VanDerWaalsContact O-CG 3.28Å; R132-D136 PolarHBondContact O-N 2.86Å; R133-D136 PolarHBondContact O-N 3.4Å; D136-H138 VanDerWaalsContact C-N 3.32Å; D136-H138 PolarHBondContact O-N 3.28Å; D136-K139 WeakPolarHBondContact O-CB 3.41Å; D136-K139 PolarHBondContact O-N 3.46Å; D136-K139 IonicContact OD1-NZ 2.83Å; D136-K139 PolarHBondContact OD1-NZ 3.47Å; D136-C140 PolarHBondContact O-N 2.85Å; D136-C140 PolarHBondContact O-SG 3.09Å
137Y71.8Confident77.5Confident140 Ų14099 Ų9955%0.54950%0.498SS..Hα-helixtrans-60.2-42.4170.7-177.5-100.4000112R133 A134 K139 C140 K141R133-Y137 VanDerWaalsContact O-CB 3.29Å; R133-Y137 WeakPolarHBondContact O-CB 3.4Å; R133-Y137 PolarHBondContact O-N 2.86Å; A134-Y137 PolarHBondContact O-N 3.45Å; Y137-K139 VanDerWaalsContact C-N 3.35Å; Y137-C140 PolarHBondContact O-N 2.91Å; Y137-K141 HydrophobicContact CD1-CD 4.18Å; Y137-K141 HydrophobicContact CE1-CD 3.52Å; Y137-K141 HydrophobicContact CE1-CG 4.27Å; Y137-K141 HydrophobicContact CE2-CD 4.26Å; Y137-K141 WeakPolarHBondContact O-CB 3.35Å; Y137-K141 PolarHBondContact O-N 2.97Å; Y137-K141 WeakPolarHBondContact OH-CE 3.42Å; Y137-K141 PolarHBondContact OH-NZ 3.39Å
138H69.4Low76.6Confident118 Ų118103.8 Ų103.855%0.54651%0.508SS..Hα-helixtrans-65.3-38.5175.4-171.873.8000111.8A134 E135 D136 I142A134-H138 WeakPolarHBondContact O-CB 3.36Å; A134-H138 PolarHBondContact O-N 3.37Å; E135-H138 PolarHBondContact O-N 2.88Å; D136-H138 VanDerWaalsContact C-N 3.32Å; D136-H138 PolarHBondContact O-N 3.28Å; H138-I142 WeakPolarHBondContact CE1-CD1 3.41Å; H138-I142 WeakPolarHBondContact NE2-CD1 3.37Å; H138-I142 WeakPolarHBondContact O-CG1 3.25Å; H138-I142 PolarHBondContact O-N 3.14Å; H138-I142 VanDerWaalsContact O-N 3.15Å
139K67.9Low75.6Confident94 Ų94102.5 Ų102.541%0.40951%0.512SS..Hα-helixtrans-62.7-45.3172.6-71.6171.8-159.5156.80111.5E135 D136 Y137 K141 I142 R147E135-K139 VanDerWaalsContact O-CG 3.31Å; E135-K139 WeakPolarHBondContact O-CG 3.38Å; E135-K139 PolarHBondContact O-N 2.85Å; D136-K139 WeakPolarHBondContact O-CB 3.41Å; D136-K139 PolarHBondContact O-N 3.46Å; D136-K139 IonicContact OD1-NZ 2.83Å; D136-K139 PolarHBondContact OD1-NZ 3.47Å; Y137-K139 VanDerWaalsContact C-N 3.35Å; K139-K141 VanDerWaalsContact C-N 3.34Å; K139-K141 PolarHBondContact O-N 3.47Å; K139-I142 VanDerWaalsContact O-O 3.08Å; K139-R147 VanDerWaalsContact CB-NH2 3.3Å; K139-R147 PolarHBondContact O-NH2 3.25Å
140C68.3Low74.6Confident115 Ų115102.4 Ų102.478%0.77751%0.514SS*.Hα-helixtrans-71.5-27.8-178.2-65.50000113D136 Y137D136-C140 PolarHBondContact O-N 2.85Å; D136-C140 PolarHBondContact O-SG 3.09Å; Y137-C140 PolarHBondContact O-N 2.91Å
