A0A087Y023_POEFO Loading...

Transcription factor AP-4

AlphaFold DB (A0A3B3VB98), UniProt , Accession A0A087Y023, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 329 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
1M40.7Very low44.4Very low227 Ų227170.9 Ų170.9100%1.11887%0.872SS**  094.80-89.8172.517200106.9
2E39.2Very low45.5Very low201 Ų201165.5 Ų165.594%0.93986%0.857SS**  trans-100.3126.4170.1-71.2-156.8150.200108.5
3Y40.1Very low46.5Very low216 Ų216160.2 Ų160.285%0.84784%0.839SS**  trans-85.7128178.6-80.1-92.2000109.7
4F37.1Very low46.9Very low189 Ų189159.7 Ų159.783%0.82984%0.837SS**  trans-89.5115174.4-154.2-95000109.1V6F4-V6 HydrophobicContact CD1-CG2 3.82Å; F4-V6 HydrophobicContact CE1-CG2 4.11Å
5M48.8Very low47.3Very low180 Ų180160 Ų16089%0.88783%0.832SS**  trans-92.3115.7169.7-98.3177.255.200109.6
6V44.3Very low47.2Very low124 Ų124159.1 Ų159.175%0.75282%0.822SS**PPolyproline II helixtrans-87.6125.6173-178.90000109.5F4F4-V6 HydrophobicContact CD1-CG2 3.82Å; F4-V6 HydrophobicContact CE1-CG2 4.11Å
7S45.2Very low47.1Very low113 Ų113159.2 Ų159.279%0.7982%0.815SS**PPolyproline II helixtrans-72.6126.8176.6-44.80000111.3
8A48.3Very low47.3Very low104 Ų104161.4 Ų161.486%0.8681%0.812SS**PPolyproline II helixtrans-73.9123.7176.900000111.9
9Q43.6Very low47.5Very low191 Ų191161.3 Ų161.389%0.89381%0.805SS**PPolyproline II helixtrans-81.4124.2175.9-163.7173.2-300110.4V11Q9-V11 PolarHBondContact O-N 3.11Å
10K48.9Very low47.7Very low204 Ų204157 Ų15789%0.88779%0.788SS**  trans-77115-174.6-149.3176.8-172.9-178.90110.3
11V52.4Low47.8Very low131 Ų131155.4 Ų155.479%0.79478%0.778SS**PPolyproline II helixtrans-75131.8176.7-173.10000109.8Q9Q9-V11 PolarHBondContact O-N 3.11Å
12P57.9Low48.2Very low106 Ų106152.9 Ų152.969%0.68876%0.761SS**PPolyproline II helixtrans-71.8150.6177.41.410.6000112.1
13P57.6Low48.8Very low97 Ų97150.6 Ų150.663%0.6375%0.75SS**PPolyproline II helixtrans-74.3139.3-172.528.4-32.6000113.2Q15 H16P13-Q15 PolarHBondContact O-N 3.04Å; P13-H16 PolarHBondContact O-N 3.29Å
14L52.9Low49.5Very low153 Ų153144.7 Ų144.780%0.80174%0.737SS**THydrogen-bonded Turntrans-50.7-10.7179.7-96.9149.3000116.6H16L14-H16 VanDerWaalsContact C-N 3.34Å
15Q53.1Low50.2Low164 Ų164140.9 Ų140.977%0.76672%0.724SS**Hα-helixtrans-74.5-20.6178.4-69.1-166.4-13.800113.8P13P13-Q15 PolarHBondContact O-N 3.04Å
16H45.6Very low50.1Low146 Ų146134.1 Ų134.168%0.67670%0.7SS**Hα-helixtrans-73.4-31.5177.1-104.254.6000113.2P13 L14 T20P13-H16 PolarHBondContact O-N 3.29Å; L14-H16 VanDerWaalsContact C-N 3.34Å; H16-T20 PolarHBondContact O-OG1 2.98Å
17F45.3Very low50.5Low160 Ų160130 Ų13070%0.70268%0.683SS**Hα-helixtrans-69.1-35.6-179.2-96.8-90.6000113.3K19 T20 E21F17-K19 PolarHBondContact O-N 3.48Å; F17-T20 PolarHBondContact O-N 3.32Å; F17-T20 PolarHBondContact O-OG1 2.94Å; F17-E21 PolarHBondContact O-N 3.47Å
18R50.5Low50.9Low200 Ų200130.4 Ų130.476%0.75568%0.676SS**Hα-helixtrans-76.8-17.6-179.3-72.1-149176.9-1720.6114.8
19K50.4Low50.9Low158 Ų158130.4 Ų130.469%0.68767%0.668SS**Hα-helixtrans-78.6-36.9172.7-83.8-178175.6-179.30111.5F17 K22 E23F17-K19 PolarHBondContact O-N 3.48Å; K19-K22 PolarHBondContact O-N 3.46Å; K19-E23 PolarHBondContact O-N 3.26Å
20T52.3Low51.2Low76 Ų76124.9 Ų124.947%0.46665%0.651SS.*Hα-helixtrans-69.4-39.7-1802.50000112.3H16 F17 K22 E23 V24H16-T20 PolarHBondContact O-OG1 2.98Å; F17-T20 PolarHBondContact O-N 3.32Å; F17-T20 PolarHBondContact O-OG1 2.94Å; T20-K22 PolarHBondContact O-N 3.32Å; T20-E23 PolarHBondContact O-N 3.05Å; T20-V24 WeakPolarHBondContact O-CB 3.32Å; T20-V24 WeakPolarHBondContact O-CG2 3.45Å; T20-V24 PolarHBondContact O-N 3.43Å
21E50.3Low51.5Low124 Ų124121.5 Ų121.558%0.57964%0.642SS**Hα-helixtrans-65.4-35.8175.3-84.1-174.8144.200113.2F17 V24 I25F17-E21 PolarHBondContact O-N 3.47Å; E21-V24 PolarHBondContact O-N 2.99Å; E21-I25 HydrophobicContact CB-CD1 4.49Å; E21-I25 WeakPolarHBondContact O-CB 3.49Å; E21-I25 VanDerWaalsContact O-CG1 3.28Å; E21-I25 WeakPolarHBondContact O-CG1 3.36Å; E21-I25 PolarHBondContact O-N 3.32Å
22K48.6Very low51.5Low174 Ų174118.9 Ų118.976%0.75763%0.634SS**Hα-helixtrans-69-32.6178.3-81.5-172.8173.4-172.60112.9K19 T20 G26K19-K22 PolarHBondContact O-N 3.46Å; T20-K22 PolarHBondContact O-N 3.32Å; K22-G26 PolarHBondContact O-N 3.39Å
23E52.1Low51.2Low153 Ų153121.2 Ų121.272%0.71564%0.641SS**Hα-helixtrans-76.1-36.8173.4-75.4-180167.400112.3K19 T20 G27K19-E23 PolarHBondContact O-N 3.26Å; T20-E23 PolarHBondContact O-N 3.05Å; E23-G27 PolarHBondContact O-N 2.93Å
24V55Low51.2Low92 Ų92121.9 Ų121.956%0.55864%0.638SS**Hα-helixtrans-70.7-41.2178.7173.70000111.6T20 E21 L28T20-V24 WeakPolarHBondContact O-CB 3.32Å; T20-V24 WeakPolarHBondContact O-CG2 3.45Å; T20-V24 PolarHBondContact O-N 3.43Å; E21-V24 PolarHBondContact O-N 2.99Å; V24-L28 WeakPolarHBondContact O-CG 3.48Å
25I51.8Low51.2Low108 Ų108120 Ų12055%0.55463%0.634SS**Hα-helixtrans-77.5-36.9179.1-63.3168000111.1E21 G27 L28E21-I25 HydrophobicContact CB-CD1 4.49Å; E21-I25 WeakPolarHBondContact O-CB 3.49Å; E21-I25 VanDerWaalsContact O-CG1 3.28Å; E21-I25 WeakPolarHBondContact O-CG1 3.36Å; E21-I25 PolarHBondContact O-N 3.32Å; I25-G27 VanDerWaalsContact C-N 3.3Å; I25-G27 PolarHBondContact O-N 3.17Å; I25-L28 PolarHBondContact O-N 3.05Å
26G47Very low51.4Low39 Ų39116.4 Ų116.440%0.40262%0.62SS.*Hα-helixtrans-67.3-27.6175.100000114.1K22 S30K22-G26 PolarHBondContact O-N 3.39Å; G26-S30 PolarHBondContact O-OG 3.38Å
27G51.7Low52.2Low38 Ų38113.3 Ų113.339%0.39261%0.611SS.*Hα-helixtrans-75.1-30.1175.900000114.3E23 I25E23-G27 PolarHBondContact O-N 2.93Å; I25-G27 VanDerWaalsContact C-N 3.3Å; I25-G27 PolarHBondContact O-N 3.17Å
28L53.3Low53.3Low120 Ų120110.2 Ų110.263%0.62861%0.608SS**Hα-helixtrans-77.6-35-176.2-69.5170.1000113V24 I25V24-L28 WeakPolarHBondContact O-CG 3.48Å; I25-L28 PolarHBondContact O-N 3.05Å
29C48Very low54Low104 Ų104106.2 Ų106.270%0.70360%0.597SS**Hα-helixtrans-80.1-20.1177-67.20000113.5L31C29-L31 VanDerWaalsContact C-N 3.3Å; C29-L31 PolarHBondContact O-N 3.47Å
30S50.6Low55.2Low75 Ų75101.4 Ų101.452%0.52458%0.581SS.*G310 helixtrans-77.1-14.5177.6-61.10000113.3G26 I34G26-S30 PolarHBondContact O-OG 3.38Å; S30-I34 WeakPolarHBondContact O-CD1 3.44Å; S30-I34 VanDerWaalsContact O-CG1 3.24Å; S30-I34 WeakPolarHBondContact O-CG1 3.37Å
31L54.7Low56.5Low133 Ų13399.8 Ų99.870%0.69658%0.575SS**G310 helixtrans-81.4-11.3179-74.1165.2000114.2C29C29-L31 VanDerWaalsContact C-N 3.3Å; C29-L31 PolarHBondContact O-N 3.47Å
32A53.2Low58.2Low76 Ų76101.4 Ų101.463%0.62858%0.576SS**G310 helixtrans-86.6-13-172.300000114.5
33N51.5Low60.1Low156 Ų15696.7 Ų96.783%0.83456%0.56SS**SBendtrans-151.538.5-174.7-83.3-35.1000113.8
34I58.5Low62Low111 Ų11194.3 Ų94.357%0.56955%0.548SS*.  trans-86.2124.8165.5-63161.7000106.7S30 L36S30-I34 WeakPolarHBondContact O-CD1 3.44Å; S30-I34 VanDerWaalsContact O-CG1 3.24Å; S30-I34 WeakPolarHBondContact O-CG1 3.37Å; I34-L36 PolarHBondContact O-N 2.99Å
35P52.3Low63.9Low112 Ų11293.9 Ų93.973%0.72754%0.54SS*.  trans-53.8113.2169-18.929.6000107.3T37P35-T37 PolarHBondContact O-N 3.23Å
36L56Low66Low90 Ų9094.8 Ų94.847%0.47154%0.537SS..  trans-53.3107.9173.3-77.9155.2000106.2I34 T40 A41I34-L36 PolarHBondContact O-N 2.99Å; L36-T40 WeakPolarHBondContact CA-OG1 3.37Å; L36-T40 WeakPolarHBondContact CD2-OG1 3.36Å; L36-A41 HydrophobicContact CB-CB 4.27Å
37T62.3Low68.3Low80 Ų80100.8 Ų100.849%0.49155%0.547SS..  trans-55.4140.3166.653.50000106.2P35 E39 T40 A41P35-T37 PolarHBondContact O-N 3.23Å; T37-E39 CarbonylContact O-C 3.55Å; T37-E39 PolarHBondContact O-N 2.96Å; T37-T40 PolarHBondContact N-OG1 3.34Å; T37-T40 VanDerWaalsContact N-OG1 3.08Å; T37-T40 WeakPolarHBondContact O-CA 3.45Å; T37-T40 PolarHBondContact O-N 3.24Å; T37-T40 PolarHBondContact O-OG1 3.01Å; T37-T40 VanDerWaalsContact OG1-CG2 3.3Å; T37-T40 WeakPolarHBondContact OG1-CG2 3.15Å; T37-T40 PolarHBondContact OG1-OG1 3.44Å; T37-A41 PolarHBondContact O-N 3.1Å
38P68.4Low70.5Confident96 Ų96102.9 Ų102.962%0.62355%0.549SS*.Hα-helixtrans-54.1-24.4-174.514.8-28.1000113.4R42P38-R42 VanDerWaalsContact O-CG 3.32Å; P38-R42 WeakPolarHBondContact O-CG 3.39Å; P38-R42 PolarHBondContact O-N 3.35Å
39E65.4Low72.6Confident116 Ų116105 Ų10554%0.54255%0.548SS..Hα-helixtrans-64.8-47.1169.1-73.1-66.6121.100113.2T37 A41 R42 D43T37-E39 CarbonylContact O-C 3.55Å; T37-E39 PolarHBondContact O-N 2.96Å; E39-A41 PolarHBondContact O-N 3.4Å; E39-R42 PolarHBondContact O-N 3.48Å; E39-R42 IonicContact OE1-NH1 3.28Å; E39-R42 PolarHBondContact OE1-NH1 3.44Å; E39-D43 PolarHBondContact O-N 3.32Å
40T75.9Confident74.9Confident56 Ų56107.8 Ų107.834%0.34454%0.544SS..Hα-helixtrans-66.9-33.5177.857.60000113.6L36 T37 D43 Q44L36-T40 WeakPolarHBondContact CA-OG1 3.37Å; L36-T40 WeakPolarHBondContact CD2-OG1 3.36Å; T37-T40 PolarHBondContact N-OG1 3.34Å; T37-T40 VanDerWaalsContact N-OG1 3.08Å; T37-T40 WeakPolarHBondContact O-CA 3.45Å; T37-T40 PolarHBondContact O-N 3.24Å; T37-T40 PolarHBondContact O-OG1 3.01Å; T37-T40 VanDerWaalsContact OG1-CG2 3.3Å; T37-T40 WeakPolarHBondContact OG1-CG2 3.15Å; T37-T40 PolarHBondContact OG1-OG1 3.44Å; T40-D43 PolarHBondContact O-N 2.92Å; T40-Q44 WeakPolarHBondContact O-CG 3.5Å; T40-Q44 PolarHBondContact O-N 2.86Å
41A80.7Confident77.2Confident42 Ų42109 Ų10935%0.34754%0.541SS..Hα-helixtrans-66.4-40.6173.900000111.8L36 T37 E39 D43 Q44 E45L36-A41 HydrophobicContact CB-CB 4.27Å; T37-A41 PolarHBondContact O-N 3.1Å; E39-A41 PolarHBondContact O-N 3.4Å; A41-D43 VanDerWaalsContact C-N 3.32Å; A41-D43 PolarHBondContact O-N 2.96Å; A41-Q44 PolarHBondContact O-N 2.97Å; A41-E45 WeakPolarHBondContact O-CB 3.29Å; A41-E45 PolarHBondContact O-N 3.45Å
42R84.7Confident79.2Confident158 Ų158107.8 Ų107.860%0.59653%0.534SS*.Hα-helixtrans-64.2-37.2173.6-74.1173176.8167.6-2.3112.1P38 E39 R46P38-R42 VanDerWaalsContact O-CG 3.32Å; P38-R42 WeakPolarHBondContact O-CG 3.39Å; P38-R42 PolarHBondContact O-N 3.35Å; E39-R42 PolarHBondContact O-N 3.48Å; E39-R42 IonicContact OE1-NH1 3.28Å; E39-R42 PolarHBondContact OE1-NH1 3.44Å; R42-R46 VanDerWaalsContact O-CB 3.28Å; R42-R46 WeakPolarHBondContact O-CB 3.08Å; R42-R46 PolarHBondContact O-N 2.97Å
43D90.1Very high81.4Confident76 Ų76106.8 Ų106.841%0.40653%0.526SS..Hα-helixtrans-70.1-37.9176-78.6-27.2000112.8E39 T40 A41 R46 R47E39-D43 PolarHBondContact O-N 3.32Å; T40-D43 PolarHBondContact O-N 2.92Å; A41-D43 VanDerWaalsContact C-N 3.32Å; A41-D43 PolarHBondContact O-N 2.96Å; D43-R46 PolarHBondContact O-N 2.98Å; D43-R46 IonicContact OD1-CZ 3.71Å; D43-R46 IonicContact OD1-NH1 2.72Å; D43-R46 PolarHBondContact OD1-NH1 3.26Å; D43-R47 WeakPolarHBondContact O-CB 3.32Å; D43-R47 PolarHBondContact O-N 2.94Å
44Q91.1Very high83.6Confident103 Ų103104.8 Ų104.848%0.48152%0.516SS..Hα-helixtrans-62.8-46.1171.2-75.2-177.9-12.400111.6T40 A41 R46 R47 I48T40-Q44 WeakPolarHBondContact O-CG 3.5Å; T40-Q44 PolarHBondContact O-N 2.86Å; A41-Q44 PolarHBondContact O-N 2.97Å; Q44-R46 VanDerWaalsContact C-N 3.34Å; Q44-R46 PolarHBondContact O-N 3.33Å; Q44-R47 WeakPolarHBondContact O-CB 3.48Å; Q44-R47 PolarHBondContact O-N 2.99Å; Q44-R47 VanDerWaalsContact O-N 3.13Å; Q44-I48 WeakPolarHBondContact O-CG1 3.49Å; Q44-I48 PolarHBondContact O-N 3.19Å
45E94Very high85.5Confident82 Ų82102.7 Ų102.738%0.38351%0.511SS..Hα-helixtrans-60.3-43.8175.3177.760.8-158.900111.5A41 R47 I48 R49A41-E45 WeakPolarHBondContact O-CB 3.29Å; A41-E45 PolarHBondContact O-N 3.45Å; E45-R47 VanDerWaalsContact C-N 3.29Å; E45-R47 PolarHBondContact O-N 3.11Å; E45-I48 PolarHBondContact O-N 3.07Å; E45-R49 WeakPolarHBondContact O-CG 3.44Å; E45-R49 PolarHBondContact O-N 3.02Å; E45-R49 IonicContact OE1-CZ 3.22Å; E45-R49 VanDerWaalsContact OE1-CZ 3.22Å; E45-R49 IonicContact OE1-NE 2.75Å; E45-R49 PolarHBondContact OE1-NE 3.42Å; E45-R49 IonicContact OE1-NH2 2.82Å; E45-R49 PolarHBondContact OE1-NH2 2.97Å
46R95.9Very high87.7Confident127 Ų127102.1 Ų102.148%0.47950%0.502SS..Hα-helixtrans-61.7-38.5175.1-173.5-176.2-68147.8-8.4111.6R42 D43 Q44 R50R42-R46 VanDerWaalsContact O-CB 3.28Å; R42-R46 WeakPolarHBondContact O-CB 3.08Å; R42-R46 PolarHBondContact O-N 2.97Å; D43-R46 PolarHBondContact O-N 2.98Å; D43-R46 IonicContact OD1-CZ 3.71Å; D43-R46 IonicContact OD1-NH1 2.72Å; D43-R46 PolarHBondContact OD1-NH1 3.26Å; Q44-R46 VanDerWaalsContact C-N 3.34Å; Q44-R46 PolarHBondContact O-N 3.33Å; R46-R50 VanDerWaalsContact O-CG 3.31Å; R46-R50 WeakPolarHBondContact O-CG 3.32Å; R46-R50 PolarHBondContact O-N 3.32Å; R46-R50 VanDerWaalsContact O-N 3.14Å
47R96.4Very high89.7Confident166 Ų166101.5 Ų101.563%0.62650%0.496SS*.Hα-helixtrans-66.6-46.9175.6-178.3177.1179.1162.83.3111.5D43 Q44 E45 R49 R50 E51D43-R47 WeakPolarHBondContact O-CB 3.32Å; D43-R47 PolarHBondContact O-N 2.94Å; Q44-R47 WeakPolarHBondContact O-CB 3.48Å; Q44-R47 PolarHBondContact O-N 2.99Å; Q44-R47 VanDerWaalsContact O-N 3.13Å; E45-R47 VanDerWaalsContact C-N 3.29Å; E45-R47 PolarHBondContact O-N 3.11Å; R47-R49 VanDerWaalsContact C-N 3.33Å; R47-R49 PolarHBondContact O-N 2.84Å; R47-R50 WeakPolarHBondContact O-CB 3.39Å; R47-R50 PolarHBondContact O-N 3.28Å; R47-R50 VanDerWaalsContact O-N 3.15Å; R47-E51 HydrophobicContact CG-CG 4.48Å; R47-E51 WeakPolarHBondContact CG-OE1 3.46Å; R47-E51 IonicContact CZ-OE1 2.89Å; R47-E51 IonicContact NE-OE1 3.95Å; R47-E51 PolarHBondContact NE-OE1 3.3Å; R47-E51 IonicContact NH2-OE1 3.89Å; R47-E51 WeakPolarHBondContact O-CG 3.36Å; R47-E51 PolarHBondContact O-N 2.96Å
48I96.4Very high91.5Very high82 Ų82106.1 Ų106.142%0.42151%0.505SS..Hα-helixtrans-58.6-45.5177.1-68.5166.1000110.4Q44 E45 R50 E51 I52Q44-I48 WeakPolarHBondContact O-CG1 3.49Å; Q44-I48 PolarHBondContact O-N 3.19Å; E45-I48 PolarHBondContact O-N 3.07Å; I48-R50 VanDerWaalsContact C-N 3.33Å; I48-R50 PolarHBondContact O-N 2.86Å; I48-E51 PolarHBondContact O-N 2.93Å; I48-E51 VanDerWaalsContact O-N 3.15Å; I48-I52 HydrophobicContact CG2-CD1 3.79Å; I48-I52 HydrophobicContact CG2-CG1 4.38Å; I48-I52 WeakPolarHBondContact O-CG1 3.44Å; I48-I52 PolarHBondContact O-N 3.46Å
49R97.8Very high92.9Very high164 Ų164109.8 Ų109.862%0.61951%0.506SS*.Hα-helixtrans-59.3-42.2176.4-72.2176.6-172.8-115.9-6.9112.7E45 R47 A53E45-R49 WeakPolarHBondContact O-CG 3.44Å; E45-R49 PolarHBondContact O-N 3.02Å; E45-R49 IonicContact OE1-CZ 3.22Å; E45-R49 VanDerWaalsContact OE1-CZ 3.22Å; E45-R49 IonicContact OE1-NE 2.75Å; E45-R49 PolarHBondContact OE1-NE 3.42Å; E45-R49 IonicContact OE1-NH2 2.82Å; E45-R49 PolarHBondContact OE1-NH2 2.97Å; R47-R49 VanDerWaalsContact C-N 3.33Å; R47-R49 PolarHBondContact O-N 2.84Å; R49-A53 WeakPolarHBondContact O-CB 3.32Å; R49-A53 PolarHBondContact O-N 3.24Å
50R97.9Very high94.5Very high163 Ų163110.3 Ų110.362%0.61550%0.503SS*.Hα-helixtrans-65-41.2175.4-72.6172.4-178.5-177.21.1111.6R46 R47 I48 A53 N54R46-R50 VanDerWaalsContact O-CG 3.31Å; R46-R50 WeakPolarHBondContact O-CG 3.32Å; R46-R50 PolarHBondContact O-N 3.32Å; R46-R50 VanDerWaalsContact O-N 3.14Å; R47-R50 WeakPolarHBondContact O-CB 3.39Å; R47-R50 PolarHBondContact O-N 3.28Å; R47-R50 VanDerWaalsContact O-N 3.15Å; I48-R50 VanDerWaalsContact C-N 3.33Å; I48-R50 PolarHBondContact O-N 2.86Å; R50-A53 PolarHBondContact O-N 3.45Å; R50-N54 WeakPolarHBondContact O-CB 3.42Å; R50-N54 PolarHBondContact O-N 3.36Å; R50-N54 PolarHBondContact O-ND2 3.16Å
51E97.8Very high95.6Very high99 Ų99111.6 Ų111.646%0.46351%0.506SS..Hα-helixtrans-64.5-42.4177.9-73174.5-170.400111.7R47 I48 N54 S55R47-E51 HydrophobicContact CG-CG 4.48Å; R47-E51 WeakPolarHBondContact CG-OE1 3.46Å; R47-E51 IonicContact CZ-OE1 2.89Å; R47-E51 IonicContact NE-OE1 3.95Å; R47-E51 PolarHBondContact NE-OE1 3.3Å; R47-E51 IonicContact NH2-OE1 3.89Å; R47-E51 WeakPolarHBondContact O-CG 3.36Å; R47-E51 PolarHBondContact O-N 2.96Å; I48-E51 PolarHBondContact O-N 2.93Å; I48-E51 VanDerWaalsContact O-N 3.15Å; E51-N54 PolarHBondContact O-N 2.91Å; E51-S55 WeakPolarHBondContact O-CB 3.46Å; E51-S55 PolarHBondContact O-N 3.34Å
52I97.2Very high96.4Very high108 Ų108115.2 Ų115.255%0.55452%0.516SS*.Hα-helixtrans-62.4-46.6174.1-66.6168.3000110.7I48 N54 S55 N56I48-I52 HydrophobicContact CG2-CD1 3.79Å; I48-I52 HydrophobicContact CG2-CG1 4.38Å; I48-I52 WeakPolarHBondContact O-CG1 3.44Å; I48-I52 PolarHBondContact O-N 3.46Å; I52-N54 PolarHBondContact O-N 2.99Å; I52-S55 PolarHBondContact O-N 3.27Å; I52-N56 WeakPolarHBondContact O-CB 3.43Å; I52-N56 PolarHBondContact O-N 3.39Å
53A98.1Very high97.1Very high56 Ų56111.3 Ų111.346%0.46351%0.513SS..Hα-helixtrans-60.3-45.1177.800000111.9R49 R50 S55 N56 E57R49-A53 WeakPolarHBondContact O-CB 3.32Å; R49-A53 PolarHBondContact O-N 3.24Å; R50-A53 PolarHBondContact O-N 3.45Å; A53-S55 PolarHBondContact O-N 3.4Å; A53-N56 WeakPolarHBondContact O-CB 3.47Å; A53-N56 PolarHBondContact O-N 3.45Å; A53-E57 PolarHBondContact O-N 2.98Å
54N98.6Very high97.5Very high114 Ų114110.4 Ų110.461%0.6151%0.507SS*.Hα-helixtrans-63.7-40.9176.6-72.6-16000112.2R50 E51 I52 N56 E57 R58R50-N54 WeakPolarHBondContact O-CB 3.42Å; R50-N54 PolarHBondContact O-N 3.36Å; R50-N54 PolarHBondContact O-ND2 3.16Å; E51-N54 PolarHBondContact O-N 2.91Å; I52-N54 PolarHBondContact O-N 2.99Å; N54-N56 VanDerWaalsContact C-N 3.3Å; N54-N56 PolarHBondContact O-N 3.38Å; N54-E57 PolarHBondContact O-N 3.32Å; N54-R58 WeakPolarHBondContact O-CB 3.43Å; N54-R58 PolarHBondContact O-N 3.14Å
55S98.6Very high97.8Very high67 Ų67108.7 Ų108.747%0.46950%0.502SS..Hα-helixtrans-63-39.2175-176.80000111.5E51 I52 A53 R59E51-S55 WeakPolarHBondContact O-CB 3.46Å; E51-S55 PolarHBondContact O-N 3.34Å; I52-S55 PolarHBondContact O-N 3.27Å; A53-S55 PolarHBondContact O-N 3.4Å; S55-R59 PolarHBondContact O-N 3.04Å; S55-R59 VanDerWaalsContact O-N 3.17Å
56N98.6Very high98Very high100 Ų100107.4 Ų107.454%0.53551%0.505SS..Hα-helixtrans-65.8-47.2177.5-164.5-68.1000111.2I52 A53 N54 R58 R59 R60I52-N56 WeakPolarHBondContact O-CB 3.43Å; I52-N56 PolarHBondContact O-N 3.39Å; A53-N56 WeakPolarHBondContact O-CB 3.47Å; A53-N56 PolarHBondContact O-N 3.45Å; N54-N56 VanDerWaalsContact C-N 3.3Å; N54-N56 PolarHBondContact O-N 3.38Å; N56-R58 VanDerWaalsContact C-N 3.32Å; N56-R58 PolarHBondContact O-N 3.42Å; N56-R59 WeakPolarHBondContact O-CB 3.35Å; N56-R59 PolarHBondContact O-N 3.27Å; N56-R59 VanDerWaalsContact O-N 3.1Å; N56-R60 PolarHBondContact O-N 3.49Å
57E98.5Very high98.1Very high77 Ų77103.2 Ų103.236%0.3650%0.502SS..Hα-helixtrans-64.7-36.9179.1-17355.6-148.500112A53 N54 R59 R60 M61A53-E57 PolarHBondContact O-N 2.98Å; N54-E57 PolarHBondContact O-N 3.32Å; E57-R59 VanDerWaalsContact C-N 3.32Å; E57-R59 PolarHBondContact O-N 3.45Å; E57-R60 PolarHBondContact O-N 3.06Å; E57-R60 IonicContact OE1-NH1 3.81Å; E57-R60 PolarHBondContact OE1-NH1 2.78Å; E57-R60 IonicContact OE2-NH1 2.97Å; E57-M61 WeakPolarHBondContact O-CB 3.49Å; E57-M61 PolarHBondContact O-N 2.97Å
58R98.7Very high98.2Very high176 Ų17697.1 Ų97.166%0.66448%0.48SS*.Hα-helixtrans-59.1-44.8173.1-177.3-179.6-65.5-85.9-0.1111.4N54 N56 M61 Q62N54-R58 WeakPolarHBondContact O-CB 3.43Å; N54-R58 PolarHBondContact O-N 3.14Å; N56-R58 VanDerWaalsContact C-N 3.32Å; N56-R58 PolarHBondContact O-N 3.42Å; R58-M61 PolarHBondContact O-N 3.04Å; R58-Q62 WeakPolarHBondContact O-CB 3.38Å; R58-Q62 VanDerWaalsContact O-CG 3.3Å; R58-Q62 WeakPolarHBondContact O-CG 3.4Å; R58-Q62 PolarHBondContact O-N 3.49Å
59R98.7Very high98.2Very high173 Ų17398.9 Ų98.965%0.65349%0.486SS*.Hα-helixtrans-63-46177.8-173.9-174.1-63.9-175.7-0.2111S55 N56 E57 M61 Q62 S63S55-R59 PolarHBondContact O-N 3.04Å; S55-R59 VanDerWaalsContact O-N 3.17Å; N56-R59 WeakPolarHBondContact O-CB 3.35Å; N56-R59 PolarHBondContact O-N 3.27Å; N56-R59 VanDerWaalsContact O-N 3.1Å; E57-R59 VanDerWaalsContact C-N 3.32Å; E57-R59 PolarHBondContact O-N 3.45Å; R59-M61 VanDerWaalsContact C-N 3.33Å; R59-M61 PolarHBondContact O-N 3.47Å; R59-Q62 WeakPolarHBondContact O-CB 3.46Å; R59-Q62 PolarHBondContact O-N 3.4Å; R59-S63 PolarHBondContact O-N 2.98Å; R59-S63 PolarHBondContact O-OG 3.3Å
60R98.6Very high98.1Very high128 Ų12894.6 Ų94.648%0.48348%0.481SS..Hα-helixtrans-57.9-44.7175.1179.9-179.2172.3-88.3-3.9111.6N56 E57 Q62 S63 I64N56-R60 PolarHBondContact O-N 3.49Å; E57-R60 PolarHBondContact O-N 3.06Å; E57-R60 IonicContact OE1-NH1 3.81Å; E57-R60 PolarHBondContact OE1-NH1 2.78Å; E57-R60 IonicContact OE2-NH1 2.97Å; R60-Q62 VanDerWaalsContact C-N 3.35Å; R60-Q62 PolarHBondContact O-N 2.72Å; R60-S63 PolarHBondContact O-N 3.02Å; R60-S63 PolarHBondContact O-OG 3.41Å; R60-I64 HydrophobicContact CG-CD1 3.97Å; R60-I64 VanDerWaalsContact O-CG1 3.27Å; R60-I64 WeakPolarHBondContact O-CG1 3.32Å; R60-I64 PolarHBondContact O-N 2.94Å
61M98.6Very high98.1Very high82 Ų8289.1 Ų89.140%0.40446%0.464SS..Hα-helixtrans-63.7-41.3177.9-161.871.861.800111.6E57 R58 R59 I64 N65E57-M61 WeakPolarHBondContact O-CB 3.49Å; E57-M61 PolarHBondContact O-N 2.97Å; R58-M61 PolarHBondContact O-N 3.04Å; R59-M61 VanDerWaalsContact C-N 3.33Å; R59-M61 PolarHBondContact O-N 3.47Å; M61-I64 PolarHBondContact O-N 2.88Å; M61-N65 WeakPolarHBondContact O-CB 3.35Å; M61-N65 PolarHBondContact O-N 3.4Å; M61-N65 PolarHBondContact O-ND2 2.84Å
62Q98.4Very high98Very high119 Ų11986 Ų8656%0.55645%0.449SS*.Hα-helixtrans-63.2-44.8175.9-75.5172.4-16.800111.8R58 R59 R60 N65 A66R58-Q62 WeakPolarHBondContact O-CB 3.38Å; R58-Q62 VanDerWaalsContact O-CG 3.3Å; R58-Q62 WeakPolarHBondContact O-CG 3.4Å; R58-Q62 PolarHBondContact O-N 3.49Å; R59-Q62 WeakPolarHBondContact O-CB 3.46Å; R59-Q62 PolarHBondContact O-N 3.4Å; R60-Q62 VanDerWaalsContact C-N 3.35Å; R60-Q62 PolarHBondContact O-N 2.72Å; Q62-N65 PolarHBondContact O-N 3.38Å; Q62-A66 WeakPolarHBondContact O-CB 3.34Å; Q62-A66 PolarHBondContact O-N 3Å
63S98.6Very high97.9Very high76 Ų7685.9 Ų85.953%0.53145%0.453SS..Hα-helixtrans-65.2-40.8178.565.50000111.9R59 R60 A66 G67R59-S63 PolarHBondContact O-N 2.98Å; R59-S63 PolarHBondContact O-OG 3.3Å; R60-S63 PolarHBondContact O-N 3.02Å; R60-S63 PolarHBondContact O-OG 3.41Å; S63-A66 PolarHBondContact O-N 2.95Å; S63-G67 PolarHBondContact O-N 3.44Å
64I98.3Very high97.8Very high56 Ų5689.2 Ų89.229%0.28746%0.463SS..Hα-helixtrans-61.1-46.8174.4-69.5168.3000110.2R60 M61 A66 G67 F68R60-I64 HydrophobicContact CG-CD1 3.97Å; R60-I64 VanDerWaalsContact O-CG1 3.27Å; R60-I64 WeakPolarHBondContact O-CG1 3.32Å; R60-I64 PolarHBondContact O-N 2.94Å; M61-I64 PolarHBondContact O-N 2.88Å; I64-A66 VanDerWaalsContact C-N 3.33Å; I64-A66 PolarHBondContact O-N 3.34Å; I64-G67 PolarHBondContact O-N 3.26Å; I64-G67 VanDerWaalsContact O-N 3.16Å; I64-F68 HydrophobicContact CG2-CD2 3.82Å; I64-F68 HydrophobicContact CG2-CE2 3.77Å; I64-F68 WeakPolarHBondContact O-CD2 3.28Å; I64-F68 PolarHBondContact O-N 2.92Å
65N98Very high97.7Very high67 Ų6784.3 Ų84.336%0.35844%0.437SS..Hα-helixtrans-63.1-39.1179-70.5-19.2000112.2M61 Q62 G67 F68 Q69 K85M61-N65 WeakPolarHBondContact O-CB 3.35Å; M61-N65 PolarHBondContact O-N 3.4Å; M61-N65 PolarHBondContact O-ND2 2.84Å; Q62-N65 PolarHBondContact O-N 3.38Å; N65-G67 VanDerWaalsContact C-N 3.33Å; N65-F68 PolarHBondContact O-N 3.45Å; N65-Q69 WeakPolarHBondContact O-CG 3.47Å; N65-Q69 PolarHBondContact O-N 3.44Å; N65-Q69 VanDerWaalsContact O-N 3.08Å; N65-K85 WeakPolarHBondContact OD1-CE 3.36Å; N65-K85 PolarHBondContact OD1-NZ 3.44Å
66A98.2Very high97.5Very high55 Ų5585.1 Ų85.146%0.45544%0.44SS..Hα-helixtrans-62.6-40.2173.700000112Q62 S63 I64 Q69 S70Q62-A66 WeakPolarHBondContact O-CB 3.34Å; Q62-A66 PolarHBondContact O-N 3Å; S63-A66 PolarHBondContact O-N 2.95Å; I64-A66 VanDerWaalsContact C-N 3.33Å; I64-A66 PolarHBondContact O-N 3.34Å; A66-Q69 PolarHBondContact O-N 2.86Å; A66-S70 PolarHBondContact O-N 2.89Å; A66-S70 PolarHBondContact O-OG 3.3Å
67G98.3Very high97.1Very high40 Ų4082.9 Ų82.941%0.41243%0.426SS..Hα-helixtrans-59.8-45.2173.300000112.6S63 I64 N65 Q69 S70 L71S63-G67 PolarHBondContact O-N 3.44Å; I64-G67 PolarHBondContact O-N 3.26Å; I64-G67 VanDerWaalsContact O-N 3.16Å; N65-G67 VanDerWaalsContact C-N 3.33Å; G67-Q69 VanDerWaalsContact C-N 3.33Å; G67-Q69 PolarHBondContact O-N 3.02Å; G67-S70 PolarHBondContact O-N 2.83Å; G67-L71 WeakPolarHBondContact O-CB 3.49Å; G67-L71 PolarHBondContact O-N 3.41Å
68F97.9Very high96.5Very high37 Ų3782.6 Ų82.616%0.16243%0.433CS..Hα-helixtrans-60.6-40175.2-89.8-77.9000113I64 N65 L71 K72 K85 I88 L89I64-F68 HydrophobicContact CG2-CD2 3.82Å; I64-F68 HydrophobicContact CG2-CE2 3.77Å; I64-F68 WeakPolarHBondContact O-CD2 3.28Å; I64-F68 PolarHBondContact O-N 2.92Å; N65-F68 PolarHBondContact O-N 3.45Å; F68-L71 PolarHBondContact O-N 2.96Å; F68-K72 WeakPolarHBondContact O-CB 3.49Å; F68-K72 PolarHBondContact O-N 3.38Å; F68-K85 HydrophobicContact CD1-CB 4.16Å; F68-K85 HydrophobicContact CD1-CG 4Å; F68-K85 HydrophobicContact CD2-CD 4.13Å; F68-K85 HydrophobicContact CD2-CG 4.25Å; F68-K85 HydrophobicContact CE1-CB 3.67Å; F68-K85 HydrophobicContact CE1-CD 4.48Å; F68-K85 HydrophobicContact CE1-CG 3.92Å; F68-K85 WeakPolarHBondContact CE1-O 3.42Å; F68-K85 HydrophobicContact CE2-CD 3.9Å; F68-K85 HydrophobicContact CE2-CG 4.2Å; F68-K85 HydrophobicContact CG-CG 4.16Å; F68-K85 HydrophobicContact CZ-CB 3.88Å; F68-K85 HydrophobicContact CZ-CD 4.09Å; F68-K85 HydrophobicContact CZ-CG 4.04Å; F68-I88 HydrophobicContact CD1-CB 4.25Å; F68-I88 HydrophobicContact CD1-CD1 4.11Å; F68-I88 HydrophobicContact CD1-CG2 4.1Å; F68-L89 HydrophobicContact CE1-CD1 4.29Å; F68-L89 HydrophobicContact CE1-CD2 4Å; F68-L89 HydrophobicContact CE1-CG 3.88Å; F68-L89 HydrophobicContact CZ-CD1 4.2Å; F68-L89 HydrophobicContact CZ-CD2 4.28Å; F68-L89 HydrophobicContact CZ-CG 4.25Å
69Q96Very high95.5Very high120 Ų12082.1 Ų82.156%0.56144%0.443SS*.Hα-helixtrans-67.1-41176.7-64-64.321.200111.8N65 A66 G67 K72 T73N65-Q69 WeakPolarHBondContact O-CG 3.47Å; N65-Q69 PolarHBondContact O-N 3.44Å; N65-Q69 VanDerWaalsContact O-N 3.08Å; A66-Q69 PolarHBondContact O-N 2.86Å; G67-Q69 VanDerWaalsContact C-N 3.33Å; G67-Q69 PolarHBondContact O-N 3.02Å; Q69-K72 WeakPolarHBondContact O-CB 3.35Å; Q69-K72 PolarHBondContact O-N 3.28Å; Q69-T73 WeakPolarHBondContact O-CG2 3.5Å; Q69-T73 PolarHBondContact O-N 3.43Å
70S96.9Very high94.6Very high73 Ų7377.4 Ų77.451%0.5145%0.448SS..Hα-helixtrans-61.5-46.7175.7-53.60000110.8A66 G67 K72 T73A66-S70 PolarHBondContact O-N 2.89Å; A66-S70 PolarHBondContact O-OG 3.3Å; G67-S70 PolarHBondContact O-N 2.83Å; S70-K72 VanDerWaalsContact C-N 3.32Å; S70-K72 PolarHBondContact O-N 2.97Å; S70-T73 PolarHBondContact O-N 3.07Å; S70-T73 PolarHBondContact O-OG1 3.37Å
71L97.4Very high94.2Very high49 Ų4974.8 Ų74.826%0.25744%0.442SS..Hα-helixtrans-60.3-42.8178.5-176.856.5000111.9G67 F68 T73 L74 I75 I88 L89 T92G67-L71 WeakPolarHBondContact O-CB 3.49Å; G67-L71 PolarHBondContact O-N 3.41Å; F68-L71 PolarHBondContact O-N 2.96Å; L71-T73 VanDerWaalsContact C-N 3.26Å; L71-T73 PolarHBondContact O-N 3.44Å; L71-L74 PolarHBondContact O-N 3.3Å; L71-L74 VanDerWaalsContact O-N 3.08Å; L71-I75 HydrophobicContact CG-CD1 4.31Å; L71-I88 HydrophobicContact CB-CG2 4.24Å; L71-I88 HydrophobicContact CD2-CG2 3.8Å; L71-I88 HydrophobicContact CG-CG2 3.85Å; L71-L89 HydrophobicContact CD2-CD2 4.34Å; L71-T92 HydrophobicContact CD1-CG2 3.8Å; L71-T92 HydrophobicContact CD2-CG2 4.38Å; L71-T92 WeakPolarHBondContact CD2-OG1 3.3Å; L71-T92 HydrophobicContact CG-CG2 4.47Å
72K96.4Very high93.9Very high33 Ų3380.6 Ų80.614%0.14347%0.465CS..Hα-helixtrans-54.5-43.1177.3-169.4-172.9172.8-151.20111.9F68 Q69 S70 L74 I75 H77 E81 L83 I88F68-K72 WeakPolarHBondContact O-CB 3.49Å; F68-K72 PolarHBondContact O-N 3.38Å; Q69-K72 WeakPolarHBondContact O-CB 3.35Å; Q69-K72 PolarHBondContact O-N 3.28Å; S70-K72 VanDerWaalsContact C-N 3.32Å; S70-K72 PolarHBondContact O-N 2.97Å; K72-L74 PolarHBondContact O-N 2.8Å; K72-L74 VanDerWaalsContact O-N 3.16Å; K72-I75 PolarHBondContact O-N 3.42Å; K72-H77 PolarHBondContact O-CE1 3.34Å; K72-H77 PolarHBondContact O-ND1 2.91Å; K72-H77 VanDerWaalsContact O-ND1 3.07Å; K72-E81 VanDerWaalsContact CE-O 3.3Å; K72-E81 WeakPolarHBondContact CE-O 3.44Å; K72-E81 PolarHBondContact NZ-O 3.03Å; K72-L83 HydrophobicContact CG-CD1 4.19Å; K72-I88 HydrophobicContact CB-CD1 4.1Å; K72-I88 HydrophobicContact CB-CG1 4.39Å; K72-I88 HydrophobicContact CD-CD1 4.35Å; K72-I88 HydrophobicContact CG-CD1 4.28Å; K72-I88 HydrophobicContact CG-CG1 4.34Å