141K71.6Confident73.6Confident135 Ų135100.8 Ų100.859%0.58751%0.511SS*.Hα-helixtrans-83.8-23.8178.1-80.6-158.9162.2-1730115Y137 K139Y137-K141 HydrophobicContact CD1-CD 4.18Å; Y137-K141 HydrophobicContact CE1-CD 3.52Å; Y137-K141 HydrophobicContact CE1-CG 4.27Å; Y137-K141 HydrophobicContact CE2-CD 4.26Å; Y137-K141 WeakPolarHBondContact O-CB 3.35Å; Y137-K141 PolarHBondContact O-N 2.97Å; Y137-K141 WeakPolarHBondContact OH-CE 3.42Å; Y137-K141 PolarHBondContact OH-NZ 3.39Å; K139-K141 VanDerWaalsContact C-N 3.34Å; K139-K141 PolarHBondContact O-N 3.47Å
142I66.8Low73Confident27 Ų2796.5 Ų96.514%0.13850%0.501CS..SBendtrans-107.3112.4-179.5-54.5-171.8000109.4H138 K139 A146 R147 L150H138-I142 WeakPolarHBondContact CE1-CD1 3.41Å; H138-I142 WeakPolarHBondContact NE2-CD1 3.37Å; H138-I142 WeakPolarHBondContact O-CG1 3.25Å; H138-I142 PolarHBondContact O-N 3.14Å; H138-I142 VanDerWaalsContact O-N 3.15Å; K139-I142 VanDerWaalsContact O-O 3.08Å; I142-A146 HydrophobicContact CG2-CB 3.74Å; I142-R147 HydrophobicContact CB-CG 4.13Å; I142-R147 HydrophobicContact CG2-CB 4.49Å; I142-R147 HydrophobicContact CG2-CG 3.53Å; I142-R147 PolarHBondContact O-NE 3.48Å; I142-R147 VanDerWaalsContact O-NE 3.16Å; I142-L150 HydrophobicContact CD1-CD1 4.31Å
143P72.9Confident72.3Confident72 Ų7297 Ų9747%0.46850%0.503SS..  trans-59.9145.9177.523.8-30.8000109.8S145 A146 R147P143-S145 PolarHBondContact O-N 2.88Å; P143-A146 HydrophobicContact CG-CB 3.77Å; P143-A146 PolarHBondContact O-N 3.3Å; P143-R147 PolarHBondContact O-N 2.93Å
144P67.7Low71.8Confident104 Ų10493.8 Ų93.868%0.67550%0.5SS*.Hα-helixtrans-51.3-34.4-176.5-28.234.5000113.9R147P144-R147 PolarHBondContact O-N 3.33Å
145S67.6Low71.2Confident93 Ų9399.9 Ų99.965%0.6551%0.51SS*.Hα-helixtrans-63.2-42.9175.452.80000113.4P143 R147 K148 A149P143-S145 PolarHBondContact O-N 2.88Å; S145-R147 VanDerWaalsContact C-N 3.32Å; S145-R147 PolarHBondContact O-N 3Å; S145-K148 PolarHBondContact O-N 3.35Å; S145-A149 PolarHBondContact O-N 2.92Å
146A67.6Low70.7Confident35 Ų35101.8 Ų101.829%0.28952%0.521SS..Hα-helixtrans-71.3-26.717900000112.5I142 P143 K148 A149 L150I142-A146 HydrophobicContact CG2-CB 3.74Å; P143-A146 HydrophobicContact CG-CB 3.77Å; P143-A146 PolarHBondContact O-N 3.3Å; A146-K148 VanDerWaalsContact C-N 3.33Å; A146-K148 PolarHBondContact O-N 2.91Å; A146-A149 PolarHBondContact O-N 3.5Å; A146-L150 WeakPolarHBondContact O-CB 3.48Å; A146-L150 PolarHBondContact O-N 2.96Å