73T95Very high93.7Very high106 Ų10676.4 Ų76.465%0.6545%0.446SS*.Hα-helixtrans-63.7-18.6-179.664.60000115Q69 S70 L71Q69-T73 WeakPolarHBondContact O-CG2 3.5Å; Q69-T73 PolarHBondContact O-N 3.43Å; S70-T73 PolarHBondContact O-N 3.07Å; S70-T73 PolarHBondContact O-OG1 3.37Å; L71-T73 VanDerWaalsContact C-N 3.26Å; L71-T73 PolarHBondContact O-N 3.44Å
74L95.6Very high93.6Very high126 Ų12676.2 Ų76.266%0.6645%0.445SS*.Hα-helixtrans-92.6-13.1-177.9-62.3176.1000113.5L71 K72 Y95L71-L74 PolarHBondContact O-N 3.3Å; L71-L74 VanDerWaalsContact O-N 3.08Å; K72-L74 PolarHBondContact O-N 2.8Å; K72-L74 VanDerWaalsContact O-N 3.16Å; L74-Y95 WeakPolarHBondContact O-CE1 3.3Å
75I95.7Very high93.6Very high11 Ų1178.1 Ų78.16%0.05645%0.451CS..SBendtrans-96.6142.6-177.9-54.5162.2000108L71 K72 H77 I88 Q91 T92L71-I75 HydrophobicContact CG-CD1 4.31Å; K72-I75 PolarHBondContact O-N 3.42Å; I75-H77 PolarHBondContact O-N 3.37Å; I75-H77 VanDerWaalsContact O-N 3.1Å; I75-H77 PolarHBondContact O-ND1 3.46Å; I75-I88 HydrophobicContact CD1-CG2 3.95Å; I75-I88 WeakPolarHBondContact CD1-O 3.43Å; I75-Q91 HydrophobicContact CG2-CB 3.8Å; I75-T92 WeakPolarHBondContact CD1-OG1 3.41Å
76P94.6Very high93.6Very high84 Ų8478.2 Ų78.255%0.54546%0.461SS..  trans-59.1114.1170.6-21.933000111.3Y95P76-Y95 HydrophobicContact CG-CD2 3.82Å; P76-Y95 HydrophobicContact CG-CE1 4.36Å; P76-Y95 HydrophobicContact CG-CE2 3.54Å; P76-Y95 HydrophobicContact CG-CG 4.38Å
77H90.9Very high93.6Very high53 Ų5377 Ų7725%0.24545%0.451CS..  trans-153.8167.4174.466.5-70.9000109.7K72 I75 L83K72-H77 PolarHBondContact O-CE1 3.34Å; K72-H77 PolarHBondContact O-ND1 2.91Å; K72-H77 VanDerWaalsContact O-ND1 3.07Å; I75-H77 PolarHBondContact O-N 3.37Å; I75-H77 VanDerWaalsContact O-N 3.1Å; I75-H77 PolarHBondContact O-ND1 3.46Å; H77-L83 HydrophobicContact CB-CD1 4Å
78S86.6Confident93.6Very high70 Ų7075.3 Ų75.349%0.4943%0.433SS..  trans-83.7140.1178.254.70000112G80 E81S78-G80 PolarHBondContact O-N 3.31Å; S78-E81 PolarHBondContact N-OE2 2.85Å; S78-E81 WeakPolarHBondContact O-CB 3.44Å; S78-E81 PolarHBondContact O-N 2.92Å; S78-E81 WeakPolarHBondContact OG-CB 3.32Å; S78-E81 PolarHBondContact OG-OE2 3.09Å
79D76.8Confident93.6Very high166 Ų16678.1 Ų78.189%0.88845%0.449SS*.THydrogen-bonded Turntrans-59.9127.1178.7-84.2-30.1000110.7E81D79-E81 VanDerWaalsContact C-N 3.34Å
80G80.4Confident93.7Very high74 Ų7477.6 Ų77.676%0.76345%0.446SS*.THydrogen-bonded Turntrans85.9-3.3-176.600000115.3S78S78-G80 PolarHBondContact O-N 3.31Å
81E89.7Confident93.7Very high74 Ų7476.7 Ų76.735%0.34643%0.434SS..  trans-65.7135.7176.1-170.9171.7-176.300112K72 S78 D79 L83K72-E81 VanDerWaalsContact CE-O 3.3Å; K72-E81 WeakPolarHBondContact CE-O 3.44Å; K72-E81 PolarHBondContact NZ-O 3.03Å; S78-E81 PolarHBondContact N-OE2 2.85Å; S78-E81 WeakPolarHBondContact O-CB 3.44Å; S78-E81 PolarHBondContact O-N 2.92Å; S78-E81 WeakPolarHBondContact OG-CB 3.32Å; S78-E81 PolarHBondContact OG-OE2 3.09Å; D79-E81 VanDerWaalsContact C-N 3.34Å; E81-L83 HydrophobicContact CG-CD2 4.23Å; E81-L83 HydrophobicContact CG-CG 4.46Å; E81-L83 PolarHBondContact O-N 3.34Å
82K92.8Very high93.8Very high203 Ų20375.5 Ų75.588%0.88343%0.429SS*.  trans-93.8101.2178.4-70.4-174.8179.5177.60110.4
83L94.1Very high93.9Very high32 Ų3276.6 Ų76.617%0.16844%0.444CS..  trans-93.5137.4173.6-61.7176.7000111.1K72 H77 E81 A87 I88K72-L83 HydrophobicContact CG-CD1 4.19Å; H77-L83 HydrophobicContact CB-CD1 4Å; E81-L83 HydrophobicContact CG-CD2 4.23Å; E81-L83 HydrophobicContact CG-CG 4.46Å; E81-L83 PolarHBondContact O-N 3.34Å; L83-A87 HydrophobicContact CD2-CB 4.47Å; L83-I88 HydrophobicContact CB-CD1 4.29Å; L83-I88 HydrophobicContact CB-CG1 3.71Å; L83-I88 HydrophobicContact CD1-CG1 4.36Å
84S97.1Very high94Very high72 Ų7276.4 Ų76.450%0.50344%0.435SS..  trans-74.3161.4171.375.90000110.7A86 A87 I88S84-A86 VanDerWaalsContact C-N 3.26Å; S84-A86 PolarHBondContact O-N 3Å; S84-A87 PolarHBondContact O-N 2.99Å; S84-A87 VanDerWaalsContact O-N 3.15Å; S84-A87 WeakPolarHBondContact OG-CB 3.27Å; S84-A87 PolarHBondContact OG-N 3.37Å; S84-A87 VanDerWaalsContact OG-N 3.1Å; S84-I88 WeakPolarHBondContact O-CG1 3.22Å; S84-I88 PolarHBondContact O-N 2.94Å
85K97.5Very high94.1Very high95 Ų9574.5 Ų74.541%0.41342%0.42SS..Hα-helixtrans-56.9-41.4176.2-70.7-175.4176.6-1760112.2N65 F68 I88 L89N65-K85 WeakPolarHBondContact OD1-CE 3.36Å; N65-K85 PolarHBondContact OD1-NZ 3.44Å; F68-K85 HydrophobicContact CD1-CB 4.16Å; F68-K85 HydrophobicContact CD1-CG 4Å; F68-K85 HydrophobicContact CD2-CD 4.13Å; F68-K85 HydrophobicContact CD2-CG 4.25Å; F68-K85 HydrophobicContact CE1-CB 3.67Å; F68-K85 HydrophobicContact CE1-CD 4.48Å; F68-K85 HydrophobicContact CE1-CG 3.92Å; F68-K85 WeakPolarHBondContact CE1-O 3.42Å; F68-K85 HydrophobicContact CE2-CD 3.9Å; F68-K85 HydrophobicContact CE2-CG 4.2Å; F68-K85 HydrophobicContact CG-CG 4.16Å; F68-K85 HydrophobicContact CZ-CB 3.88Å; F68-K85 HydrophobicContact CZ-CD 4.09Å; F68-K85 HydrophobicContact CZ-CG 4.04Å; K85-I88 PolarHBondContact O-N 3.33Å; K85-L89 WeakPolarHBondContact O-CG 3.29Å; K85-L89 PolarHBondContact O-N 3.4Å; K85-L89 VanDerWaalsContact O-N 3.13Å
86A98.1Very high94.3Very high70 Ų7077.9 Ų77.958%0.57944%0.438SS*.Hα-helixtrans-65.7-42.7177.100000111.7S84 I88 L89 Q90S84-A86 VanDerWaalsContact C-N 3.26Å; S84-A86 PolarHBondContact O-N 3Å; A86-I88 PolarHBondContact O-N 2.97Å; A86-L89 PolarHBondContact O-N 3.18Å; A86-Q90 WeakPolarHBondContact O-CB 3.23Å; A86-Q90 PolarHBondContact O-N 3.19Å
87A97.6Very high94.5Very high28 Ų2879.6 Ų79.623%0.23144%0.437CS..Hα-helixtrans-63-42.117700000111.9L83 S84 L89 Q90 Q91L83-A87 HydrophobicContact CD2-CB 4.47Å; S84-A87 PolarHBondContact O-N 2.99Å; S84-A87 VanDerWaalsContact O-N 3.15Å; S84-A87 WeakPolarHBondContact OG-CB 3.27Å; S84-A87 PolarHBondContact OG-N 3.37Å; S84-A87 VanDerWaalsContact OG-N 3.1Å; A87-L89 VanDerWaalsContact C-N 3.34Å; A87-L89 PolarHBondContact O-N 3.07Å; A87-Q90 PolarHBondContact O-N 2.86Å; A87-Q91 WeakPolarHBondContact O-CB 3.35Å; A87-Q91 WeakPolarHBondContact O-CG 3.4Å; A87-Q91 PolarHBondContact O-N 3.22Å
88I97.8Very high94.8Very high6 Ų680.6 Ų80.63%0.03145%0.446CS..Hα-helixtrans-58.3-47.8175.3-66.6166.5000110.1F68 L71 K72 I75 L83 S84 K85 A86 T92F68-I88 HydrophobicContact CD1-CB 4.25Å; F68-I88 HydrophobicContact CD1-CD1 4.11Å; F68-I88 HydrophobicContact CD1-CG2 4.1Å; L71-I88 HydrophobicContact CB-CG2 4.24Å; L71-I88 HydrophobicContact CD2-CG2 3.8Å; L71-I88 HydrophobicContact CG-CG2 3.85Å; K72-I88 HydrophobicContact CB-CD1 4.1Å; K72-I88 HydrophobicContact CB-CG1 4.39Å; K72-I88 HydrophobicContact CD-CD1 4.35Å; K72-I88 HydrophobicContact CG-CD1 4.28Å; K72-I88 HydrophobicContact CG-CG1 4.34Å; I75-I88 HydrophobicContact CD1-CG2 3.95Å; I75-I88 WeakPolarHBondContact CD1-O 3.43Å; L83-I88 HydrophobicContact CB-CD1 4.29Å; L83-I88 HydrophobicContact CB-CG1 3.71Å; L83-I88 HydrophobicContact CD1-CG1 4.36Å; S84-I88 WeakPolarHBondContact O-CG1 3.22Å; S84-I88 PolarHBondContact O-N 2.94Å; K85-I88 PolarHBondContact O-N 3.33Å; A86-I88 PolarHBondContact O-N 2.97Å; I88-T92 WeakPolarHBondContact O-CB 3.29Å; I88-T92 PolarHBondContact O-N 2.72Å; I88-T92 PolarHBondContact O-OG1 2.82Å
89L98.5Very high95.4Very high96 Ų9680.8 Ų80.850%0.50344%0.442SS..Hα-helixtrans-63.7-43.7179.1-66174.5000112.2F68 L71 K85 A86 A87 T92 A93F68-L89 HydrophobicContact CE1-CD1 4.29Å; F68-L89 HydrophobicContact CE1-CD2 4Å; F68-L89 HydrophobicContact CE1-CG 3.88Å; F68-L89 HydrophobicContact CZ-CD1 4.2Å; F68-L89 HydrophobicContact CZ-CD2 4.28Å; F68-L89 HydrophobicContact CZ-CG 4.25Å; L71-L89 HydrophobicContact CD2-CD2 4.34Å; K85-L89 WeakPolarHBondContact O-CG 3.29Å; K85-L89 PolarHBondContact O-N 3.4Å; K85-L89 VanDerWaalsContact O-N 3.13Å; A86-L89 PolarHBondContact O-N 3.18Å; A87-L89 VanDerWaalsContact C-N 3.34Å; A87-L89 PolarHBondContact O-N 3.07Å; L89-T92 WeakPolarHBondContact O-CB 3.32Å; L89-T92 PolarHBondContact O-N 3.19Å; L89-A93 PolarHBondContact O-N 3.42Å
90Q98Very high96.4Very high109 Ų10978.2 Ų78.251%0.50942%0.424SS..Hα-helixtrans-63.7-51-179.7-174.460.936.200111.4A86 A87 T92 A93 E94A86-Q90 WeakPolarHBondContact O-CB 3.23Å; A86-Q90 PolarHBondContact O-N 3.19Å; A87-Q90 PolarHBondContact O-N 2.86Å; Q90-T92 VanDerWaalsContact C-N 3.27Å; Q90-T92 PolarHBondContact O-N 3.47Å; Q90-A93 PolarHBondContact O-N 2.94Å; Q90-A93 VanDerWaalsContact O-N 3.16Å; Q90-E94 WeakPolarHBondContact CG-OE1 3.36Å; Q90-E94 PolarHBondContact NE2-OE1 3.38Å; Q90-E94 WeakPolarHBondContact O-CG 3.5Å; Q90-E94 PolarHBondContact O-N 3.39Å
91Q97.4Very high97.2Very high54 Ų5479.6 Ų79.625%0.25241%0.411SS..Hα-helixtrans-63.9-34.3177.8-68.2-179.212.500111.8I75 A87 Y95I75-Q91 HydrophobicContact CG2-CB 3.8Å; A87-Q91 WeakPolarHBondContact O-CB 3.35Å; A87-Q91 WeakPolarHBondContact O-CG 3.4Å; A87-Q91 PolarHBondContact O-N 3.22Å; Q91-Y95 WeakPolarHBondContact O-CB 3.3Å; Q91-Y95 PolarHBondContact O-N 3.16Å
92T98.3Very high97.6Very high23 Ų2381 Ų8114%0.14142%0.417CS..Hα-helixtrans-59.3-49.8173-57.40000110.6L71 I75 I88 L89 Q90 Y95 I96L71-T92 HydrophobicContact CD1-CG2 3.8Å; L71-T92 HydrophobicContact CD2-CG2 4.38Å; L71-T92 WeakPolarHBondContact CD2-OG1 3.3Å; L71-T92 HydrophobicContact CG-CG2 4.47Å; I75-T92 WeakPolarHBondContact CD1-OG1 3.41Å; I88-T92 WeakPolarHBondContact O-CB 3.29Å; I88-T92 PolarHBondContact O-N 2.72Å; I88-T92 PolarHBondContact O-OG1 2.82Å; L89-T92 WeakPolarHBondContact O-CB 3.32Å; L89-T92 PolarHBondContact O-N 3.19Å; Q90-T92 VanDerWaalsContact C-N 3.27Å; Q90-T92 PolarHBondContact O-N 3.47Å; T92-Y95 PolarHBondContact O-N 3.17Å; T92-I96 HydrophobicContact CG2-CD1 3.83Å; T92-I96 HydrophobicContact CG2-CG1 4.42Å; T92-I96 VanDerWaalsContact O-CG1 3.3Å; T92-I96 WeakPolarHBondContact O-CG1 3.46Å; T92-I96 PolarHBondContact O-N 2.93Å
93A98.4Very high97.9Very high56 Ų5678.1 Ų78.146%0.46341%0.405SS..Hα-helixtrans-63.4-44.3-177.700000111.5L89 Q90 I96 F97L89-A93 PolarHBondContact O-N 3.42Å; Q90-A93 PolarHBondContact O-N 2.94Å; Q90-A93 VanDerWaalsContact O-N 3.16Å; A93-I96 PolarHBondContact O-N 3.37Å; A93-F97 WeakPolarHBondContact O-CB 3.34Å; A93-F97 PolarHBondContact O-N 2.89Å
94E98Very high98.1Very high102 Ų10280.1 Ų80.148%0.47742%0.419SS..Hα-helixtrans-63-40.8175.7-72.8171.1-163.100112.4Q90 F97 T98Q90-E94 WeakPolarHBondContact CG-OE1 3.36Å; Q90-E94 PolarHBondContact NE2-OE1 3.38Å; Q90-E94 WeakPolarHBondContact O-CG 3.5Å; Q90-E94 PolarHBondContact O-N 3.39Å; E94-F97 PolarHBondContact O-N 2.7Å; E94-T98 PolarHBondContact O-N 3.44Å; E94-T98 PolarHBondContact O-OG1 2.89Å
95Y98.4Very high98.1Very high86 Ų8684.6 Ų84.634%0.33742%0.424SS..Hα-helixtrans-67.4-43.2178.8-174.6-128.6000111.8L74 P76 Q91 T92 F97 T98 L99L74-Y95 WeakPolarHBondContact O-CE1 3.3Å; P76-Y95 HydrophobicContact CG-CD2 3.82Å; P76-Y95 HydrophobicContact CG-CE1 4.36Å; P76-Y95 HydrophobicContact CG-CE2 3.54Å; P76-Y95 HydrophobicContact CG-CG 4.38Å; Q91-Y95 WeakPolarHBondContact O-CB 3.3Å; Q91-Y95 PolarHBondContact O-N 3.16Å; T92-Y95 PolarHBondContact O-N 3.17Å; Y95-F97 VanDerWaalsContact C-N 3.33Å; Y95-F97 PolarHBondContact O-N 2.94Å; Y95-T98 PolarHBondContact O-N 3.39Å; Y95-L99 HydrophobicContact CD1-CD1 3.98Å; Y95-L99 HydrophobicContact CD2-CG 4.34Å; Y95-L99 HydrophobicContact CE1-CD1 3.63Å; Y95-L99 HydrophobicContact CE1-CG 4.32Å; Y95-L99 HydrophobicContact CE2-CD1 4.23Å; Y95-L99 HydrophobicContact CE2-CD2 4.13Å; Y95-L99 HydrophobicContact CE2-CG 4.01Å; Y95-L99 HydrophobicContact CG-CD1 4.43Å; Y95-L99 WeakPolarHBondContact O-CG 3.35Å; Y95-L99 PolarHBondContact O-N 3.31Å
96I98.4Very high98.2Very high83 Ų8384 Ų8443%0.42643%0.426SS..Hα-helixtrans-57-48.7172.3-70.1169000110.2T92 A93 T98 L99 E100T92-I96 HydrophobicContact CG2-CD1 3.83Å; T92-I96 HydrophobicContact CG2-CG1 4.42Å; T92-I96 VanDerWaalsContact O-CG1 3.3Å; T92-I96 WeakPolarHBondContact O-CG1 3.46Å; T92-I96 PolarHBondContact O-N 2.93Å; A93-I96 PolarHBondContact O-N 3.37Å; I96-T98 VanDerWaalsContact C-N 3.27Å; I96-T98 PolarHBondContact O-N 3.49Å; I96-L99 PolarHBondContact O-N 3.48Å; I96-E100 HydrophobicContact CG2-CG 4.34Å; I96-E100 WeakPolarHBondContact O-CG 3.39Å; I96-E100 PolarHBondContact O-N 2.85Å
97F98.6Very high98.2Very high120 Ų12085.3 Ų85.353%0.52642%0.422SS..Hα-helixtrans-61-36.4179.3179-110.6000112.8A93 E94 Y95 Q101A93-F97 WeakPolarHBondContact O-CB 3.34Å; A93-F97 PolarHBondContact O-N 2.89Å; E94-F97 PolarHBondContact O-N 2.7Å; Y95-F97 VanDerWaalsContact C-N 3.33Å; Y95-F97 PolarHBondContact O-N 2.94Å; F97-Q101 HydrophobicContact CE1-CG 4.45Å; F97-Q101 HydrophobicContact CE2-CG 4.39Å; F97-Q101 HydrophobicContact CZ-CG 4.22Å; F97-Q101 WeakPolarHBondContact O-CG 3.26Å; F97-Q101 PolarHBondContact O-N 3.26Å; F97-Q101 VanDerWaalsContact O-N 3.14Å; F97-Q101 PolarHBondContact O-NE2 2.91Å; F97-Q101 VanDerWaalsContact O-NE2 3.11Å
98T98.1Very high98.2Very high73 Ų7390.1 Ų90.145%0.44844%0.44SS..Hα-helixtrans-68.2-46175.3-60.60000111.2E94 Y95 I96 E100 Q101 E102E94-T98 PolarHBondContact O-N 3.44Å; E94-T98 PolarHBondContact O-OG1 2.89Å; Y95-T98 PolarHBondContact O-N 3.39Å; I96-T98 VanDerWaalsContact C-N 3.27Å; I96-T98 PolarHBondContact O-N 3.49Å; T98-E100 VanDerWaalsContact C-N 3.29Å; T98-E100 PolarHBondContact O-N 3.22Å; T98-Q101 PolarHBondContact O-N 3.01Å; T98-E102 WeakPolarHBondContact O-CB 3.39Å; T98-E102 PolarHBondContact O-N 2.65Å
99L98.4Very high98.2Very high74 Ų7494 Ų9439%0.38746%0.458SS..Hα-helixtrans-60.4-38.3176.4-72.1174.5000112.1Y95 I96 E102 K103Y95-L99 HydrophobicContact CD1-CD1 3.98Å; Y95-L99 HydrophobicContact CD2-CG 4.34Å; Y95-L99 HydrophobicContact CE1-CD1 3.63Å; Y95-L99 HydrophobicContact CE1-CG 4.32Å; Y95-L99 HydrophobicContact CE2-CD1 4.23Å; Y95-L99 HydrophobicContact CE2-CD2 4.13Å; Y95-L99 HydrophobicContact CE2-CG 4.01Å; Y95-L99 HydrophobicContact CG-CD1 4.43Å; Y95-L99 WeakPolarHBondContact O-CG 3.35Å; Y95-L99 PolarHBondContact O-N 3.31Å; I96-L99 PolarHBondContact O-N 3.48Å; L99-E102 PolarHBondContact O-N 2.88Å; L99-K103 VanDerWaalsContact O-CB 3.3Å; L99-K103 WeakPolarHBondContact O-CB 3.45Å; L99-K103 PolarHBondContact O-N 3.34Å
100E98.4Very high98.1Very high113 Ų11393.4 Ų93.453%0.52846%0.455SS..Hα-helixtrans-66.2-42.4177-74.3178.6158.200112.7I96 T98 T104I96-E100 HydrophobicContact CG2-CG 4.34Å; I96-E100 WeakPolarHBondContact O-CG 3.39Å; I96-E100 PolarHBondContact O-N 2.85Å; T98-E100 VanDerWaalsContact C-N 3.29Å; T98-E100 PolarHBondContact O-N 3.22Å; E100-T104 PolarHBondContact O-N 2.9Å; E100-T104 VanDerWaalsContact O-N 3.1Å; E100-T104 PolarHBondContact O-OG1 3.42Å
101Q98.3Very high98Very high103 Ų10391.7 Ų91.748%0.48146%0.455SS..Hα-helixtrans-64.7-43.9174.3-73.5174.397.200111.4F97 T98 T104 R105F97-Q101 HydrophobicContact CE1-CG 4.45Å; F97-Q101 HydrophobicContact CE2-CG 4.39Å; F97-Q101 HydrophobicContact CZ-CG 4.22Å; F97-Q101 WeakPolarHBondContact O-CG 3.26Å; F97-Q101 PolarHBondContact O-N 3.26Å; F97-Q101 VanDerWaalsContact O-N 3.14Å; F97-Q101 PolarHBondContact O-NE2 2.91Å; F97-Q101 VanDerWaalsContact O-NE2 3.11Å; T98-Q101 PolarHBondContact O-N 3.01Å; Q101-T104 PolarHBondContact O-N 3.5Å; Q101-R105 PolarHBondContact O-N 3.45Å
102E98Very high98Very high103 Ų10394.7 Ų94.748%0.48147%0.469SS..Hα-helixtrans-63.4-43.9178.1-174.1172.2-157.900111.5T98 L99 T104 R105 L106T98-E102 WeakPolarHBondContact O-CB 3.39Å; T98-E102 PolarHBondContact O-N 2.65Å; L99-E102 PolarHBondContact O-N 2.88Å; E102-T104 VanDerWaalsContact C-N 3.3Å; E102-T104 PolarHBondContact O-N 3.39Å; E102-R105 WeakPolarHBondContact O-CB 3.37Å; E102-R105 PolarHBondContact O-N 3.19Å; E102-L106 HydrophobicContact CG-CD1 4.02Å; E102-L106 HydrophobicContact CG-CG 4.31Å; E102-L106 WeakPolarHBondContact O-CB 3.12Å; E102-L106 WeakPolarHBondContact O-CG 3.48Å; E102-L106 PolarHBondContact O-N 2.9Å
103K98.2Very high97.9Very high142 Ų14298.1 Ų98.162%0.61749%0.486SS*.Hα-helixtrans-54.4-47.1173177.5-177.2177.4179.80111.4L99 L106 L107L99-K103 VanDerWaalsContact O-CB 3.3Å; L99-K103 WeakPolarHBondContact O-CB 3.45Å; L99-K103 PolarHBondContact O-N 3.34Å; K103-L106 PolarHBondContact O-N 3.47Å; K103-L107 HydrophobicContact CG-CD1 4.15Å; K103-L107 WeakPolarHBondContact O-CB 3.42Å; K103-L107 VanDerWaalsContact O-CG 3.29Å; K103-L107 WeakPolarHBondContact O-CG 3.3Å; K103-L107 PolarHBondContact O-N 2.98Å
104T98Very high97.7Very high75 Ų75102.7 Ų102.746%0.4650%0.496SS..Hα-helixtrans-63.3-44.2179.6-580000111.3E100 Q101 E102 L107 Q108E100-T104 PolarHBondContact O-N 2.9Å; E100-T104 VanDerWaalsContact O-N 3.1Å; E100-T104 PolarHBondContact O-OG1 3.42Å; Q101-T104 PolarHBondContact O-N 3.5Å; E102-T104 VanDerWaalsContact C-N 3.3Å; E102-T104 PolarHBondContact O-N 3.39Å; T104-L107 PolarHBondContact O-N 3.5Å; T104-Q108 WeakPolarHBondContact O-CG 3.47Å; T104-Q108 PolarHBondContact O-N 3.29Å
105R98.4Very high97.5Very high165 Ų165105.5 Ų105.562%0.62350%0.502SS*.Hα-helixtrans-60.9-47176-177.8-176.8174.9-172.4-0.7111.8Q101 E102 L107 Q108 Q109Q101-R105 PolarHBondContact O-N 3.45Å; E102-R105 WeakPolarHBondContact O-CB 3.37Å; E102-R105 PolarHBondContact O-N 3.19Å; R105-L107 VanDerWaalsContact C-N 3.33Å; R105-L107 PolarHBondContact O-N 2.87Å; R105-Q108 WeakPolarHBondContact O-CB 3.41Å; R105-Q108 PolarHBondContact O-N 3.15Å; R105-Q109 WeakPolarHBondContact O-CG 3.49Å; R105-Q109 PolarHBondContact O-N 3.38Å
106L98.3Very high97.3Very high84 Ų84104.5 Ų104.544%0.4450%0.502SS..Hα-helixtrans-63.4-38178.2-73.1173.2000111.8E102 K103 Q109 N110E102-L106 HydrophobicContact CG-CD1 4.02Å; E102-L106 HydrophobicContact CG-CG 4.31Å; E102-L106 WeakPolarHBondContact O-CB 3.12Å; E102-L106 WeakPolarHBondContact O-CG 3.48Å; E102-L106 PolarHBondContact O-N 2.9Å; K103-L106 PolarHBondContact O-N 3.47Å; L106-Q109 PolarHBondContact O-N 3.21Å; L106-N110 WeakPolarHBondContact O-CB 3.37Å; L106-N110 PolarHBondContact O-N 2.92Å; L106-N110 PolarHBondContact O-ND2 3.21Å
107L97.9Very high96.9Very high96 Ų96105.4 Ų105.450%0.50351%0.506SS..Hα-helixtrans-63.7-40.7174.2-76.1171.3000112.3K103 T104 R105 N110 S111K103-L107 HydrophobicContact CG-CD1 4.15Å; K103-L107 WeakPolarHBondContact O-CB 3.42Å; K103-L107 VanDerWaalsContact O-CG 3.29Å; K103-L107 WeakPolarHBondContact O-CG 3.3Å; K103-L107 PolarHBondContact O-N 2.98Å; T104-L107 PolarHBondContact O-N 3.5Å; R105-L107 VanDerWaalsContact C-N 3.33Å; R105-L107 PolarHBondContact O-N 2.87Å; L107-N110 PolarHBondContact O-N 3.1Å; L107-S111 WeakPolarHBondContact O-CB 3.4Å; L107-S111 PolarHBondContact O-N 2.8Å; L107-S111 PolarHBondContact O-OG 3.5Å
108Q97.3Very high96.5Very high129 Ų129105.6 Ų105.660%0.60351%0.509SS*.Hα-helixtrans-63.8-46174.7-70.7172.1-0.500111.2T104 R105 N110 S111 Q112T104-Q108 WeakPolarHBondContact O-CG 3.47Å; T104-Q108 PolarHBondContact O-N 3.29Å; R105-Q108 WeakPolarHBondContact O-CB 3.41Å; R105-Q108 PolarHBondContact O-N 3.15Å; Q108-N110 PolarHBondContact O-N 3.26Å; Q108-S111 PolarHBondContact O-N 3.36Å; Q108-Q112 PolarHBondContact O-N 2.74Å
109Q97.8Very high96Very high87 Ų87108.6 Ų108.641%0.40752%0.518SS..Hα-helixtrans-60.8-45.5176.2-70.7-179.2-62.500111.8R105 L106 S111 Q112 L113R105-Q109 WeakPolarHBondContact O-CG 3.49Å; R105-Q109 PolarHBondContact O-N 3.38Å; L106-Q109 PolarHBondContact O-N 3.21Å; Q109-S111 VanDerWaalsContact C-N 3.32Å; Q109-S111 PolarHBondContact O-N 3.4Å; Q109-Q112 WeakPolarHBondContact O-CB 3.5Å; Q109-Q112 PolarHBondContact O-N 3.42Å; Q109-L113 WeakPolarHBondContact O-CG 3.5Å; Q109-L113 PolarHBondContact O-N 3.45Å
110N97.4Very high95.4Very high85 Ų85111.8 Ų111.846%0.45554%0.535SS..Hα-helixtrans-61.6-40.2176-86.4-37.3000112.3L106 L107 Q108 Q112 L113 K114L106-N110 WeakPolarHBondContact O-CB 3.37Å; L106-N110 PolarHBondContact O-N 2.92Å; L106-N110 PolarHBondContact O-ND2 3.21Å; L107-N110 PolarHBondContact O-N 3.1Å; Q108-N110 PolarHBondContact O-N 3.26Å; N110-Q112 VanDerWaalsContact C-N 3.33Å; N110-Q112 PolarHBondContact O-N 3.28Å; N110-L113 PolarHBondContact O-N 3.26Å; N110-K114 WeakPolarHBondContact O-CB 3.49Å; N110-K114 VanDerWaalsContact O-CG 3.26Å; N110-K114 WeakPolarHBondContact O-CG 3.46Å; N110-K114 PolarHBondContact O-N 2.97Å
111S96.5Very high94.6Very high72 Ų72110.9 Ų110.950%0.50354%0.541SS..Hα-helixtrans-64.3-39.7176.4-58.50000111.6L107 Q108 Q109 R115L107-S111 WeakPolarHBondContact O-CB 3.4Å; L107-S111 PolarHBondContact O-N 2.8Å; L107-S111 PolarHBondContact O-OG 3.5Å; Q108-S111 PolarHBondContact O-N 3.36Å; Q109-S111 VanDerWaalsContact C-N 3.32Å; Q109-S111 PolarHBondContact O-N 3.4Å; S111-R115 PolarHBondContact O-N 3.46Å; S111-R115 VanDerWaalsContact O-N 3.11Å
112Q96.9Very high92.6Very high118 Ų118108.9 Ų108.955%0.55155%0.547SS*.Hα-helixtrans-65.4-46.9174.5-178.5-177.3-13.900111.7Q108 Q109 N110 K114 R115 I116Q108-Q112 PolarHBondContact O-N 2.74Å; Q109-Q112 WeakPolarHBondContact O-CB 3.5Å; Q109-Q112 PolarHBondContact O-N 3.42Å; N110-Q112 VanDerWaalsContact C-N 3.33Å; N110-Q112 PolarHBondContact O-N 3.28Å; Q112-K114 VanDerWaalsContact C-N 3.34Å; Q112-K114 PolarHBondContact O-N 3.11Å; Q112-R115 WeakPolarHBondContact O-CB 3.4Å; Q112-R115 PolarHBondContact O-N 2.85Å; Q112-R115 VanDerWaalsContact O-N 3.15Å; Q112-I116 HydrophobicContact CG-CD1 4.1Å; Q112-I116 WeakPolarHBondContact O-CG1 3.29Å; Q112-I116 PolarHBondContact O-N 3.39Å
113L95.6Very high90.5Very high94 Ų94107.8 Ų107.849%0.49255%0.551SS.*Hα-helixtrans-61.4-42.5177.8-70.7172.9000111.4Q109 N110 R115 I116 I117Q109-L113 WeakPolarHBondContact O-CG 3.5Å; Q109-L113 PolarHBondContact O-N 3.45Å; N110-L113 PolarHBondContact O-N 3.26Å; L113-R115 VanDerWaalsContact C-N 3.3Å; L113-R115 PolarHBondContact O-N 2.88Å; L113-I116 PolarHBondContact O-N 3.15Å; L113-I117 VanDerWaalsContact O-CG1 3.29Å; L113-I117 WeakPolarHBondContact O-CG1 3.45Å; L113-I117 PolarHBondContact O-N 3.4Å
114K94.3Very high88Confident152 Ų152105.6 Ų105.666%0.66155%0.554SS**Hα-helixtrans-57.7-42.1173.4-76.7178179.6-1720112.2N110 Q112 I117 Q118N110-K114 WeakPolarHBondContact O-CB 3.49Å; N110-K114 VanDerWaalsContact O-CG 3.26Å; N110-K114 WeakPolarHBondContact O-CG 3.46Å; N110-K114 PolarHBondContact O-N 2.97Å; Q112-K114 VanDerWaalsContact C-N 3.34Å; Q112-K114 PolarHBondContact O-N 3.11Å; K114-I117 PolarHBondContact O-N 2.83Å; K114-Q118 WeakPolarHBondContact O-CB 3.36Å; K114-Q118 PolarHBondContact O-N 3.24Å
115R94.3Very high85.7Confident162 Ų162108.2 Ų108.261%0.61157%0.572SS**Hα-helixtrans-62.3-46.5175.2-171.9-174.3-61166.71.4111.5S111 Q112 L113 I117 Q118 E119S111-R115 PolarHBondContact O-N 3.46Å; S111-R115 VanDerWaalsContact O-N 3.11Å; Q112-R115 WeakPolarHBondContact O-CB 3.4Å; Q112-R115 PolarHBondContact O-N 2.85Å; Q112-R115 VanDerWaalsContact O-N 3.15Å; L113-R115 VanDerWaalsContact C-N 3.3Å; L113-R115 PolarHBondContact O-N 2.88Å; R115-I117 VanDerWaalsContact C-N 3.34Å; R115-I117 PolarHBondContact O-N 3.42Å; R115-Q118 WeakPolarHBondContact O-CB 3.3Å; R115-Q118 PolarHBondContact O-N 2.94Å; R115-E119 WeakPolarHBondContact CG-OE1 3.39Å; R115-E119 WeakPolarHBondContact O-CG 3.5Å; R115-E119 PolarHBondContact O-N 3.49Å
116I93.4Very high83.1Confident65 Ų65109.4 Ų109.433%0.33358%0.582SS.*Hα-helixtrans-61.1-43.9178.1-67166.6000110.7Q112 L113 Q118 E119 L120Q112-I116 HydrophobicContact CG-CD1 4.1Å; Q112-I116 WeakPolarHBondContact O-CG1 3.29Å; Q112-I116 PolarHBondContact O-N 3.39Å; L113-I116 PolarHBondContact O-N 3.15Å; I116-Q118 VanDerWaalsContact C-N 3.34Å; I116-Q118 PolarHBondContact O-N 3.5Å; I116-E119 PolarHBondContact O-N 2.84Å; I116-L120 HydrophobicContact CG2-CD1 3.71Å; I116-L120 HydrophobicContact CG2-CG 4.31Å; I116-L120 WeakPolarHBondContact O-CB 3.41Å; I116-L120 VanDerWaalsContact O-CG 3.27Å; I116-L120 WeakPolarHBondContact O-CG 3.3Å; I116-L120 PolarHBondContact O-N 2.96Å
117I91.1Very high80.6Confident102 Ų102116.8 Ų116.852%0.52360%0.604SS.*Hα-helixtrans-62.3-42.7176.7-68.8166.1000110.7L113 K114 R115 E119 L120 S121L113-I117 VanDerWaalsContact O-CG1 3.29Å; L113-I117 WeakPolarHBondContact O-CG1 3.45Å; L113-I117 PolarHBondContact O-N 3.4Å; K114-I117 PolarHBondContact O-N 2.83Å; R115-I117 VanDerWaalsContact C-N 3.34Å; R115-I117 PolarHBondContact O-N 3.42Å; I117-E119 VanDerWaalsContact C-N 3.35Å; I117-E119 PolarHBondContact O-N 3.21Å; I117-L120 PolarHBondContact O-N 2.94Å; I117-S121 WeakPolarHBondContact O-CB 3.15Å; I117-S121 PolarHBondContact O-N 3.28Å; I117-S121 PolarHBondContact O-OG 2.75Å
118Q89.3Confident78Confident123 Ų123124.1 Ų124.158%0.57563%0.625SS**Hα-helixtrans-63.5-39.9176.9-174.8171.829.600112.3K114 R115 I116K114-Q118 WeakPolarHBondContact O-CB 3.36Å; K114-Q118 PolarHBondContact O-N 3.24Å; R115-Q118 WeakPolarHBondContact O-CB 3.3Å; R115-Q118 PolarHBondContact O-N 2.94Å; I116-Q118 VanDerWaalsContact C-N 3.34Å; I116-Q118 PolarHBondContact O-N 3.5Å
119E87.9Confident75.6Confident137 Ų137129.9 Ų129.964%0.6464%0.641SS**Hα-helixtrans-65.5-41.7175.3-74.1173.5-168.900111.9R115 I116 I117R115-E119 WeakPolarHBondContact CG-OE1 3.39Å; R115-E119 WeakPolarHBondContact O-CG 3.5Å; R115-E119 PolarHBondContact O-N 3.49Å; I116-E119 PolarHBondContact O-N 2.84Å; I117-E119 VanDerWaalsContact C-N 3.35Å; I117-E119 PolarHBondContact O-N 3.21Å
120L86.5Confident73.1Confident141 Ų141130.5 Ų130.574%0.73866%0.661SS**Hα-helixtrans-75.8-30.3179.1-68.8171.8000113.5I116 I117 G122I116-L120 HydrophobicContact CG2-CD1 3.71Å; I116-L120 HydrophobicContact CG2-CG 4.31Å; I116-L120 WeakPolarHBondContact O-CB 3.41Å; I116-L120 VanDerWaalsContact O-CG 3.27Å; I116-L120 WeakPolarHBondContact O-CG 3.3Å; I116-L120 PolarHBondContact O-N 2.96Å; I117-L120 PolarHBondContact O-N 2.94Å; L120-G122 PolarHBondContact O-N 3.1Å
121S80.6Confident70.7Confident94 Ų94135.8 Ų135.866%0.65768%0.683SS**THydrogen-bonded Turntrans-77.47.2179.1-56.10000113.3I117 S123I117-S121 WeakPolarHBondContact O-CB 3.15Å; I117-S121 PolarHBondContact O-N 3.28Å; I117-S121 PolarHBondContact O-OG 2.75Å; S121-S123 PolarHBondContact O-N 3.02Å
122G57.7Low68.3Low60 Ų60141.4 Ų141.462%0.61970%0.701SS**THydrogen-bonded Turntrans83.210.6163.200000116.4L120 S124L120-G122 PolarHBondContact O-N 3.1Å; G122-S124 PolarHBondContact O-N 2.78Å
123S53.4Low66.3Low81 Ų81144.8 Ų144.857%0.56671%0.714SS**  trans-77.571.9168.6177.50000110.6S121 P125S121-S123 PolarHBondContact O-N 3.02Å; S123-P125 VanDerWaalsContact O-CD 3.29Å; S123-P125 WeakPolarHBondContact O-CD 3.45Å
124S45.1Very low64.6Low95 Ų95147.7 Ų147.766%0.66473%0.73SS**  trans-67.1119.5168.6-166.60000109.6G122 K126G122-S124 PolarHBondContact O-N 2.78Å; S124-K126 PolarHBondContact O-N 3.06Å
125P50.6Low62.8Low131 Ų131149.6 Ų149.685%0.85174%0.741SS**THydrogen-bonded Turntrans-69.925-175.1-20.233.2000116.3S123S123-P125 VanDerWaalsContact O-CD 3.29Å; S123-P125 WeakPolarHBondContact O-CD 3.45Å
126K42.3Very low60.7Low189 Ų189144.9 Ų144.982%0.82274%0.743SS**THydrogen-bonded Turntrans-125.310.8-163.6-119.8166.1-176.5172.50118S124S124-K126 PolarHBondContact O-N 3.06Å
127R46.1Very low58.3Low239 Ų239149.3 Ų149.390%0.90277%0.766SS**  trans-136.970.2170.2-72.5-175.574.2-167.62.7112.7
128R43.7Very low56.1Low251 Ų251148.4 Ų148.495%0.94778%0.782SS**  trans-141.861.6154.6-68.4-166.1-175.9176.21.7110.1
129R48.1Very low53.9Low250 Ų250146 Ų14694%0.94378%0.778SS**  trans-140.480155.9-84.3-153.1-174.9-175.13.7107.8
130A45.3Very low52.1Low99 Ų99145.6 Ų145.682%0.81879%0.788SS**SBendtrans-167.1120.6152.700000106
131E46.4Very low50.2Low197 Ų197143.3 Ų143.392%0.92178%0.776SS**  trans-31.1133.6179.1-64162.812600115.7
132E46.8Very low49.1Very low189 Ų189145.5 Ų145.588%0.88378%0.779SS**  -152.8156.2124.1-152.8169.9-178.700109.1
133K54Low49Very low190 Ų190149.2 Ų149.283%0.82678%0.784SS**  trans-79.5150.1-148.3-61.3174.6171.8-178.50113.5E135K133-E135 PolarHBondContact O-N 3.24Å
134D58.9Low49.1Very low154 Ų154151 Ų15182%0.82478%0.784SS**  trans43.275.8132.4-165.829.4000116.6