147R68.4Low70Confident96 Ų96100 Ų10036%0.36252%0.516SS..Hα-helixtrans-63.6-39.1173.7-59.3-174.4-164.9167.29.7111.8K139 I142 P143 P144 S145 L150 C151K139-R147 VanDerWaalsContact CB-NH2 3.3Å; K139-R147 PolarHBondContact O-NH2 3.25Å; I142-R147 HydrophobicContact CB-CG 4.13Å; I142-R147 HydrophobicContact CG2-CB 4.49Å; I142-R147 HydrophobicContact CG2-CG 3.53Å; I142-R147 PolarHBondContact O-NE 3.48Å; I142-R147 VanDerWaalsContact O-NE 3.16Å; P143-R147 PolarHBondContact O-N 2.93Å; P144-R147 PolarHBondContact O-N 3.33Å; S145-R147 VanDerWaalsContact C-N 3.32Å; S145-R147 PolarHBondContact O-N 3Å; R147-L150 PolarHBondContact O-N 3.44Å; R147-C151 WeakPolarHBondContact O-CB 3.28Å; R147-C151 PolarHBondContact O-N 2.93Å; R147-C151 PolarHBondContact O-SG 3.17Å; R147-C151 VanDerWaalsContact O-SG 3.35Å
148K70.5Confident69.6Low155 Ų15595.3 Ų95.367%0.67451%0.506SS*.Hα-helixtrans-65.9-42.1178.3-164.3175.3-176.6-179.10111.2S145 A146 C151 N152S145-K148 PolarHBondContact O-N 3.35Å; A146-K148 VanDerWaalsContact C-N 3.33Å; A146-K148 PolarHBondContact O-N 2.91Å; K148-C151 PolarHBondContact O-N 3.3Å; K148-N152 WeakPolarHBondContact O-CB 3.29Å; K148-N152 VanDerWaalsContact O-CG 3.24Å; K148-N152 PolarHBondContact O-N 2.99Å
149A71.6Confident69.3Low61 Ų6191.6 Ų91.650%0.50450%0.496SS..Hα-helixtrans-63.3-44.6174.500000112.1S145 A146 N152 W153S145-A149 PolarHBondContact O-N 2.92Å; A146-A149 PolarHBondContact O-N 3.5Å; A149-N152 PolarHBondContact O-N 3.26Å; A149-W153 WeakPolarHBondContact O-CB 3.29Å; A149-W153 PolarHBondContact O-N 2.91Å
150L70.8Confident68.8Low86 Ų8693.6 Ų93.645%0.4551%0.507SS..Hα-helixtrans-62.8-45.3176-113.5136.4000112.5I142 A146 R147 N152 W153 V154I142-L150 HydrophobicContact CD1-CD1 4.31Å; A146-L150 WeakPolarHBondContact O-CB 3.48Å; A146-L150 PolarHBondContact O-N 2.96Å; R147-L150 PolarHBondContact O-N 3.44Å; L150-N152 VanDerWaalsContact C-N 3.33Å; L150-N152 PolarHBondContact O-N 2.91Å; L150-W153 PolarHBondContact O-N 3.19Å; L150-V154 WeakPolarHBondContact O-CB 3.29Å; L150-V154 VanDerWaalsContact O-CG2 3.3Å; L150-V154 WeakPolarHBondContact O-CG2 3.46Å; L150-V154 PolarHBondContact O-N 2.98Å
151C68.4Low68.1Low78 Ų7895 Ų9553%0.52750%0.502SS..Hα-helixtrans-63.1-39.1176.3-76.10000112.2R147 K148 R155R147-C151 WeakPolarHBondContact O-CB 3.28Å; R147-C151 PolarHBondContact O-N 2.93Å; R147-C151 PolarHBondContact O-SG 3.17Å; R147-C151 VanDerWaalsContact O-SG 3.35Å; K148-C151 PolarHBondContact O-N 3.3Å; C151-R155 WeakPolarHBondContact O-CB 3.31Å; C151-R155 WeakPolarHBondContact O-CG 3.36Å; C151-R155 PolarHBondContact O-N 3.35Å