135E57.2Low49.8Very low193 Ų193152.6 Ų152.690%0.90278%0.781SS**  -136.1123.8129.5-73.6-152.3161.100108.2K133K133-E135 PolarHBondContact O-N 3.24Å
136G51.4Low50.5Low63 Ų63152 Ų15265%0.64977%0.766SS**  trans-62.7162.5179.800000113.2
137I42.9Very low52Low157 Ų157149.4 Ų149.481%0.80576%0.755SS**  trans74.562.4164.8-20.1-176.4000115.7S139I137-S139 VanDerWaalsContact C-N 3.28Å; I137-S139 PolarHBondContact O-N 3.44Å
138G43Very low53.4Low84 Ų84140.5 Ų140.587%0.86673%0.727SS**  trans-70.884.6154.700000110.7
139S44.8Very low55.2Low71 Ų71132 Ų13250%0.49770%0.699SS.*  trans-66.3146.9169.5-75.20000111.2I137 D141I137-S139 VanDerWaalsContact C-N 3.28Å; I137-S139 PolarHBondContact O-N 3.44Å; S139-D141 PolarHBondContact O-N 3.03Å
140P48.5Very low56.9Low130 Ų130124 Ų12484%0.84467%0.674SS**SBendtrans-68.731.7176-17.231.5000116
141D47.2Very low59Low92 Ų92123.8 Ų123.849%0.49266%0.659SS.*THydrogen-bonded Turntrans-95.7-0.2-157.2-131.215.6000115.7S139 L143 E144 E145S139-D141 PolarHBondContact O-N 3.03Å; D141-L143 PolarHBondContact O-N 2.92Å; D141-E144 PolarHBondContact O-N 3.05Å; D141-E144 VanDerWaalsContact O-N 3.07Å; D141-E144 WeakPolarHBondContact OD1-CB 3.47Å; D141-E144 WeakPolarHBondContact OD1-CG 3.42Å; D141-E145 PolarHBondContact O-N 2.87Å
142I58.1Low61.2Low140 Ų140120.7 Ų120.772%0.71864%0.639SS**Hα-helixtrans-63.5-31-175.1-49171.3000111.5E146I142-E146 PolarHBondContact O-N 2.96Å
143L54.7Low63.4Low138 Ų138117.7 Ų117.772%0.72362%0.619SS**Hα-helixtrans-75.5-32.6175.7-94.7155000113.1D141 K147D141-L143 PolarHBondContact O-N 2.92Å; L143-K147 WeakPolarHBondContact O-CB 3.47Å; L143-K147 PolarHBondContact O-N 3.01Å
144E55.2Low65.2Low120 Ų120113.7 Ų113.756%0.56160%0.604SS**Hα-helixtrans-72.8-40.4175.9-73-107.1148.900109.9D141 K147 T148D141-E144 PolarHBondContact O-N 3.05Å; D141-E144 VanDerWaalsContact O-N 3.07Å; D141-E144 WeakPolarHBondContact OD1-CB 3.47Å; D141-E144 WeakPolarHBondContact OD1-CG 3.42Å; E144-K147 PolarHBondContact O-N 3.07Å; E144-T148 VanDerWaalsContact O-CG2 3.3Å; E144-T148 WeakPolarHBondContact O-CG2 3.44Å; E144-T148 PolarHBondContact O-N 2.85Å
145E60.6Low67Low128 Ų128110.5 Ų110.560%0.59859%0.585SS**Hα-helixtrans-62.4-45.5177.4-166.1167.3-157.200111.8D141 K147 T148 E149D141-E145 PolarHBondContact O-N 2.87Å; E145-K147 VanDerWaalsContact C-N 3.33Å; E145-K147 PolarHBondContact O-N 3.31Å; E145-T148 PolarHBondContact O-N 2.67Å; E145-T148 VanDerWaalsContact O-N 3.15Å; E145-T148 PolarHBondContact O-OG1 3.28Å; E145-E149 WeakPolarHBondContact O-CG 3.35Å; E145-E149 PolarHBondContact O-N 3.2Å
146E65.1Low68.8Low117 Ų117106.5 Ų106.555%0.54757%0.569SS.*Hα-helixtrans-59.5-42.3175.1-172.9175.6-163.100112.2I142 T148 E149 D150I142-E146 PolarHBondContact O-N 2.96Å; E146-T148 PolarHBondContact O-N 3.36Å; E146-E149 PolarHBondContact O-N 2.87Å; E146-D150 PolarHBondContact O-N 3.07Å
147K73.6Confident70.9Confident135 Ų135110.1 Ų110.159%0.58757%0.568SS**Hα-helixtrans-66.2-36.9176.2-172.1-179.1178.3-1710112.3L143 E144 E145 E149 D150 L151L143-K147 WeakPolarHBondContact O-CB 3.47Å; L143-K147 PolarHBondContact O-N 3.01Å; E144-K147 PolarHBondContact O-N 3.07Å; E145-K147 VanDerWaalsContact C-N 3.33Å; E145-K147 PolarHBondContact O-N 3.31Å; K147-E149 VanDerWaalsContact C-N 3.34Å; K147-D150 PolarHBondContact O-N 3.27Å; K147-L151 WeakPolarHBondContact O-CG 3.36Å; K147-L151 PolarHBondContact O-N 3.16Å
148T75.5Confident73.4Confident53 Ų53107.7 Ų107.733%0.32556%0.557SS.*Hα-helixtrans-68.8-35.6174.6650000111.9E144 E145 E146 L151 R152E144-T148 VanDerWaalsContact O-CG2 3.3Å; E144-T148 WeakPolarHBondContact O-CG2 3.44Å; E144-T148 PolarHBondContact O-N 2.85Å; E145-T148 PolarHBondContact O-N 2.67Å; E145-T148 VanDerWaalsContact O-N 3.15Å; E145-T148 PolarHBondContact O-OG1 3.28Å; E146-T148 PolarHBondContact O-N 3.36Å; T148-L151 PolarHBondContact O-N 3.31Å; T148-R152 WeakPolarHBondContact O-CG 3.01Å; T148-R152 PolarHBondContact O-N 3.08Å; T148-R152 PolarHBondContact OG1-NH1 3.35Å
149E81.2Confident75.9Confident73 Ų73111.7 Ų111.734%0.34155%0.545SS..Hα-helixtrans-68.4-38.6174.6-74.9-58.3127.800112.1E145 E146 K147 R152 R153E145-E149 WeakPolarHBondContact O-CG 3.35Å; E145-E149 PolarHBondContact O-N 3.2Å; E146-E149 PolarHBondContact O-N 2.87Å; K147-E149 VanDerWaalsContact C-N 3.34Å; E149-R152 PolarHBondContact O-N 3.39Å; E149-R152 IonicContact OE1-CZ 3.64Å; E149-R152 IonicContact OE1-NE 3.95Å; E149-R152 IonicContact OE1-NH1 2.7Å; E149-R152 PolarHBondContact OE1-NH1 3.45Å; E149-R153 WeakPolarHBondContact O-CG 3.3Å; E149-R153 PolarHBondContact O-N 3.34Å
150D84.1Confident78.3Confident80 Ų80113.6 Ų113.643%0.42855%0.547SS..Hα-helixtrans-62.4-45.5171.4-79.5-25.8000112.1E146 K147 R152 R153 E154E146-D150 PolarHBondContact O-N 3.07Å; K147-D150 PolarHBondContact O-N 3.27Å; D150-R152 VanDerWaalsContact C-N 3.29Å; D150-R152 PolarHBondContact O-N 2.87Å; D150-R153 WeakPolarHBondContact O-CB 3.33Å; D150-R153 PolarHBondContact O-N 2.94Å; D150-R153 IonicContact OD1-CZ 3.31Å; D150-R153 VanDerWaalsContact OD1-CZ 3.31Å; D150-R153 IonicContact OD1-NE 3.16Å; D150-R153 PolarHBondContact OD1-NE 3.04Å; D150-R153 VanDerWaalsContact OD1-NE 3.16Å; D150-R153 IonicContact OD1-NH2 2.65Å; D150-R153 PolarHBondContact OD1-NH2 3.1Å; D150-E154 PolarHBondContact O-N 3.25Å
151L90.4Very high80.6Confident96 Ų96112.9 Ų112.950%0.50353%0.532SS..Hα-helixtrans-62.3-36.9175.2-74169.2000111.9K147 T148 M155K147-L151 WeakPolarHBondContact O-CG 3.36Å; K147-L151 PolarHBondContact O-N 3.16Å; T148-L151 PolarHBondContact O-N 3.31Å; L151-M155 VanDerWaalsContact O-CB 3.23Å; L151-M155 WeakPolarHBondContact O-CB 3.43Å; L151-M155 PolarHBondContact O-N 3.22Å
152R91.5Very high83Confident131 Ų131112.4 Ų112.449%0.49453%0.529SS..Hα-helixtrans-64.3-43.6173.7-77.8-179.8-175.3107.78.3111.4T148 E149 D150 M155 I156T148-R152 WeakPolarHBondContact O-CG 3.01Å; T148-R152 PolarHBondContact O-N 3.08Å; T148-R152 PolarHBondContact OG1-NH1 3.35Å; E149-R152 PolarHBondContact O-N 3.39Å; E149-R152 IonicContact OE1-CZ 3.64Å; E149-R152 IonicContact OE1-NE 3.95Å; E149-R152 IonicContact OE1-NH1 2.7Å; E149-R152 PolarHBondContact OE1-NH1 3.45Å; D150-R152 VanDerWaalsContact C-N 3.29Å; D150-R152 PolarHBondContact O-N 2.87Å; R152-M155 PolarHBondContact O-N 3.19Å; R152-I156 VanDerWaalsContact O-CG1 3.3Å; R152-I156 WeakPolarHBondContact O-CG1 3.48Å; R152-I156 PolarHBondContact O-N 2.65Å
153R93.6Very high84.8Confident126 Ų126110.7 Ų110.748%0.47552%0.518SS..Hα-helixtrans-60.1-49.5175.6-75.7-176.8-82-88.99.4111.5E149 D150 M155 I156 E157E149-R153 WeakPolarHBondContact O-CG 3.3Å; E149-R153 PolarHBondContact O-N 3.34Å; D150-R153 WeakPolarHBondContact O-CB 3.33Å; D150-R153 PolarHBondContact O-N 2.94Å; D150-R153 IonicContact OD1-CZ 3.31Å; D150-R153 VanDerWaalsContact OD1-CZ 3.31Å; D150-R153 IonicContact OD1-NE 3.16Å; D150-R153 PolarHBondContact OD1-NE 3.04Å; D150-R153 VanDerWaalsContact OD1-NE 3.16Å; D150-R153 IonicContact OD1-NH2 2.65Å; D150-R153 PolarHBondContact OD1-NH2 3.1Å; R153-M155 VanDerWaalsContact C-N 3.31Å; R153-M155 PolarHBondContact O-N 3.45Å; R153-I156 PolarHBondContact O-N 3.47Å; R153-E157 PolarHBondContact O-N 3.21Å
154E92.5Very high86.8Confident107 Ų107109 Ų10950%0.551%0.505SS..Hα-helixtrans-60.3-41.2178-171.9-179.9-174.500111.4D150 I156 E157 L158D150-E154 PolarHBondContact O-N 3.25Å; E154-I156 VanDerWaalsContact C-N 3.32Å; E154-I156 PolarHBondContact O-N 2.79Å; E154-E157 PolarHBondContact O-N 3.45Å; E154-L158 HydrophobicContact CG-CD1 4.17Å; E154-L158 HydrophobicContact CG-CG 4.45Å; E154-L158 WeakPolarHBondContact O-CB 3.35Å; E154-L158 WeakPolarHBondContact O-CG 3.44Å; E154-L158 PolarHBondContact O-N 2.91Å
155M95.1Very high88.8Confident87 Ų87108.4 Ų108.443%0.42950%0.502SS..Hα-helixtrans-65.5-35178.7-160.2-88-70.400112.4L151 R152 R153 R159L151-M155 VanDerWaalsContact O-CB 3.23Å; L151-M155 WeakPolarHBondContact O-CB 3.43Å; L151-M155 PolarHBondContact O-N 3.22Å; R152-M155 PolarHBondContact O-N 3.19Å; R153-M155 VanDerWaalsContact C-N 3.31Å; R153-M155 PolarHBondContact O-N 3.45Å; M155-R159 VanDerWaalsContact O-CG 3.3Å; M155-R159 WeakPolarHBondContact O-CG 3.34Å; M155-R159 PolarHBondContact O-N 3.19Å; M155-R159 HydrophobicContact SD-CG 4.33Å; M155-R159 PolarHBondContact SD-NE 2.97Å; M155-R159 PolarHBondContact SD-NH2 2.89Å; M155-R159 VanDerWaalsContact SD-NH2 3.42Å
156I95.4Very high90.6Very high109 Ų109109.4 Ų109.456%0.55950%0.5SS*.Hα-helixtrans-69.3-43173.2-67.2163.8000110.8R152 R153 E154 R159 Q160R152-I156 VanDerWaalsContact O-CG1 3.3Å; R152-I156 WeakPolarHBondContact O-CG1 3.48Å; R152-I156 PolarHBondContact O-N 2.65Å; R153-I156 PolarHBondContact O-N 3.47Å; E154-I156 VanDerWaalsContact C-N 3.32Å; E154-I156 PolarHBondContact O-N 2.79Å; I156-R159 WeakPolarHBondContact O-CB 3.36Å; I156-R159 PolarHBondContact O-N 3.38Å; I156-Q160 PolarHBondContact O-N 3.07Å
157E95.4Very high92.1Very high138 Ų138107.3 Ų107.365%0.64550%0.495SS*.Hα-helixtrans-63.2-46.1178.4-174.3172.7-17200111.8R153 E154 R159 Q160 Q161R153-E157 PolarHBondContact O-N 3.21Å; E154-E157 PolarHBondContact O-N 3.45Å; E157-R159 VanDerWaalsContact C-N 3.31Å; E157-R159 PolarHBondContact O-N 3.27Å; E157-Q160 WeakPolarHBondContact O-CB 3.39Å; E157-Q160 PolarHBondContact O-N 3.18Å; E157-Q160 VanDerWaalsContact O-N 3.09Å; E157-Q161 PolarHBondContact O-N 3.22Å
158L96.8Very high93.2Very high107 Ų107104.4 Ų104.456%0.5649%0.489SS*.Hα-helixtrans-60.1-39.6175.9-73.2172.9000112.1E154 Q161 L162E154-L158 HydrophobicContact CG-CD1 4.17Å; E154-L158 HydrophobicContact CG-CG 4.45Å; E154-L158 WeakPolarHBondContact O-CB 3.35Å; E154-L158 WeakPolarHBondContact O-CG 3.44Å; E154-L158 PolarHBondContact O-N 2.91Å; L158-Q161 PolarHBondContact O-N 3.14Å; L158-L162 WeakPolarHBondContact O-CB 3.49Å; L158-L162 PolarHBondContact O-N 2.96Å
159R94.1Very high94.2Very high167 Ų167108.8 Ų108.863%0.6350%0.499SS*.Hα-helixtrans-62-44.5173.1-77.2179.3-173.8-1314.8111.9M155 I156 E157 Q161 L162 E163M155-R159 VanDerWaalsContact O-CG 3.3Å; M155-R159 WeakPolarHBondContact O-CG 3.34Å; M155-R159 PolarHBondContact O-N 3.19Å; M155-R159 HydrophobicContact SD-CG 4.33Å; M155-R159 PolarHBondContact SD-NE 2.97Å; M155-R159 PolarHBondContact SD-NH2 2.89Å; M155-R159 VanDerWaalsContact SD-NH2 3.42Å; I156-R159 WeakPolarHBondContact O-CB 3.36Å; I156-R159 PolarHBondContact O-N 3.38Å; E157-R159 VanDerWaalsContact C-N 3.31Å; E157-R159 PolarHBondContact O-N 3.27Å; R159-Q161 VanDerWaalsContact C-N 3.29Å; R159-Q161 PolarHBondContact O-N 2.9Å; R159-L162 PolarHBondContact O-N 2.95Å; R159-E163 PolarHBondContact O-N 3.25Å
160Q96.2Very high95Very high111 Ų111110.5 Ų110.552%0.51951%0.509SS..Hα-helixtrans-64.4-38178.2-166.4-177.498.800111.3I156 E157 E163 K164I156-Q160 PolarHBondContact O-N 3.07Å; E157-Q160 WeakPolarHBondContact O-CB 3.39Å; E157-Q160 PolarHBondContact O-N 3.18Å; E157-Q160 VanDerWaalsContact O-N 3.09Å; Q160-E163 PolarHBondContact O-N 3.28Å; Q160-K164 WeakPolarHBondContact O-CG 3.3Å; Q160-K164 PolarHBondContact O-N 3.42Å
161Q96.1Very high95.6Very high116 Ų116111.2 Ų111.254%0.54251%0.511SS..Hα-helixtrans-66.2-42.2177.1-166.566.4-0.900112.1E157 L158 R159 E163 K164 E165E157-Q161 PolarHBondContact O-N 3.22Å; L158-Q161 PolarHBondContact O-N 3.14Å; R159-Q161 VanDerWaalsContact C-N 3.29Å; R159-Q161 PolarHBondContact O-N 2.9Å; Q161-E163 VanDerWaalsContact C-N 3.31Å; Q161-E163 PolarHBondContact O-N 3.08Å; Q161-K164 PolarHBondContact O-N 3.32Å; Q161-E165 PolarHBondContact O-N 2.98Å
162L97.3Very high95.9Very high81 Ų81110.7 Ų110.742%0.42451%0.508SS..Hα-helixtrans-61.2-40.1174.7-174.270.4000111.7L158 R159 E165 R166L158-L162 WeakPolarHBondContact O-CB 3.49Å; L158-L162 PolarHBondContact O-N 2.96Å; R159-L162 PolarHBondContact O-N 2.95Å; L162-E165 PolarHBondContact O-N 2.99Å; L162-R166 WeakPolarHBondContact O-CB 3.49Å; L162-R166 WeakPolarHBondContact O-CG 3.49Å; L162-R166 PolarHBondContact O-N 3.47Å
163E97.2Very high96.1Very high104 Ų104108.1 Ų108.149%0.48650%0.501SS..Hα-helixtrans-67.7-39.8178.3-165.857.7-144.800112R159 Q160 Q161 R166 T167R159-E163 PolarHBondContact O-N 3.25Å; Q160-E163 PolarHBondContact O-N 3.28Å; Q161-E163 VanDerWaalsContact C-N 3.31Å; Q161-E163 PolarHBondContact O-N 3.08Å; E163-R166 PolarHBondContact O-N 2.9Å; E163-R166 IonicContact OE2-NH1 3.92Å; E163-T167 WeakPolarHBondContact O-CB 3.34Å; E163-T167 PolarHBondContact O-N 2.62Å; E163-T167 PolarHBondContact O-OG1 3.36Å
164K96.4Very high96.2Very high104 Ų104106 Ų10645%0.45250%0.499SS..Hα-helixtrans-60.6-46171.5-71.6170.7-173.9162.90111.1Q160 Q161 T167 V168Q160-K164 WeakPolarHBondContact O-CG 3.3Å; Q160-K164 PolarHBondContact O-N 3.42Å; Q161-K164 PolarHBondContact O-N 3.32Å; K164-T167 PolarHBondContact O-N 2.92Å; K164-V168 WeakPolarHBondContact O-CG2 3.41Å; K164-V168 PolarHBondContact O-N 2.86Å
165E97Very high96.4Very high106 Ų106105.9 Ų105.950%0.49550%0.499SS..Hα-helixtrans-61.5-45.8178.2-168.1-165.3154.500111.4Q161 L162 T167 V168 R169Q161-E165 PolarHBondContact O-N 2.98Å; L162-E165 PolarHBondContact O-N 2.99Å; E165-T167 VanDerWaalsContact C-N 3.32Å; E165-T167 PolarHBondContact O-N 3.37Å; E165-V168 PolarHBondContact O-N 3.46Å; E165-R169 VanDerWaalsContact O-CB 3.28Å; E165-R169 WeakPolarHBondContact O-CB 3.35Å; E165-R169 PolarHBondContact O-N 2.91Å; E165-R169 IonicContact OE1-NH2 3.87Å
166R97.4Very high96.4Very high150 Ų150107.4 Ų107.457%0.56651%0.507SS*.Hα-helixtrans-57.9-44.8175.9-77.8174.8175.9178.2-2.3112L162 E163 R169 M170L162-R166 WeakPolarHBondContact O-CB 3.49Å; L162-R166 WeakPolarHBondContact O-CG 3.49Å; L162-R166 PolarHBondContact O-N 3.47Å; E163-R166 PolarHBondContact O-N 2.9Å; E163-R166 IonicContact OE2-NH1 3.92Å; R166-R169 PolarHBondContact O-N 3.31Å; R166-M170 WeakPolarHBondContact O-CB 3.46Å; R166-M170 PolarHBondContact O-N 3.03Å
167T96.8Very high96.3Very high72 Ų72108.8 Ų108.844%0.44251%0.505SS..Hα-helixtrans-62.2-46.9178.8-57.10000111.2E163 K164 E165 M170 M171E163-T167 WeakPolarHBondContact O-CB 3.34Å; E163-T167 PolarHBondContact O-N 2.62Å; E163-T167 PolarHBondContact O-OG1 3.36Å; K164-T167 PolarHBondContact O-N 2.92Å; E165-T167 VanDerWaalsContact C-N 3.32Å; E165-T167 PolarHBondContact O-N 3.37Å; T167-M170 PolarHBondContact O-N 3.16Å; T167-M171 PolarHBondContact O-N 2.9Å
168V97Very high96.3Very high74 Ų74105.1 Ų105.145%0.44849%0.494SS..Hα-helixtrans-65.5-42178.1172.70000111.2K164 E165 M171 L172K164-V168 WeakPolarHBondContact O-CG2 3.41Å; K164-V168 PolarHBondContact O-N 2.86Å; E165-V168 PolarHBondContact O-N 3.46Å; V168-M171 PolarHBondContact O-N 3.31Å; V168-L172 HydrophobicContact CG1-CD1 4.03Å; V168-L172 HydrophobicContact CG1-CG 4.4Å; V168-L172 WeakPolarHBondContact O-CG 3.39Å; V168-L172 PolarHBondContact O-N 3.11Å
169R97.7Very high96Very high145 Ų145105.2 Ų105.255%0.54750%0.495SS..Hα-helixtrans-60.5-47.2176.6179.2176.7-73.6-126.22.8111.1E165 R166 M171 L172 E173E165-R169 VanDerWaalsContact O-CB 3.28Å; E165-R169 WeakPolarHBondContact O-CB 3.35Å; E165-R169 PolarHBondContact O-N 2.91Å; E165-R169 IonicContact OE1-NH2 3.87Å; R166-R169 PolarHBondContact O-N 3.31Å; R169-M171 VanDerWaalsContact C-N 3.33Å; R169-M171 PolarHBondContact O-N 3.02Å; R169-L172 PolarHBondContact O-N 3.14Å; R169-E173 HydrophobicContact CG-CG 4.32Å; R169-E173 WeakPolarHBondContact CG-OE1 3.41Å; R169-E173 WeakPolarHBondContact O-CB 3.49Å; R169-E173 VanDerWaalsContact O-CG 3.32Å; R169-E173 WeakPolarHBondContact O-CG 3.38Å; R169-E173 PolarHBondContact O-N 2.99Å
170M96.4Very high95.8Very high109 Ų109101.8 Ų101.854%0.53749%0.489SS..Hα-helixtrans-58.1-46175.9-178.3179.765.100111.3R166 T167 L172 E173 D174R166-M170 WeakPolarHBondContact O-CB 3.46Å; R166-M170 PolarHBondContact O-N 3.03Å; T167-M170 PolarHBondContact O-N 3.16Å; M170-L172 PolarHBondContact O-N 3.36Å; M170-E173 PolarHBondContact O-N 3.1Å; M170-D174 PolarHBondContact O-N 3.31Å
171M97.3Very high95.5Very high96 Ų9699.7 Ų99.747%0.47349%0.491SS..Hα-helixtrans-60.4-43.4177.3-175.7-170.769.900112.3T167 V168 R169 D174 Q175T167-M171 PolarHBondContact O-N 2.9Å; V168-M171 PolarHBondContact O-N 3.31Å; R169-M171 VanDerWaalsContact C-N 3.33Å; R169-M171 PolarHBondContact O-N 3.02Å; M171-D174 PolarHBondContact O-N 2.93Å; M171-Q175 WeakPolarHBondContact O-CG 3.4Å; M171-Q175 PolarHBondContact O-N 3.49Å
172L96.5Very high95.2Very high84 Ų84100.5 Ų100.544%0.4450%0.495SS..Hα-helixtrans-68.9-40.7178.2-71.8174.9000112V168 R169 M170 D174 Q175 M176V168-L172 HydrophobicContact CG1-CD1 4.03Å; V168-L172 HydrophobicContact CG1-CG 4.4Å; V168-L172 WeakPolarHBondContact O-CG 3.39Å; V168-L172 PolarHBondContact O-N 3.11Å; R169-L172 PolarHBondContact O-N 3.14Å; M170-L172 PolarHBondContact O-N 3.36Å; L172-D174 VanDerWaalsContact C-N 3.3Å; L172-D174 PolarHBondContact O-N 2.91Å; L172-Q175 PolarHBondContact O-N 3.33Å; L172-M176 WeakPolarHBondContact O-CB 3.27Å; L172-M176 WeakPolarHBondContact O-CG 3.4Å; L172-M176 PolarHBondContact O-N 2.87Å
173E96.3Very high94.7Very high77 Ų77100.3 Ų100.336%0.3649%0.493SS..Hα-helixtrans-62-38.2175-74.8178.2-16900111.8R169 M170 M176 R177R169-E173 HydrophobicContact CG-CG 4.32Å; R169-E173 WeakPolarHBondContact CG-OE1 3.41Å; R169-E173 WeakPolarHBondContact O-CB 3.49Å; R169-E173 VanDerWaalsContact O-CG 3.32Å; R169-E173 WeakPolarHBondContact O-CG 3.38Å; R169-E173 PolarHBondContact O-N 2.99Å; M170-E173 PolarHBondContact O-N 3.1Å; E173-M176 PolarHBondContact O-N 3Å; E173-R177 WeakPolarHBondContact O-CB 3.36Å; E173-R177 WeakPolarHBondContact O-CG 3.13Å; E173-R177 PolarHBondContact O-N 3.38Å; E173-R177 IonicContact OE2-NH1 3.86Å; E173-R177 IonicContact OE2-NH2 3.88Å
174D96.4Very high94.2Very high81 Ų81102.7 Ų102.743%0.43350%0.499SS..Hα-helixtrans-69.4-39.2175-75.9-14.8000112.3M170 M171 L172 R177 S178M170-D174 PolarHBondContact O-N 3.31Å; M171-D174 PolarHBondContact O-N 2.93Å; L172-D174 VanDerWaalsContact C-N 3.3Å; L172-D174 PolarHBondContact O-N 2.91Å; D174-R177 PolarHBondContact O-N 3.15Å; D174-R177 IonicContact OD1-CZ 3.47Å; D174-R177 IonicContact OD1-NE 3.38Å; D174-R177 PolarHBondContact OD1-NE 3.36Å; D174-R177 IonicContact OD1-NH2 2.72Å; D174-R177 PolarHBondContact OD1-NH2 2.92Å; D174-S178 WeakPolarHBondContact O-CB 3.49Å; D174-S178 PolarHBondContact O-N 3.29Å
175Q95.9Very high93.5Very high105 Ų105100.7 Ų100.749%0.49150%0.497SS..Hα-helixtrans-62.5-43.6172.1-74.4-179.23.800111.7M171 L172 S178 L179M171-Q175 WeakPolarHBondContact O-CG 3.4Å; M171-Q175 PolarHBondContact O-N 3.49Å; L172-Q175 PolarHBondContact O-N 3.33Å; Q175-S178 PolarHBondContact O-N 2.9Å; Q175-L179 WeakPolarHBondContact O-CG 3.49Å; Q175-L179 PolarHBondContact O-N 3.23Å
176M94.4Very high93Very high120 Ų120101.8 Ų101.859%0.59150%0.502SS*.Hα-helixtrans-61.6-48.8175.6-75.1-175.766.900111.5L172 E173 S178 L179 D180L172-M176 WeakPolarHBondContact O-CB 3.27Å; L172-M176 WeakPolarHBondContact O-CG 3.4Å; L172-M176 PolarHBondContact O-N 2.87Å; E173-M176 PolarHBondContact O-N 3Å; M176-S178 VanDerWaalsContact C-N 3.28Å; M176-S178 PolarHBondContact O-N 3.48Å; M176-L179 PolarHBondContact O-N 2.94Å; M176-D180 WeakPolarHBondContact O-CB 3.28Å; M176-D180 PolarHBondContact O-N 2.96Å
177R94.9Very high92.4Very high137 Ų137100.1 Ų100.152%0.51750%0.499SS..Hα-helixtrans-57.7-40.8175.8-82.2-171.5-78.3-92.92112.1E173 D174 A181E173-R177 WeakPolarHBondContact O-CB 3.36Å; E173-R177 WeakPolarHBondContact O-CG 3.13Å; E173-R177 PolarHBondContact O-N 3.38Å; E173-R177 IonicContact OE2-NH1 3.86Å; E173-R177 IonicContact OE2-NH2 3.88Å; D174-R177 PolarHBondContact O-N 3.15Å; D174-R177 IonicContact OD1-CZ 3.47Å; D174-R177 IonicContact OD1-NE 3.38Å; D174-R177 PolarHBondContact OD1-NE 3.36Å; D174-R177 IonicContact OD1-NH2 2.72Å; D174-R177 PolarHBondContact OD1-NH2 2.92Å; R177-A181 VanDerWaalsContact O-CB 3.32Å; R177-A181 WeakPolarHBondContact O-CB 3.34Å; R177-A181 PolarHBondContact O-N 3.16Å
178S93.7Very high91.8Very high61 Ų61101 Ų10143%0.42750%0.5SS..Hα-helixtrans-65-45.8177.2-1760000112.2D174 Q175 M176 A181 Q182D174-S178 WeakPolarHBondContact O-CB 3.49Å; D174-S178 PolarHBondContact O-N 3.29Å; Q175-S178 PolarHBondContact O-N 2.9Å; M176-S178 VanDerWaalsContact C-N 3.28Å; M176-S178 PolarHBondContact O-N 3.48Å; S178-A181 PolarHBondContact O-N 3.34Å; S178-Q182 WeakPolarHBondContact O-CG 3.36Å; S178-Q182 PolarHBondContact O-N 2.99Å
179L91.4Very high91.3Very high109 Ų109104.8 Ų104.857%0.57151%0.511SS*.Hα-helixtrans-63.4-43.8176.3-74172.2000111.9Q175 M176 A181 Q182 L183Q175-L179 WeakPolarHBondContact O-CG 3.49Å; Q175-L179 PolarHBondContact O-N 3.23Å; M176-L179 PolarHBondContact O-N 2.94Å; L179-A181 VanDerWaalsContact C-N 3.34Å; L179-A181 PolarHBondContact O-N 3.43Å; L179-Q182 PolarHBondContact O-N 3.49Å; L179-L183 WeakPolarHBondContact O-CB 3.35Å; L179-L183 PolarHBondContact O-N 3.3Å
180D89.1Confident90.8Very high95 Ų95100.5 Ų100.551%0.50851%0.506SS..Hα-helixtrans-61.8-42.6175.5-81.8-29.5000111.2M176 Q182 L183 Y184M176-D180 WeakPolarHBondContact O-CB 3.28Å; M176-D180 PolarHBondContact O-N 2.96Å; D180-Q182 PolarHBondContact O-N 2.81Å; D180-L183 PolarHBondContact O-N 2.96Å; D180-Y184 WeakPolarHBondContact O-CB 3.46Å; D180-Y184 PolarHBondContact O-N 2.98Å
181A90.1Very high90.4Very high67 Ų67100 Ų10055%0.55451%0.505SS*.Hα-helixtrans-62-31.7176.300000112.9R177 S178 L179 P185R177-A181 VanDerWaalsContact O-CB 3.32Å; R177-A181 WeakPolarHBondContact O-CB 3.34Å; R177-A181 PolarHBondContact O-N 3.16Å; S178-A181 PolarHBondContact O-N 3.34Å; L179-A181 VanDerWaalsContact C-N 3.34Å; L179-A181 PolarHBondContact O-N 3.43Å; A181-P185 WeakPolarHBondContact O-CD 3.19Å; A181-P185 WeakPolarHBondContact O-CG 3.49Å
182Q89.7Confident90Very high134 Ų13498.3 Ų98.363%0.62651%0.506SS*.Hα-helixtrans-76.7-39.7176.1-70.1175.322.400112.6S178 L179 D180S178-Q182 WeakPolarHBondContact O-CG 3.36Å; S178-Q182 PolarHBondContact O-N 2.99Å; L179-Q182 PolarHBondContact O-N 3.49Å; D180-Q182 PolarHBondContact O-N 2.81Å
183L87.6Confident89.7Confident76 Ų76100 Ų10040%0.39851%0.511SS..Hα-helixtrans-90.1-28.1-172-161.272.9000113.4L179 D180 E186 K187L179-L183 WeakPolarHBondContact O-CB 3.35Å; L179-L183 PolarHBondContact O-N 3.3Å; D180-L183 PolarHBondContact O-N 2.96Å; L183-E186 WeakPolarHBondContact O-CB 3.47Å; L183-E186 PolarHBondContact O-N 3.45Å; L183-E186 VanDerWaalsContact O-N 3.11Å; L183-K187 PolarHBondContact O-N 3.47Å
184Y85.3Confident89.4Confident154 Ų154102.3 Ų102.360%0.60452%0.522SS*.Hα-helixtrans-59.8-42.2-178.2-166.8-100.7000113.4D180 E186 K187 L188D180-Y184 WeakPolarHBondContact O-CB 3.46Å; D180-Y184 PolarHBondContact O-N 2.98Å; Y184-E186 VanDerWaalsContact C-N 3.27Å; Y184-E186 PolarHBondContact O-N 3.13Å; Y184-K187 PolarHBondContact O-N 3.28Å; Y184-L188 HydrophobicContact CD1-CD1 3.54Å; Y184-L188 HydrophobicContact CD1-CG 4.36Å; Y184-L188 HydrophobicContact CE1-CD1 3.36Å; Y184-L188 HydrophobicContact CE1-CG 4.12Å; Y184-L188 HydrophobicContact CG-CD1 4.5Å; Y184-L188 PolarHBondContact O-N 2.91Å
185P83.6Confident89.1Confident63 Ų63102.5 Ų102.541%0.40953%0.526SS..Hα-helixtrans-60.5-35173.1-22.733.8000113.3A181 K189A181-P185 WeakPolarHBondContact O-CD 3.19Å; A181-P185 WeakPolarHBondContact O-CG 3.49Å; P185-K189 WeakPolarHBondContact O-CG 3.34Å; P185-K189 PolarHBondContact O-N 3.3Å; P185-K189 VanDerWaalsContact O-N 3.1Å
186E85.3Confident88.8Confident128 Ų128103.2 Ų103.260%0.59853%0.529SS*.Hα-helixtrans-73-42.7179.9-164.5175.7-16000111.5L183 Y184 L188 K189 A190L183-E186 WeakPolarHBondContact O-CB 3.47Å; L183-E186 PolarHBondContact O-N 3.45Å; L183-E186 VanDerWaalsContact O-N 3.11Å; Y184-E186 VanDerWaalsContact C-N 3.27Å; Y184-E186 PolarHBondContact O-N 3.13Å; E186-L188 VanDerWaalsContact C-N 3.34Å; E186-L188 PolarHBondContact O-N 2.8Å; E186-K189 PolarHBondContact O-N 3.33Å; E186-A190 PolarHBondContact O-N 3.47Å
187K84.3Confident88.5Confident116 Ų116102.4 Ų102.450%0.50452%0.524SS..Hα-helixtrans-59.6-42.9172.7-73.3-178.8177.91750112.1L183 Y184 A190 I191L183-K187 PolarHBondContact O-N 3.47Å; Y184-K187 PolarHBondContact O-N 3.28Å; K187-A190 PolarHBondContact O-N 3.01Å; K187-I191 VanDerWaalsContact O-CG1 3.29Å; K187-I191 WeakPolarHBondContact O-CG1 3.37Å; K187-I191 PolarHBondContact O-N 2.82Å
188L84.8Confident88.2Confident89 Ų89101.7 Ų101.747%0.46653%0.527SS..Hα-helixtrans-61-43.9175.9-86163000112.1Y184 E186 I191 A192Y184-L188 HydrophobicContact CD1-CD1 3.54Å; Y184-L188 HydrophobicContact CD1-CG 4.36Å; Y184-L188 HydrophobicContact CE1-CD1 3.36Å; Y184-L188 HydrophobicContact CE1-CG 4.12Å; Y184-L188 HydrophobicContact CG-CD1 4.5Å; Y184-L188 PolarHBondContact O-N 2.91Å; E186-L188 VanDerWaalsContact C-N 3.34Å; E186-L188 PolarHBondContact O-N 2.8Å; L188-I191 PolarHBondContact O-N 3.43Å; L188-A192 WeakPolarHBondContact O-CB 3.39Å; L188-A192 PolarHBondContact O-N 3.1Å
189K87.1Confident87.9Confident155 Ų155103.9 Ų103.967%0.67453%0.53SS*.Hα-helixtrans-62.3-43.8175.7-74.5173.8-177.6178.90111.8P185 E186 A192 Q193P185-K189 WeakPolarHBondContact O-CG 3.34Å; P185-K189 PolarHBondContact O-N 3.3Å; P185-K189 VanDerWaalsContact O-N 3.1Å; E186-K189 PolarHBondContact O-N 3.33Å; K189-A192 PolarHBondContact O-N 3.42Å; K189-Q193 WeakPolarHBondContact O-CB 3.27Å; K189-Q193 PolarHBondContact O-N 3.02Å
190A87.7Confident87.7Confident54 Ų54102.9 Ų102.945%0.44653%0.528SS..Hα-helixtrans-62.3-43.317800000112.2E186 K187 Q193 Q194E186-A190 PolarHBondContact O-N 3.47Å; K187-A190 PolarHBondContact O-N 3.01Å; A190-Q193 PolarHBondContact O-N 3.38Å; A190-Q194 WeakPolarHBondContact O-CB 3.5Å; A190-Q194 PolarHBondContact O-N 2.83Å
191I87.8Confident87.5Confident100 Ų100104.7 Ų104.751%0.51353%0.534SS..Hα-helixtrans-63.9-45.9176.1-66.8165.2000110.6K187 L188 Q193 Q194 V195K187-I191 VanDerWaalsContact O-CG1 3.29Å; K187-I191 WeakPolarHBondContact O-CG1 3.37Å; K187-I191 PolarHBondContact O-N 2.82Å; L188-I191 PolarHBondContact O-N 3.43Å; I191-Q193 VanDerWaalsContact C-N 3.3Å; I191-Q193 PolarHBondContact O-N 3.44Å; I191-Q194 PolarHBondContact O-N 3.13Å; I191-V195 HydrophobicContact CG2-CG2 4.46Å; I191-V195 WeakPolarHBondContact O-CG2 3.33Å; I191-V195 PolarHBondContact O-N 3.17Å
192A87.8Confident87.3Confident59 Ų59105.3 Ų105.349%0.48853%0.531SS..Hα-helixtrans-59.5-41.7177.900000111.7L188 K189 V195 Q196L188-A192 WeakPolarHBondContact O-CB 3.39Å; L188-A192 PolarHBondContact O-N 3.1Å; K189-A192 PolarHBondContact O-N 3.42Å; A192-V195 PolarHBondContact O-N 3.35Å; A192-Q196 PolarHBondContact O-N 3.48Å
193Q90.8Very high87.2Confident120 Ų120103.7 Ų103.756%0.56152%0.523SS*.Hα-helixtrans-63.2-45.9175.4-177.9175.80.400112K189 A190 I191 V195 Q196 E197K189-Q193 WeakPolarHBondContact O-CB 3.27Å; K189-Q193 PolarHBondContact O-N 3.02Å; A190-Q193 PolarHBondContact O-N 3.38Å; I191-Q193 VanDerWaalsContact C-N 3.3Å; I191-Q193 PolarHBondContact O-N 3.44Å; Q193-V195 VanDerWaalsContact C-N 3.32Å; Q193-V195 PolarHBondContact O-N 2.87Å; Q193-Q196 WeakPolarHBondContact O-CB 3.47Å; Q193-Q196 PolarHBondContact O-N 3.31Å; Q193-Q196 VanDerWaalsContact O-N 3.17Å; Q193-E197 PolarHBondContact NE2-OE1 2.85Å; Q193-E197 VanDerWaalsContact NE2-OE1 3.11Å; Q193-E197 WeakPolarHBondContact O-CG 3.34Å; Q193-E197 PolarHBondContact O-N 3.47Å
194Q89.6Confident87.1Confident126 Ų126103.2 Ų103.259%0.58953%0.526SS*.Hα-helixtrans-61.7-40.5179.4-172.7179.21.600112.1A190 I191 E197 Q198A190-Q194 WeakPolarHBondContact O-CB 3.5Å; A190-Q194 PolarHBondContact O-N 2.83Å; I191-Q194 PolarHBondContact O-N 3.13Å; Q194-E197 PolarHBondContact O-N 3.25Å; Q194-Q198 WeakPolarHBondContact O-CB 3.41Å; Q194-Q198 PolarHBondContact O-N 3.11Å
195V90.6Very high87.1Confident84 Ų84101.8 Ų101.851%0.50953%0.528SS..Hα-helixtrans-63.9-42.5175.5172.70000110.9I191 A192 Q193 E197 Q198 Q199I191-V195 HydrophobicContact CG2-CG2 4.46Å; I191-V195 WeakPolarHBondContact O-CG2 3.33Å; I191-V195 PolarHBondContact O-N 3.17Å; A192-V195 PolarHBondContact O-N 3.35Å; Q193-V195 VanDerWaalsContact C-N 3.32Å; Q193-V195 PolarHBondContact O-N 2.87Å; V195-E197 PolarHBondContact O-N 3.31Å; V195-Q198 PolarHBondContact O-N 2.93Å; V195-Q199 WeakPolarHBondContact O-CB 3.34Å; V195-Q199 PolarHBondContact O-N 3.45Å