152N74.2Confident67.1Low82 Ų8297 Ų9744%0.43951%0.505SS..Hα-helixtrans-67.2-41175.4-75.7-7000111.5K148 A149 L150 R155 M156K148-N152 WeakPolarHBondContact O-CB 3.29Å; K148-N152 VanDerWaalsContact O-CG 3.24Å; K148-N152 PolarHBondContact O-N 2.99Å; A149-N152 PolarHBondContact O-N 3.26Å; L150-N152 VanDerWaalsContact C-N 3.33Å; L150-N152 PolarHBondContact O-N 2.91Å; N152-R155 PolarHBondContact O-N 3.42Å; N152-M156 WeakPolarHBondContact O-CB 3.38Å; N152-M156 VanDerWaalsContact O-CG 3.28Å; N152-M156 WeakPolarHBondContact O-CG 3.17Å; N152-M156 PolarHBondContact O-N 3.23Å
153W73.9Confident66.4Low179 Ų179103.5 Ų103.568%0.67854%0.535SS*.Hα-helixtrans-65.6-42.8176.2-176.174.3000112.5A149 L150 R155 M156 A157A149-W153 WeakPolarHBondContact O-CB 3.29Å; A149-W153 PolarHBondContact O-N 2.91Å; L150-W153 PolarHBondContact O-N 3.19Å; W153-R155 VanDerWaalsContact C-N 3.31Å; W153-R155 PolarHBondContact O-N 3.36Å; W153-M156 WeakPolarHBondContact O-CB 3.43Å; W153-M156 PolarHBondContact O-N 3.29Å; W153-A157 WeakPolarHBondContact O-CB 3.23Å; W153-A157 PolarHBondContact O-N 3.43Å
154V74.1Confident65.5Low80 Ų80105.3 Ų105.349%0.48555%0.549SS..Hα-helixtrans-63.3-38174.3171.10000111.2L150 A158L150-V154 WeakPolarHBondContact O-CB 3.29Å; L150-V154 VanDerWaalsContact O-CG2 3.3Å; L150-V154 WeakPolarHBondContact O-CG2 3.46Å; L150-V154 PolarHBondContact O-N 2.98Å; V154-A158 VanDerWaalsContact O-CB 3.24Å; V154-A158 WeakPolarHBondContact O-CB 3.46Å; V154-A158 PolarHBondContact O-N 3.32Å
155R70.9Confident65Low190 Ų190103 Ų10372%0.71754%0.536SS*.Hα-helixtrans-66.3-43.5174-81.7179.8169179.6-4112.5C151 N152 W153 A158 A159C151-R155 WeakPolarHBondContact O-CB 3.31Å; C151-R155 WeakPolarHBondContact O-CG 3.36Å; C151-R155 PolarHBondContact O-N 3.35Å; N152-R155 PolarHBondContact O-N 3.42Å; W153-R155 VanDerWaalsContact C-N 3.31Å; W153-R155 PolarHBondContact O-N 3.36Å; R155-A158 PolarHBondContact O-N 3.05Å; R155-A159 WeakPolarHBondContact O-CB 3.49Å; R155-A159 PolarHBondContact O-N 3.49Å
156M69.1Low64.5Low123 Ų123102.1 Ų102.161%0.60654%0.541SS*.Hα-helixtrans-59.3-52174.5-81-79.8-5000111.2N152 W153 A158 A159 E160N152-M156 WeakPolarHBondContact O-CB 3.38Å; N152-M156 VanDerWaalsContact O-CG 3.28Å; N152-M156 WeakPolarHBondContact O-CG 3.17Å; N152-M156 PolarHBondContact O-N 3.23Å; W153-M156 WeakPolarHBondContact O-CB 3.43Å; W153-M156 PolarHBondContact O-N 3.29Å; M156-A158 VanDerWaalsContact C-N 3.29Å; M156-A158 PolarHBondContact O-N 3.08Å; M156-A159 CarbonylContact O-C 3.58Å; M156-A159 WeakPolarHBondContact O-CB 3.43Å; M156-A159 PolarHBondContact O-N 3.35Å; M156-A159 VanDerWaalsContact O-N 3.07Å; M156-E160 WeakPolarHBondContact O-CB 3.2Å; M156-E160 PolarHBondContact O-N 2.87Å
157A66.8Low63.7Low38 Ų38106.9 Ų106.931%0.31456%0.561SS.*Hα-helixtrans-62.7-36.5179.400000112.1W153 H161W153-A157 WeakPolarHBondContact O-CB 3.23Å; W153-A157 PolarHBondContact O-N 3.43Å; A157-H161 VanDerWaalsContact O-CB 3.27Å; A157-H161 WeakPolarHBondContact O-CB 3.39Å; A157-H161 PolarHBondContact O-N 3.33Å
158A62.8Low62.7Low41 Ų41107.3 Ų107.334%0.33958%0.576SS.*Hα-helixtrans-69.4-35.3173.700000112.6V154 R155 M156 R162V154-A158 VanDerWaalsContact O-CB 3.24Å; V154-A158 WeakPolarHBondContact O-CB 3.46Å; V154-A158 PolarHBondContact O-N 3.32Å; R155-A158 PolarHBondContact O-N 3.05Å; M156-A158 VanDerWaalsContact C-N 3.29Å; M156-A158 PolarHBondContact O-N 3.08Å; A158-R162 WeakPolarHBondContact O-CB 3.35Å; A158-R162 VanDerWaalsContact O-CD 3.3Å; A158-R162 WeakPolarHBondContact O-CD 3.21Å; A158-R162 WeakPolarHBondContact O-CG 3.44Å; A158-R162 PolarHBondContact O-N 3.15Å
159A62.8Low61.5Low39 Ų39108.9 Ų108.932%0.32258%0.579SS.*Hα-helixtrans-68.8-43172.500000111.7R155 M156 R162 H163R155-A159 WeakPolarHBondContact O-CB 3.49Å; R155-A159 PolarHBondContact O-N 3.49Å; M156-A159 CarbonylContact O-C 3.58Å; M156-A159 WeakPolarHBondContact O-CB 3.43Å; M156-A159 PolarHBondContact O-N 3.35Å; M156-A159 VanDerWaalsContact O-N 3.07Å; A159-R162 WeakPolarHBondContact O-CA 3.36Å; A159-R162 WeakPolarHBondContact O-CB 3.15Å; A159-R162 PolarHBondContact O-N 3.23Å; A159-H163 PolarHBondContact O-CD2 3.5Å; A159-H163 PolarHBondContact O-N 3.47Å
160E58.9Low60.3Low136 Ų136116.8 Ų116.864%0.63660%0.596SS**Hα-helixtrans-64.5-43.1178.6-165.7171.4-174.800111.8M156 R162 H163 S164M156-E160 WeakPolarHBondContact O-CB 3.2Å; M156-E160 PolarHBondContact O-N 2.87Å; E160-R162 PolarHBondContact O-N 3Å; E160-H163 PolarHBondContact O-N 3.47Å; E160-S164 PolarHBondContact O-N 3.37Å
161H52.8Low59.4Low146 Ų146115.7 Ų115.768%0.67660%0.595SS**Hα-helixtrans-64.7-23.4171.5-167.9-67.6000112.9A157 S165A157-H161 VanDerWaalsContact O-CB 3.27Å; A157-H161 WeakPolarHBondContact O-CB 3.39Å; A157-H161 PolarHBondContact O-N 3.33Å; H161-S165 PolarHBondContact O-OG 2.8Å
162R50.6Low58.3Low176 Ų176122.6 Ų122.666%0.66461%0.611SS**Hα-helixtrans-81.2-29.2175.8-77.4167.9-178-172.3-0113.2A158 A159 E160 S165A158-R162 WeakPolarHBondContact O-CB 3.35Å; A158-R162 VanDerWaalsContact O-CD 3.3Å; A158-R162 WeakPolarHBondContact O-CD 3.21Å; A158-R162 WeakPolarHBondContact O-CG 3.44Å; A158-R162 PolarHBondContact O-N 3.15Å; A159-R162 WeakPolarHBondContact O-CA 3.36Å; A159-R162 WeakPolarHBondContact O-CB 3.15Å; A159-R162 PolarHBondContact O-N 3.23Å; E160-R162 PolarHBondContact O-N 3Å; R162-S165 PolarHBondContact O-OG 2.89Å