196Q89.8Confident87.2Confident120 Ų120102.8 Ų102.856%0.56153%0.533SS*.Hα-helixtrans-59.5-46.9176.6-169.679.34800111.3A192 Q193 Q199 V200A192-Q196 PolarHBondContact O-N 3.48Å; Q193-Q196 WeakPolarHBondContact O-CB 3.47Å; Q193-Q196 PolarHBondContact O-N 3.31Å; Q193-Q196 VanDerWaalsContact O-N 3.17Å; Q196-Q199 PolarHBondContact O-N 3.49Å; Q196-V200 WeakPolarHBondContact O-CG2 3.45Å; Q196-V200 PolarHBondContact O-N 2.97Å
197E87.5Confident87.2Confident103 Ų103105 Ų10548%0.48154%0.536SS..Hα-helixtrans-63.9-42.1179.6-72.3174.6-169.200112.1Q193 Q194 V195 Q199 V200 Q201Q193-E197 PolarHBondContact NE2-OE1 2.85Å; Q193-E197 VanDerWaalsContact NE2-OE1 3.11Å; Q193-E197 WeakPolarHBondContact O-CG 3.34Å; Q193-E197 PolarHBondContact O-N 3.47Å; Q194-E197 PolarHBondContact O-N 3.25Å; V195-E197 PolarHBondContact O-N 3.31Å; E197-Q199 VanDerWaalsContact C-N 3.33Å; E197-Q199 PolarHBondContact O-N 2.92Å; E197-V200 PolarHBondContact O-N 3.36Å; E197-Q201 PolarHBondContact O-N 3.07Å
198Q88.1Confident87.2Confident123 Ų123104.3 Ų104.358%0.57554%0.537SS*.Hα-helixtrans-65.8-36.9177.3-166.6170.371.600111.9Q194 V195 Q201 T202Q194-Q198 WeakPolarHBondContact O-CB 3.41Å; Q194-Q198 PolarHBondContact O-N 3.11Å; V195-Q198 PolarHBondContact O-N 2.93Å; Q198-Q201 PolarHBondContact O-N 3.44Å; Q198-T202 WeakPolarHBondContact O-CB 3.32Å; Q198-T202 PolarHBondContact O-N 3.41Å; Q198-T202 PolarHBondContact O-OG1 3.41Å
199Q88.1Confident86.9Confident107 Ų107105.6 Ų105.650%0.554%0.541SS..Hα-helixtrans-66.1-38.7174.9-163.7179.819.200111.9V195 Q196 E197 T202 Q203V195-Q199 WeakPolarHBondContact O-CB 3.34Å; V195-Q199 PolarHBondContact O-N 3.45Å; Q196-Q199 PolarHBondContact O-N 3.49Å; E197-Q199 VanDerWaalsContact C-N 3.33Å; E197-Q199 PolarHBondContact O-N 2.92Å; Q199-T202 PolarHBondContact O-N 3.45Å; Q199-Q203 PolarHBondContact O-N 3.24Å
200V87.4Confident86.5Confident88 Ų88103.8 Ų103.853%0.53353%0.533SS..Hα-helixtrans-65.8-45.1175.4172.60000111.1Q196 E197 T202 Q203 S204Q196-V200 WeakPolarHBondContact O-CG2 3.45Å; Q196-V200 PolarHBondContact O-N 2.97Å; E197-V200 PolarHBondContact O-N 3.36Å; V200-T202 VanDerWaalsContact C-N 3.33Å; V200-T202 PolarHBondContact O-N 2.92Å; V200-Q203 PolarHBondContact O-N 3.17Å; V200-S204 PolarHBondContact O-N 3.21Å
201Q85.9Confident85.9Confident132 Ų132106.9 Ų106.962%0.61754%0.538SS*.Hα-helixtrans-61-41.3174.9-79-17512.100112.3E197 Q198 S204 L205E197-Q201 PolarHBondContact O-N 3.07Å; Q198-Q201 PolarHBondContact O-N 3.44Å; Q201-S204 PolarHBondContact O-N 3.28Å; Q201-S204 PolarHBondContact O-OG 3.42Å; Q201-L205 PolarHBondContact O-N 3.45Å
202T85.3Confident85.1Confident81 Ų81107 Ų10750%0.49754%0.539SS..Hα-helixtrans-64.4-43.4178.1-54.30000110.7Q198 Q199 V200 S204 L205 V206Q198-T202 WeakPolarHBondContact O-CB 3.32Å; Q198-T202 PolarHBondContact O-N 3.41Å; Q198-T202 PolarHBondContact O-OG1 3.41Å; Q199-T202 PolarHBondContact O-N 3.45Å; V200-T202 VanDerWaalsContact C-N 3.33Å; V200-T202 PolarHBondContact O-N 2.92Å; T202-S204 PolarHBondContact O-N 3.47Å; T202-L205 PolarHBondContact O-N 2.87Å; T202-V206 VanDerWaalsContact O-CG2 3.32Å; T202-V206 WeakPolarHBondContact O-CG2 3.31Å; T202-V206 PolarHBondContact O-N 2.92Å
203Q86.3Confident84Confident99 Ų99110.2 Ų110.246%0.46354%0.544SS..Hα-helixtrans-64.1-38175.6-86.8-173.354.200113Q199 V200 V206 R207Q199-Q203 PolarHBondContact O-N 3.24Å; V200-Q203 PolarHBondContact O-N 3.17Å; Q203-V206 PolarHBondContact O-N 2.89Å; Q203-R207 WeakPolarHBondContact O-CG 3.19Å; Q203-R207 PolarHBondContact O-N 3.5Å
204S85.6Confident82.5Confident66 Ų66112.2 Ų112.246%0.46255%0.547SS..Hα-helixtrans-67.3-40.4178.168.90000111.5V200 Q201 T202 R207 L208V200-S204 PolarHBondContact O-N 3.21Å; Q201-S204 PolarHBondContact O-N 3.28Å; Q201-S204 PolarHBondContact O-OG 3.42Å; T202-S204 PolarHBondContact O-N 3.47Å; S204-R207 PolarHBondContact O-N 3.02Å; S204-L208 PolarHBondContact O-N 3.48Å
205L86.6Confident81Confident124 Ų124112.4 Ų112.465%0.64955%0.552SS**Hα-helixtrans-59.3-47.5173.6-111.7165.9000111.9Q201 T202 R207 L208 Q209Q201-L205 PolarHBondContact O-N 3.45Å; T202-L205 PolarHBondContact O-N 2.87Å; L205-R207 VanDerWaalsContact C-N 3.34Å; L205-R207 PolarHBondContact O-N 3.39Å; L205-L208 PolarHBondContact O-N 2.9Å; L205-Q209 PolarHBondContact O-N 3.47Å
206V85Confident79.4Confident85 Ų85115 Ų11552%0.51556%0.562SS.*Hα-helixtrans-63.5-39.6178.1172.40000111.5T202 Q203 Q209 K210T202-V206 VanDerWaalsContact O-CG2 3.32Å; T202-V206 WeakPolarHBondContact O-CG2 3.31Å; T202-V206 PolarHBondContact O-N 2.92Å; Q203-V206 PolarHBondContact O-N 2.89Å; V206-Q209 PolarHBondContact O-N 3.42Å; V206-K210 WeakPolarHBondContact O-CB 3.24Å; V206-K210 PolarHBondContact O-N 2.9Å
207R85.4Confident77.2Confident175 Ų175114.6 Ų114.666%0.6657%0.568SS**Hα-helixtrans-63.8-42.8175.4-80.6-175-175.1148.54.9112Q203 S204 L205 K210 Q211Q203-R207 WeakPolarHBondContact O-CG 3.19Å; Q203-R207 PolarHBondContact O-N 3.5Å; S204-R207 PolarHBondContact O-N 3.02Å; L205-R207 VanDerWaalsContact C-N 3.34Å; L205-R207 PolarHBondContact O-N 3.39Å; R207-K210 PolarHBondContact O-N 3.28Å; R207-Q211 PolarHBondContact O-N 3.41Å
208L83.4Confident75.3Confident100 Ų100116 Ų11652%0.52459%0.586SS.*Hα-helixtrans-64.2-43.2178.9-169.564.7000111.2S204 L205 K210 Q211 L212S204-L208 PolarHBondContact O-N 3.48Å; L205-L208 PolarHBondContact O-N 2.9Å; L208-K210 VanDerWaalsContact C-N 3.33Å; L208-K210 PolarHBondContact O-N 2.89Å; L208-Q211 PolarHBondContact O-N 3.33Å; L208-Q211 VanDerWaalsContact O-N 3.14Å; L208-L212 HydrophobicContact CG-CD1 4.26Å; L208-L212 PolarHBondContact O-N 2.78Å
209Q79.6Confident73.1Confident117 Ų117114.5 Ų114.555%0.54759%0.594SS.*Hα-helixtrans-57.9-45.4174-174.9-178.2-100111.7L205 V206 Q211 L212 E213L205-Q209 PolarHBondContact O-N 3.47Å; V206-Q209 PolarHBondContact O-N 3.42Å; Q209-Q211 PolarHBondContact O-N 3.05Å; Q209-L212 PolarHBondContact O-N 2.98Å; Q209-E213 PolarHBondContact O-N 3.49Å
210K78.3Confident70.7Confident117 Ų117118.5 Ų118.551%0.50961%0.613SS.*Hα-helixtrans-67.5-24.3178.9-163.1175.8-176.6172.20113.3V206 R207 L208 R214V206-K210 WeakPolarHBondContact O-CB 3.24Å; V206-K210 PolarHBondContact O-N 2.9Å; R207-K210 PolarHBondContact O-N 3.28Å; L208-K210 VanDerWaalsContact C-N 3.33Å; L208-K210 PolarHBondContact O-N 2.89Å; K210-R214 PolarHBondContact O-N 2.94Å
211Q76.3Confident68.2Low118 Ų118119.2 Ų119.255%0.55162%0.622SS**Hα-helixtrans-76.5-44.5173.7-171.7172-28.500110.8R207 L208 Q209 E213 R214 D215R207-Q211 PolarHBondContact O-N 3.41Å; L208-Q211 PolarHBondContact O-N 3.33Å; L208-Q211 VanDerWaalsContact O-N 3.14Å; Q209-Q211 PolarHBondContact O-N 3.05Å; Q211-E213 VanDerWaalsContact C-N 3.31Å; Q211-E213 PolarHBondContact O-N 3.36Å; Q211-R214 PolarHBondContact O-N 2.94Å; Q211-D215 PolarHBondContact O-N 3.04Å; Q211-D215 VanDerWaalsContact O-N 3.16Å
212L70.3Confident66.9Low102 Ų102117.9 Ų117.953%0.53462%0.624SS.*Hα-helixtrans-57.4-41172.9-84.5145.9000112.4L208 Q209 R214 D215 L216L208-L212 HydrophobicContact CG-CD1 4.26Å; L208-L212 PolarHBondContact O-N 2.78Å; Q209-L212 PolarHBondContact O-N 2.98Å; L212-R214 VanDerWaalsContact C-N 3.29Å; L212-R214 PolarHBondContact O-N 3.48Å; L212-D215 PolarHBondContact O-N 2.95Å; L212-L216 WeakPolarHBondContact O-CD1 3.35Å
213E63.3Low64.4Low127 Ų127122.5 Ų122.559%0.59364%0.641SS**Hα-helixtrans-67.3-26.3175.9-74.5-169.5169.100113.7Q209 Q211Q209-E213 PolarHBondContact O-N 3.49Å; Q211-E213 VanDerWaalsContact C-N 3.31Å; Q211-E213 PolarHBondContact O-N 3.36Å
214R60.8Low61.9Low162 Ų162123 Ų12361%0.61165%0.65SS**Hα-helixtrans-77.8-33.1176-79.6-169.5177.7107.8-11.3113K210 Q211 L212 L216K210-R214 PolarHBondContact O-N 2.94Å; Q211-R214 PolarHBondContact O-N 2.94Å; L212-R214 VanDerWaalsContact C-N 3.29Å; L212-R214 PolarHBondContact O-N 3.48Å; R214-L216 PolarHBondContact O-N 3.32Å
215D57.2Low59.5Low130 Ų130128.1 Ų128.170%0.69567%0.672SS**Hα-helixtrans-74.8-11.8179.9-70.2-19.9000113Q211 L212Q211-D215 PolarHBondContact O-N 3.04Å; Q211-D215 VanDerWaalsContact O-N 3.16Å; L212-D215 PolarHBondContact O-N 2.95Å
216L56.9Low57Low139 Ų139126.4 Ų126.473%0.72868%0.675SS**THydrogen-bonded Turntrans-97.413.9-177.8-96.6135.3000115.4L212 R214L212-L216 WeakPolarHBondContact O-CD1 3.35Å; R214-L216 PolarHBondContact O-N 3.32Å
217T45Very low55.4Low112 Ų112128.3 Ų128.369%0.68769%0.689SS**  trans-126.8116.8176.556.80000114.1
218P46.6Very low52.9Low132 Ų132124.1 Ų124.186%0.85769%0.692SS**  trans-111.5155.8147.822.9-5.7000111.9
219A41.9Very low51Low91 Ų91125.7 Ų125.775%0.75271%0.706SS**  trans-79.7162.5-163.400000117.1
220H37.6Very low49.6Very low191 Ų191125.9 Ų125.988%0.88472%0.717SS**  trans94.1131.7150.9-79.7-0.8000122.5
221S35.1Very low47.9Very low103 Ų103126.2 Ų126.272%0.7273%0.731SS**  trans-78.3-173.318050.80000114.4
222P57.8Low46Very low104 Ų104124.6 Ų124.668%0.67574%0.738SS**  cis-144.4-174.4940.2-17.8000118
223Q33.9Very low44.6Very low179 Ų179124.7 Ų124.784%0.83675%0.745SS**  trans80.3142.7160.2-69.2-162.931.900118.3
224V34.3Very low43.5Very low110 Ų110124.9 Ų124.967%0.66776%0.755SS**  cis-166.4154.813.9125.90000111.5
225L35.2Very low42.4Very low173 Ų173125.2 Ų125.291%0.90676%0.763SS**  trans67.1138.7159.7-110.761.5000123.8
226A33.6Very low41.5Very low87 Ų87126.7 Ų126.772%0.71977%0.766SS**  trans-95.9-156.6-16900000113.2
227P51.5Low40.7Very low125 Ų125124.3 Ų124.381%0.81277%0.766SS**  cis-125.5172.6-49.624.7-4.5000112.6
228A33.1Very low40.4Very low87 Ų87123.9 Ų123.972%0.71976%0.763SS**  trans132.7128.4142.100000116
229T43.4Very low40Very low133 Ų133123.5 Ų123.582%0.81676%0.758SS**  trans71.8140.7158.259.40000121.2
230P49.4Very low40.2Very low121 Ų121125.5 Ų125.579%0.78676%0.755SS**PPolyproline II helixtrans-90.9141.9-170.435.9-31.1000112
231P43.9Very low40.2Very low125 Ų125121.9 Ų121.981%0.81275%0.746SS**PPolyproline II helixtrans-95.4133158.932.7-24.2000110.4
232A34.8Very low40.6Very low84 Ų84122.3 Ų122.369%0.69475%0.746SS**PPolyproline II helixtrans-54.2150.3176.800000113.6T234A232-T234 PolarHBondContact O-N 3.41Å
233P42.1Very low39.6Very low103 Ų103121.8 Ų121.867%0.66975%0.75SS**  trans-75.1108.116730.8-30000109H235P233-H235 PolarHBondContact O-N 2.85Å
234T40.3Very low40.2Very low132 Ų132119 Ų11981%0.8175%0.748SS**  trans-71.975.5161.726.50000109.3A232 H236A232-T234 PolarHBondContact O-N 3.41Å; T234-H236 VanDerWaalsContact C-N 3.32Å; T234-H236 PolarHBondContact O-N 2.88Å; T234-H236 PolarHBondContact O-ND1 3.15Å
235H37.4Very low40.3Very low168 Ų168118.5 Ų118.578%0.77876%0.756SS**  trans-61.399.1152.8-73.5-84.9000107.2P233 A237P233-H235 PolarHBondContact O-N 2.85Å; H235-A237 PolarHBondContact O-N 2.99Å
236H38.8Very low40.4Very low162 Ų162119.5 Ų119.575%0.7576%0.756SS**  trans-69.7109.1156.240.3-77.9000106T234 T238T234-H236 VanDerWaalsContact C-N 3.32Å; T234-H236 PolarHBondContact O-N 2.88Å; T234-H236 PolarHBondContact O-ND1 3.15Å; H236-T238 VanDerWaalsContact C-N 3.29Å; H236-T238 PolarHBondContact O-N 2.89Å
237A38.4Very low40.7Very low88 Ų88120.7 Ų120.773%0.72775%0.754SS**  trans-63.692.2167.800000108.3H235 V239H235-A237 PolarHBondContact O-N 2.99Å; A237-V239 VanDerWaalsContact C-N 3.28Å; A237-V239 PolarHBondContact O-N 3.37Å
238T39Very low40.3Very low103 Ų103120.7 Ų120.763%0.63275%0.754SS**  trans-71.496.6157.4-44.80000105.9H236 I240H236-T238 VanDerWaalsContact C-N 3.29Å; H236-T238 PolarHBondContact O-N 2.89Å; T238-I240 HydrophobicContact CG2-CD1 3.97Å; T238-I240 HydrophobicContact CG2-CG1 3.54Å; T238-I240 PolarHBondContact O-N 3.15Å
239V39.3Very low40.4Very low124 Ų124124.1 Ų124.175%0.75276%0.755SS**  trans-67.284.6164.7176.80000106.7A237 V241A237-V239 VanDerWaalsContact C-N 3.28Å; A237-V239 PolarHBondContact O-N 3.37Å; V239-V241 HydrophobicContact CG1-CG2 4.03Å
240I45.2Very low40.4Very low133 Ų133122.4 Ų122.468%0.68275%0.746SS**  trans-90.6102.3159.6-57.1-175.7000105.2T238 P242T238-I240 HydrophobicContact CG2-CD1 3.97Å; T238-I240 HydrophobicContact CG2-CG1 3.54Å; T238-I240 PolarHBondContact O-N 3.15Å; I240-P242 VanDerWaalsContact O-CD 3.3Å; I240-P242 WeakPolarHBondContact O-CD 3.37Å
241V38.6Very low40.1Very low116 Ų116126.1 Ų126.170%0.70375%0.753SS**PPolyproline II helixtrans-64.4119.8166.5176.40000107.3V239 A243V239-V241 HydrophobicContact CG1-CG2 4.03Å; V241-A243 PolarHBondContact O-N 3.37Å
242P42.4Very low39.8Very low112 Ų112127.5 Ų127.573%0.72775%0.748SS**PPolyproline II helixtrans-71.3120172.1-11.627.7000108.8I240I240-P242 VanDerWaalsContact O-CD 3.3Å; I240-P242 WeakPolarHBondContact O-CD 3.37Å
243A38.1Very low40Very low92 Ų92129.9 Ų129.976%0.7675%0.753SS**PPolyproline II helixtrans-68.1130.7166.400000109.4V241 A245V241-A243 PolarHBondContact O-N 3.37Å; A243-A245 PolarHBondContact O-N 2.97Å
244P45Very low40Very low120 Ų120130.3 Ų130.378%0.77975%0.754SS**PPolyproline II helixtrans-74.1125.4172.827.2-29.1000110.2Q246P244-Q246 PolarHBondContact O-N 3.39Å
245A37Very low40.1Very low101 Ų101129.6 Ų129.684%0.83575%0.75SS**PPolyproline II helixtrans-65.2126.5171.600000110.4A243A243-A245 PolarHBondContact O-N 2.97Å
246Q38Very low40.4Very low194 Ų194127 Ų12791%0.90775%0.745SS**PPolyproline II helixtrans-84.6123.8174.8-66.1179.932.600110.1P244P244-Q246 PolarHBondContact O-N 3.39Å
247T38.9Very low40.8Very low111 Ų111125.1 Ų125.168%0.68175%0.745SS**PPolyproline II helixtrans-79.6147.416349.20000110.6
248P43.6Very low41.3Very low126 Ų126127.6 Ų127.682%0.81874%0.743SS**PPolyproline II helixtrans-75.7129.1-179.830.8-31.2000110.8
249Q35.6Very low41.7Very low159 Ų159123.9 Ų123.974%0.74373%0.726SS**  trans-113.8140175-75.4-73.8-33.200110.5
250P41.7Very low42.4Very low96 Ų96123.4 Ų123.462%0.62373%0.725SS**  trans-75.5159.3179.233.2-32.6000111.4H252P250-H252 PolarHBondContact O-N 3.14Å
251H44.7Very low42.5Very low200 Ų200122.2 Ų122.293%0.92672%0.724SS**  trans-47.2115.9-178.6-54.2-82000112.9