163H52.3Low57.2Low163 Ų163122.5 Ų122.576%0.75561%0.61SS**Hα-helixtrans-76.8-28.6174.9-68.4-63.2000112.4A159 E160A159-H163 PolarHBondContact O-CD2 3.5Å; A159-H163 PolarHBondContact O-N 3.47Å; E160-H163 PolarHBondContact O-N 3.47Å
164S54.3Low56.4Low110 Ų110118.2 Ų118.277%0.76960%0.604SS**SBendtrans-83.2-11.6177.8-1660000114.6E160E160-S164 PolarHBondContact O-N 3.37Å
165S57.1Low55.4Low56 Ų56118.4 Ų118.439%0.39261%0.614SS.*SBendtrans-94.5-6.8-174.865.80000115H161 R162 L167H161-S165 PolarHBondContact O-OG 2.8Å; R162-S165 PolarHBondContact O-OG 2.89Å; S165-L167 PolarHBondContact O-N 3.13Å
166G56.2Low54.6Low75 Ų75116.2 Ų116.277%0.77361%0.612SS**  trans60.913.3175.400000115.6
167L51.6Low53.9Low135 Ų135112.8 Ų112.871%0.70760%0.598SS**  trans-88.7131.9-176.9-81.4163.7000111.2S165 Y169S165-L167 PolarHBondContact O-N 3.13Å; L167-Y169 PolarHBondContact O-N 3.45Å
168P47.4Very low53.4Low104 Ų104115 Ų11568%0.67560%0.603SS**  trans-63.6135.1179.224.6-32.1000111.2W170P168-W170 PolarHBondContact O-N 3.5Å; P168-W170 VanDerWaalsContact O-N 3.1Å
169Y44.6Very low53.1Low189 Ų189120.5 Ų120.574%0.74162%0.62SS**  trans-60.4107.5178.7173.4-110.2000110.9L167 P171L167-Y169 PolarHBondContact O-N 3.45Å; Y169-P171 HydrophobicContact CD1-CG 4.09Å; Y169-P171 HydrophobicContact CE1-CB 3.66Å; Y169-P171 HydrophobicContact CE1-CG 3.53Å; Y169-P171 HydrophobicContact CE2-CB 4.31Å; Y169-P171 WeakPolarHBondContact O-CD 3.46Å; Y169-P171 WeakPolarHBondContact OH-CB 3.32Å
170W46.8Very low53Low226 Ų226123.9 Ų123.986%0.85663%0.632SS**  trans-94.7105.1156.9-85.388000107.7P168 Y172P168-W170 PolarHBondContact O-N 3.5Å; P168-W170 VanDerWaalsContact O-N 3.1Å; W170-Y172 PolarHBondContact O-N 3.04Å; W170-Y172 VanDerWaalsContact O-N 3.17Å
171P51.4Low52.9Low64 Ų64126.3 Ų126.342%0.41664%0.636SS.*  trans-57.3127.1170.511.4-12.2000107.4Y169 L173Y169-P171 HydrophobicContact CD1-CG 4.09Å; Y169-P171 HydrophobicContact CE1-CB 3.66Å; Y169-P171 HydrophobicContact CE1-CG 3.53Å; Y169-P171 HydrophobicContact CE2-CB 4.31Å; Y169-P171 WeakPolarHBondContact O-CD 3.46Å; Y169-P171 WeakPolarHBondContact OH-CB 3.32Å; P171-L173 PolarHBondContact O-N 3.37Å
172Y46.2Very low53Low222 Ų222126.3 Ų126.387%0.87164%0.638SS**  trans-45.9113.8162.9-141.8-98.3000106.1W170 T174W170-Y172 PolarHBondContact O-N 3.04Å; W170-Y172 VanDerWaalsContact O-N 3.17Å; Y172-T174 VanDerWaalsContact C-N 3.35Å; Y172-T174 PolarHBondContact O-N 3.5Å
173L50.9Low53.2Low81 Ų81120.7 Ų120.742%0.42464%0.635SS.*  trans-51.6107.7173.5-81.2158.8000106.1P171 A175 T177P171-L173 PolarHBondContact O-N 3.37Å; L173-A175 PolarHBondContact O-N 2.92Å; L173-T177 HydrophobicContact CD2-CG2 3.53Å
174T57.9Low53.5Low88 Ų88120.7 Ų120.754%0.5464%0.635SS.*  trans-50.2140.2173.811.90000107.4Y172 E176 T177 L178Y172-T174 VanDerWaalsContact C-N 3.35Å; Y172-T174 PolarHBondContact O-N 3.5Å; T174-E176 PolarHBondContact O-N 3.43Å; T174-T177 WeakPolarHBondContact O-CA 3.43Å; T174-T177 WeakPolarHBondContact O-CB 3.25Å; T174-T177 PolarHBondContact O-N 3.39Å; T174-T177 PolarHBondContact O-OG1 3.05Å; T174-T177 PolarHBondContact OG1-OG1 3.42Å; T174-L178 PolarHBondContact O-N 3.01Å
175A52.9Low53.7Low84 Ų84124 Ų12469%0.69464%0.638SS**Hα-helixtrans-51.5-27.4179.600000111.9L173 L178 K179L173-A175 PolarHBondContact O-N 2.92Å; A175-L178 PolarHBondContact O-N 3.32Å; A175-K179 WeakPolarHBondContact O-CB 3.39Å; A175-K179 PolarHBondContact O-N 3.01Å
176E53.3Low53.9Low145 Ų145126.4 Ų126.468%0.67865%0.653SS**Hα-helixtrans-63.4-41.4172.6-151.4142.7-147.500113.7T174 K179 N180T174-E176 PolarHBondContact O-N 3.43Å; E176-K179 PolarHBondContact O-N 3.08Å; E176-N180 VanDerWaalsContact O-CG 3.25Å; E176-N180 PolarHBondContact O-N 3.02Å; E176-N180 PolarHBondContact O-ND2 3.28Å
177T54.2Low54.2Low50 Ų50128.5 Ų128.531%0.30765%0.652SS.*Hα-helixtrans-69.9-34.6175.2-37.60000111.9L173 T174 R181L173-T177 HydrophobicContact CD2-CG2 3.53Å; T174-T177 WeakPolarHBondContact O-CA 3.43Å; T174-T177 WeakPolarHBondContact O-CB 3.25Å; T174-T177 PolarHBondContact O-N 3.39Å; T174-T177 PolarHBondContact O-OG1 3.05Å; T174-T177 PolarHBondContact OG1-OG1 3.42Å; T177-R181 PolarHBondContact O-N 3.44Å
178L56.4Low54.8Low84 Ų84127.3 Ų127.344%0.4465%0.653SS.*Hα-helixtrans-70.2-37.3173.7-120.7152.4000111.3T174 A175 R181 M182T174-L178 PolarHBondContact O-N 3.01Å; A175-L178 PolarHBondContact O-N 3.32Å; L178-R181 PolarHBondContact O-N 3.36Å; L178-M182 HydrophobicContact CB-CE 4.33Å; L178-M182 HydrophobicContact CD2-CE 3.55Å; L178-M182 HydrophobicContact CD2-SD 4.48Å; L178-M182 WeakPolarHBondContact O-CE 3.4Å; L178-M182 PolarHBondContact O-N 3.34Å; L178-M182 VanDerWaalsContact O-N 3.08Å
179K57.3Low55.1Low158 Ų158128.2 Ų128.269%0.68766%0.659SS**Hα-helixtrans-67.1-40.9176.6-160.2-179.6-178.4-170.50112.2A175 E176 R181 M182 G183A175-K179 WeakPolarHBondContact O-CB 3.39Å; A175-K179 PolarHBondContact O-N 3.01Å; E176-K179 PolarHBondContact O-N 3.08Å; K179-R181 VanDerWaalsContact C-N 3.28Å; K179-R181 PolarHBondContact O-N 3.25Å; K179-M182 PolarHBondContact O-N 3.36Å; K179-G183 PolarHBondContact O-N 3.49Å; K179-G183 VanDerWaalsContact O-N 3.09Å
180N59.3Low55.8Low109 Ų109125.5 Ų125.558%0.58366%0.662SS**Hα-helixtrans-67.2-27.2176.4-67.1-16.1000113E176E176-N180 VanDerWaalsContact O-CG 3.25Å; E176-N180 PolarHBondContact O-N 3.02Å; E176-N180 PolarHBondContact O-ND2 3.28Å
181R57.1Low56.3Low188 Ų188123.8 Ų123.871%0.70966%0.664SS**Hα-helixtrans-81.4-30173.9-75.4-174.6175.6-174.5-0.9114.1T177 L178 K179T177-R181 PolarHBondContact O-N 3.44Å; L178-R181 PolarHBondContact O-N 3.36Å; K179-R181 VanDerWaalsContact C-N 3.28Å; K179-R181 PolarHBondContact O-N 3.25Å
182M55.6Low56.1Low145 Ų145133.1 Ų133.171%0.71470%0.702SS**Hα-helixtrans-82-14.7175.5-79.4-177.1-73.900113.6L178 K179L178-M182 HydrophobicContact CB-CE 4.33Å; L178-M182 HydrophobicContact CD2-CE 3.55Å; L178-M182 HydrophobicContact CD2-SD 4.48Å; L178-M182 WeakPolarHBondContact O-CE 3.4Å; L178-M182 PolarHBondContact O-N 3.34Å; L178-M182 VanDerWaalsContact O-N 3.08Å; K179-M182 PolarHBondContact O-N 3.36Å
183G55.1Low56.6Low59 Ų59128.7 Ų128.761%0.60869%0.693SS**THydrogen-bonded Turntrans-89.4-0.5-178.500000115.8K179 Q185K179-G183 PolarHBondContact O-N 3.49Å; K179-G183 VanDerWaalsContact O-N 3.09Å; G183-Q185 PolarHBondContact O-N 3.46Å
184H57.7Low56.9Low162 Ų162131.2 Ų131.275%0.7571%0.707SS**  trans-89.1105.9173.7-76.525000109.2
185Q59.3Low56.8Low180 Ų180133.6 Ų133.684%0.84172%0.717SS**PPolyproline II helixtrans-62.1139.9160.8-84.1-163.6-5.700108.8G183G183-Q185 PolarHBondContact O-N 3.46Å
186P61.2Low57Low107 Ų107136.5 Ų136.570%0.69572%0.718SS**PPolyproline II helixtrans-60.3141.6167.626.3-31.4000108.9
187P62.3Low57.3Low118 Ų118135.9 Ų135.977%0.76672%0.72SS**PPolyproline II helixtrans-58.4143175.825.2-32.5000109.5
188P64.6Low57.5Low111 Ų111141.7 Ų141.772%0.72175%0.748SS**PPolyproline II helixtrans-60.1146.1-178.624.6-32.6000110.3T190P188-T190 PolarHBondContact O-N 3.49Å
189P52.4Low57.6Low122 Ų122145.8 Ų145.879%0.79277%0.77SS**PPolyproline II helixtrans-61.1123.5-177.924.8-32.5000109.8Q191P189-Q191 PolarHBondContact O-N 3.46Å
190T60.2Low57.6Low132 Ų132144.8 Ų144.881%0.8178%0.776SS**PPolyproline II helixtrans-64.9116.7172.6-46.20000108.3P188 Q192P188-T190 PolarHBondContact O-N 3.49Å; T190-Q192 PolarHBondContact O-N 3.41Å
191Q56.6Low57.5Low191 Ų191147.8 Ų147.889%0.89379%0.792SS**  trans-76.8107.1168.6-75.6-116.2-7.100108.6P189P189-Q191 PolarHBondContact O-N 3.46Å
192Q47.4Very low57.5Low259 Ų259144.2 Ų144.2100%1.2180%0.8SS**  trans-146.40152-69.8-163.9-14.600108.9T190T190-Q192 PolarHBondContact O-N 3.41Å

Retrieved 192 of 192 residues in 202.8 ms (Link to these results)