252H36Very low43Very low154 Ų154119.6 Ų119.671%0.71371%0.712SS**  trans-115.9122.7163.465.3-84.1000109.7P250P250-H252 PolarHBondContact O-N 3.14Å
253V40.8Very low43.5Very low133 Ų133118.4 Ų118.481%0.80670%0.702SS**  trans-67.2122.7166.21710000107.6V255V253-V255 HydrophobicContact CG1-CG2 4.34Å; V253-V255 PolarHBondContact O-N 3.35Å; V253-V255 VanDerWaalsContact O-N 3.1Å
254T40.2Very low44.2Very low112 Ų112119.3 Ų119.369%0.68769%0.693SS**  trans-78.892.9175.7-37.10000109.8
255V43.8Very low44.5Very low118 Ų118119.3 Ų119.372%0.71569%0.686SS**  trans-79.5114.5158.2-1790000107V253 T257V253-V255 HydrophobicContact CG1-CG2 4.34Å; V253-V255 PolarHBondContact O-N 3.35Å; V253-V255 VanDerWaalsContact O-N 3.1Å; V255-T257 PolarHBondContact O-N 3.33Å
256V43.8Very low45.5Very low112 Ų112117.4 Ų117.468%0.67967%0.667SS**  trans-71.992.5174.9-178.50000108.4M258V256-M258 HydrophobicContact CG1-CG 4.36Å; V256-M258 HydrophobicContact CG1-SD 4.06Å
257T46.4Very low46.5Very low123 Ų123112.5 Ų112.576%0.75565%0.65SS**  trans-85.7117.2159.2-100.20000107.6V255 G259V255-T257 PolarHBondContact O-N 3.33Å; T257-G259 PolarHBondContact O-N 2.92Å; T257-G259 VanDerWaalsContact O-N 3.14Å
258M48.2Very low47.8Very low140 Ų140110.7 Ų110.769%0.6964%0.642SS**  trans-73.2102.8177.7-70-70.4-77.300109.3V256V256-M258 HydrophobicContact CG1-CG 4.36Å; V256-M258 HydrophobicContact CG1-SD 4.06Å
259G47.5Very low49.1Very low26 Ų26108.1 Ų108.127%0.26862%0.624SS.*  trans-74154.5168.300000112.2T257 T261 S262T257-G259 PolarHBondContact O-N 2.92Å; T257-G259 VanDerWaalsContact O-N 3.14Å; G259-T261 PolarHBondContact O-N 2.88Å; G259-S262 PolarHBondContact O-N 3.45Å
260P55.3Low51.2Low113 Ų113103.3 Ų103.373%0.73461%0.608SS**THydrogen-bonded Turntrans-66-11.5-172.325.2-33.7000114.9
261T46.7Very low53.1Low108 Ų108107.2 Ų107.266%0.66361%0.61SS**THydrogen-bonded Turntrans-75.3-24.1176.123.90000113.7G259 V263 I264G259-T261 PolarHBondContact O-N 2.88Å; T261-V263 VanDerWaalsContact C-N 3.27Å; T261-V263 PolarHBondContact O-N 3.15Å; T261-I264 PolarHBondContact O-N 2.82Å
262S49.3Very low54.8Low62 Ų62103.8 Ų103.843%0.43459%0.594SS.*Hα-helixtrans-71.7-21.1179.3-60.10000113.4G259 I264G259-S262 PolarHBondContact O-N 3.45Å; S262-I264 VanDerWaalsContact C-N 3.31Å
263V52.8Low57Low87 Ų87101.1 Ų101.153%0.52759%0.586SS.*Hα-helixtrans-75.4-23.5-178.5-153.10000111.7T261 S266 V267T261-V263 VanDerWaalsContact C-N 3.27Å; T261-V263 PolarHBondContact O-N 3.15Å; V263-S266 PolarHBondContact O-OG 3.05Å; V263-V267 WeakPolarHBondContact O-CG2 3.34Å
264I52.7Low59.4Low111 Ų11199.5 Ų99.557%0.56957%0.572SS**Hα-helixtrans-75.9-37.2-177.9-50.1176.4000110.4T261 S262 S268T261-I264 PolarHBondContact O-N 2.82Å; S262-I264 VanDerWaalsContact C-N 3.31Å; I264-S268 PolarHBondContact O-N 2.75Å; I264-S268 PolarHBondContact O-OG 3.37Å
265N52.4Low61.7Low119 Ų11998.8 Ų98.864%0.63656%0.564SS**Hα-helixtrans-74.8-28.7178.7-92.627000113.9T269N265-T269 PolarHBondContact O-N 2.93Å; N265-T269 VanDerWaalsContact O-N 3.13Å; N265-T269 PolarHBondContact O-OG1 3.4Å
266S56.7Low63.9Low61 Ų6197.1 Ų97.143%0.42755%0.554SS.*Hα-helixtrans-70.2-34.9175.563.80000111.8V263 T269 S270V263-S266 PolarHBondContact O-OG 3.05Å; S266-T269 WeakPolarHBondContact CA-OG1 3.42Å; S266-T269 PolarHBondContact O-OG1 3.13Å; S266-S270 WeakPolarHBondContact O-CB 3.35Å; S266-S270 PolarHBondContact O-N 2.92Å
267V60Low66Low91 Ų9196.3 Ų96.355%0.55255%0.545SS*.Hα-helixtrans-67.4-43.6174.7177.10000110.8V263 S270 R271V263-V267 WeakPolarHBondContact O-CG2 3.34Å; V267-S270 PolarHBondContact O-N 3.39Å; V267-R271 VanDerWaalsContact O-CB 3.27Å; V267-R271 WeakPolarHBondContact O-CB 3.41Å; V267-R271 PolarHBondContact O-N 2.88Å
268S65.1Low68.2Low73 Ų7394.4 Ų94.451%0.5153%0.533SS..Hα-helixtrans-63.8-41.9178.6-62.60000113.1I264 Q272I264-S268 PolarHBondContact O-N 2.75Å; I264-S268 PolarHBondContact O-OG 3.37Å; S268-Q272 PolarHBondContact O-N 3.44Å; S268-Q272 VanDerWaalsContact O-N 3.11Å
269T71.9Confident70.1Confident72 Ų7293.7 Ų93.744%0.44253%0.528SS..Hα-helixtrans-72.6-39.1177.345.70000112.2N265 S266 R271 Q272 N273N265-T269 PolarHBondContact O-N 2.93Å; N265-T269 VanDerWaalsContact O-N 3.13Å; N265-T269 PolarHBondContact O-OG1 3.4Å; S266-T269 WeakPolarHBondContact CA-OG1 3.42Å; S266-T269 PolarHBondContact O-OG1 3.13Å; T269-R271 VanDerWaalsContact C-N 3.32Å; T269-R271 PolarHBondContact O-N 3.42Å; T269-Q272 PolarHBondContact O-N 2.89Å; T269-N273 WeakPolarHBondContact O-CB 3.39Å; T269-N273 PolarHBondContact O-N 2.94Å; T269-N273 PolarHBondContact O-ND2 2.94Å
270S79.9Confident71.9Confident59 Ų5994.9 Ų94.941%0.41354%0.535SS..Hα-helixtrans-59.8-42172.8177.60000111.9S266 V267 N273 L274S266-S270 WeakPolarHBondContact O-CB 3.35Å; S266-S270 PolarHBondContact O-N 2.92Å; V267-S270 PolarHBondContact O-N 3.39Å; S270-N273 PolarHBondContact O-N 2.98Å; S270-L274 WeakPolarHBondContact O-CB 3.31Å; S270-L274 WeakPolarHBondContact O-CG 3.42Å; S270-L274 PolarHBondContact O-N 3.04Å
271R80.8Confident73.3Confident177 Ų17793.4 Ų93.467%0.66852%0.52SS*.Hα-helixtrans-65.7-41.9178.2-158.3167.9-177.5-114.10.4112.1V267 T269 L274 D275V267-R271 VanDerWaalsContact O-CB 3.27Å; V267-R271 WeakPolarHBondContact O-CB 3.41Å; V267-R271 PolarHBondContact O-N 2.88Å; T269-R271 VanDerWaalsContact C-N 3.32Å; T269-R271 PolarHBondContact O-N 3.42Å; R271-L274 PolarHBondContact O-N 3.23Å; R271-D275 PolarHBondContact O-N 3.27Å
272Q81.3Confident75.1Confident128 Ų12894.4 Ų94.460%0.59852%0.518SS*.Hα-helixtrans-64.1-39.7174.4-172.3176.38.600112.6S268 T269 D275 T276S268-Q272 PolarHBondContact O-N 3.44Å; S268-Q272 VanDerWaalsContact O-N 3.11Å; T269-Q272 PolarHBondContact O-N 2.89Å; Q272-D275 PolarHBondContact O-N 2.95Å; Q272-T276 PolarHBondContact O-N 3.33Å; Q272-T276 PolarHBondContact O-OG1 3.43Å
273N82.3Confident76.5Confident99 Ų9998.4 Ų98.453%0.52953%0.529SS..Hα-helixtrans-66.2-41.8176.4-67.4-21.5000111.5T269 S270 T276 I277T269-N273 WeakPolarHBondContact O-CB 3.39Å; T269-N273 PolarHBondContact O-N 2.94Å; T269-N273 PolarHBondContact O-ND2 2.94Å; S270-N273 PolarHBondContact O-N 2.98Å; N273-T276 PolarHBondContact O-N 3.28Å; N273-I277 VanDerWaalsContact O-CG1 3.31Å; N273-I277 WeakPolarHBondContact O-CG1 3.35Å; N273-I277 PolarHBondContact O-N 3.23Å
274L91.4Very high77.7Confident99 Ų9999.2 Ų99.252%0.51853%0.529SS..Hα-helixtrans-63-45.6175.2-74.6168.8000111.6S270 R271 T276 I277 V278S270-L274 WeakPolarHBondContact O-CB 3.31Å; S270-L274 WeakPolarHBondContact O-CG 3.42Å; S270-L274 PolarHBondContact O-N 3.04Å; R271-L274 PolarHBondContact O-N 3.23Å; L274-T276 VanDerWaalsContact C-N 3.26Å; L274-T276 PolarHBondContact O-N 2.91Å; L274-I277 PolarHBondContact O-N 2.84Å; L274-I277 VanDerWaalsContact O-N 3.15Å; L274-V278 WeakPolarHBondContact O-CG2 3.38Å; L274-V278 PolarHBondContact O-N 2.93Å
275D88.6Confident78.9Confident96 Ų96100.2 Ų100.251%0.51353%0.532SS..Hα-helixtrans-60.1-38176.8-78.2-10.6000111.8R271 Q272 V278 Q279R271-D275 PolarHBondContact O-N 3.27Å; Q272-D275 PolarHBondContact O-N 2.95Å; D275-V278 PolarHBondContact O-N 3.08Å; D275-Q279 WeakPolarHBondContact O-CB 3.37Å; D275-Q279 PolarHBondContact O-N 2.73Å
276T89.6Confident79.4Confident83 Ų8397.1 Ų97.151%0.50953%0.527SS..Hα-helixtrans-65.3-42.1176.4-54.90000111.6Q272 N273 L274 A280Q272-T276 PolarHBondContact O-N 3.33Å; Q272-T276 PolarHBondContact O-OG1 3.43Å; N273-T276 PolarHBondContact O-N 3.28Å; L274-T276 VanDerWaalsContact C-N 3.26Å; L274-T276 PolarHBondContact O-N 2.91Å; T276-A280 WeakPolarHBondContact O-CB 3.28Å; T276-A280 PolarHBondContact O-N 3.45Å
277I88.2Confident79.4Confident96 Ų9699 Ų9949%0.49254%0.536SS..Hα-helixtrans-66.3-44.3176.9-67.1164.3000110.5N273 L274 A280 I281N273-I277 VanDerWaalsContact O-CG1 3.31Å; N273-I277 WeakPolarHBondContact O-CG1 3.35Å; N273-I277 PolarHBondContact O-N 3.23Å; L274-I277 PolarHBondContact O-N 2.84Å; L274-I277 VanDerWaalsContact O-N 3.15Å; I277-A280 PolarHBondContact O-N 2.72Å; I277-I281 HydrophobicContact CG2-CD1 3.89Å; I277-I281 WeakPolarHBondContact O-CG1 3.24Å; I277-I281 PolarHBondContact O-N 3.43Å
278V92.4Very high79.1Confident82 Ų8299.5 Ų99.550%0.49753%0.533SS..Hα-helixtrans-62.1-45.6178.6171.30000111L274 D275 A280 I281 Q282L274-V278 WeakPolarHBondContact O-CG2 3.38Å; L274-V278 PolarHBondContact O-N 2.93Å; D275-V278 PolarHBondContact O-N 3.08Å; V278-A280 VanDerWaalsContact C-N 3.33Å; V278-A280 PolarHBondContact O-N 2.77Å; V278-I281 PolarHBondContact O-N 3.49Å; V278-Q282 WeakPolarHBondContact O-CB 3.3Å; V278-Q282 PolarHBondContact O-N 3.35Å
279Q87.4Confident78.6Confident126 Ų12698.5 Ų98.559%0.58953%0.534SS*.Hα-helixtrans-60.6-40.9174.7-84.1-1780.500112.4D275 Q282 H283D275-Q279 WeakPolarHBondContact O-CB 3.37Å; D275-Q279 PolarHBondContact O-N 2.73Å; Q279-Q282 PolarHBondContact O-N 3.01Å; Q279-H283 WeakPolarHBondContact O-CB 3.49Å; Q279-H283 PolarHBondContact O-CD2 3.26Å; Q279-H283 VanDerWaalsContact O-CD2 3.27Å; Q279-H283 PolarHBondContact O-N 3.28Å
280A85.9Confident77.6Confident51 Ų51103.4 Ų103.442%0.42155%0.549SS..Hα-helixtrans-63.9-43.1178.300000112T276 I277 V278 H283 I284T276-A280 WeakPolarHBondContact O-CB 3.28Å; T276-A280 PolarHBondContact O-N 3.45Å; I277-A280 PolarHBondContact O-N 2.72Å; V278-A280 VanDerWaalsContact C-N 3.33Å; V278-A280 PolarHBondContact O-N 2.77Å; A280-H283 PolarHBondContact O-N 3.09Å; A280-I284 WeakPolarHBondContact O-CD1 3.47Å; A280-I284 VanDerWaalsContact O-CG1 3.24Å; A280-I284 WeakPolarHBondContact O-CG1 3.32Å; A280-I284 PolarHBondContact O-N 2.84Å; A280-I284 VanDerWaalsContact O-N 3.09Å
281I84.2Confident76.1Confident81 Ų81102.3 Ų102.342%0.41555%0.548SS..Hα-helixtrans-63.5-46.2175.9-66.5168000110.2I277 V278 H283 I284 E285I277-I281 HydrophobicContact CG2-CD1 3.89Å; I277-I281 WeakPolarHBondContact O-CG1 3.24Å; I277-I281 PolarHBondContact O-N 3.43Å; V278-I281 PolarHBondContact O-N 3.49Å; I281-H283 VanDerWaalsContact C-N 3.3Å; I281-H283 PolarHBondContact O-N 3.08Å; I281-I284 PolarHBondContact O-N 3.28Å; I281-I284 VanDerWaalsContact O-N 3.08Å; I281-E285 HydrophobicContact CG2-CG 4.2Å; I281-E285 WeakPolarHBondContact CG2-OE1 3.28Å; I281-E285 WeakPolarHBondContact O-CG 3.4Å; I281-E285 PolarHBondContact O-N 3.35Å
282Q83.3Confident74.5Confident130 Ų130100 Ų10061%0.60754%0.542SS*.Hα-helixtrans-64.6-33.5-179.8-161.7164.529.300112.9V278 Q279 G286V278-Q282 WeakPolarHBondContact O-CB 3.3Å; V278-Q282 PolarHBondContact O-N 3.35Å; Q279-Q282 PolarHBondContact O-N 3.01Å; Q282-G286 PolarHBondContact O-N 2.87Å
283H79Confident73.1Confident145 Ų145100.2 Ų100.267%0.67154%0.544SS*.Hα-helixtrans-67.3-38.7171.6-92.9-114.9000112.7Q279 A280 I281 T287Q279-H283 WeakPolarHBondContact O-CB 3.49Å; Q279-H283 PolarHBondContact O-CD2 3.26Å; Q279-H283 VanDerWaalsContact O-CD2 3.27Å; Q279-H283 PolarHBondContact O-N 3.28Å; A280-H283 PolarHBondContact O-N 3.09Å; I281-H283 VanDerWaalsContact C-N 3.3Å; I281-H283 PolarHBondContact O-N 3.08Å; H283-T287 PolarHBondContact O-N 2.66Å; H283-T287 VanDerWaalsContact O-N 3.1Å; H283-T287 PolarHBondContact O-OG1 3.1Å
284I78.7Confident71.7Confident104 Ų104102.2 Ų102.253%0.53355%0.55SS..Hα-helixtrans-69.5-46.8177.4-68164000109.8A280 I281 G286 T287 Q288A280-I284 WeakPolarHBondContact O-CD1 3.47Å; A280-I284 VanDerWaalsContact O-CG1 3.24Å; A280-I284 WeakPolarHBondContact O-CG1 3.32Å; A280-I284 PolarHBondContact O-N 2.84Å; A280-I284 VanDerWaalsContact O-N 3.09Å; I281-I284 PolarHBondContact O-N 3.28Å; I281-I284 VanDerWaalsContact O-N 3.08Å; I284-G286 VanDerWaalsContact C-N 3.33Å; I284-G286 PolarHBondContact O-N 3.11Å; I284-T287 PolarHBondContact O-N 3.3Å; I284-T287 PolarHBondContact O-OG1 3.06Å; I284-T287 VanDerWaalsContact O-OG1 3.11Å; I284-Q288 VanDerWaalsContact O-CG 3.28Å; I284-Q288 WeakPolarHBondContact O-CG 3.43Å; I284-Q288 PolarHBondContact O-N 3.45Å
285E76.9Confident70Confident133 Ų133104.7 Ų104.762%0.62156%0.559SS**Hα-helixtrans-67.6-34.2178.3-67.8177.8169.100111.9I281 Q288 G289I281-E285 HydrophobicContact CG2-CG 4.2Å; I281-E285 WeakPolarHBondContact CG2-OE1 3.28Å; I281-E285 WeakPolarHBondContact O-CG 3.4Å; I281-E285 PolarHBondContact O-N 3.35Å; E285-Q288 PolarHBondContact O-N 3.4Å; E285-G289 PolarHBondContact O-N 3.47Å
286G64.5Low68.3Low53 Ų53106 Ų10655%0.54656%0.561SS.*Hα-helixtrans-69.9-29174.500000114.5Q282 I284Q282-G286 PolarHBondContact O-N 2.87Å; I284-G286 VanDerWaalsContact C-N 3.33Å; I284-G286 PolarHBondContact O-N 3.11Å
287T54.9Low66.7Low100 Ų100110.8 Ų110.861%0.61357%0.57SS**Hα-helixtrans-81.8-30.6173.830.70000112.5H283 I284 G289 K290 G291H283-T287 PolarHBondContact O-N 2.66Å; H283-T287 VanDerWaalsContact O-N 3.1Å; H283-T287 PolarHBondContact O-OG1 3.1Å; I284-T287 PolarHBondContact O-N 3.3Å; I284-T287 PolarHBondContact O-OG1 3.06Å; I284-T287 VanDerWaalsContact O-OG1 3.11Å; T287-G289 VanDerWaalsContact C-N 3.32Å; T287-G289 PolarHBondContact O-N 3.25Å; T287-K290 PolarHBondContact O-N 3.39Å; T287-G291 PolarHBondContact O-N 3.42Å
288Q55.6Low65.1Low102 Ų102115.6 Ų115.648%0.47758%0.582SS.*Hα-helixtrans-67.3-28.7175.9-68.3-69.833.200113.6I284 E285 K290 F292I284-Q288 VanDerWaalsContact O-CG 3.28Å; I284-Q288 WeakPolarHBondContact O-CG 3.43Å; I284-Q288 PolarHBondContact O-N 3.45Å; E285-Q288 PolarHBondContact O-N 3.4Å; Q288-K290 VanDerWaalsContact C-N 3.33Å; Q288-K290 PolarHBondContact O-N 3.42Å; Q288-F292 HydrophobicContact CB-CD2 4.37Å; Q288-F292 WeakPolarHBondContact O-CD2 3.44Å; Q288-F292 VanDerWaalsContact OE1-CD2 3.29Å
289G53.5Low63.2Low52 Ų52114.4 Ų114.454%0.53658%0.581SS.*Hα-helixtrans-70.2-20.817800000115.5E285 T287E285-G289 PolarHBondContact O-N 3.47Å; T287-G289 VanDerWaalsContact C-N 3.32Å; T287-G289 PolarHBondContact O-N 3.25Å
290K50.8Low61.3Low175 Ų175113.7 Ų113.776%0.76159%0.585SS**Hα-helixtrans-108.1-26.8-179.9-76.8-171174.5-176.80114.3T287 Q288T287-K290 PolarHBondContact O-N 3.39Å; Q288-K290 VanDerWaalsContact C-N 3.33Å; Q288-K290 PolarHBondContact O-N 3.42Å
291G48.1Very low59.6Low37 Ų37118.2 Ų118.238%0.38160%0.6SS.*Hα-helixtrans-75.3-36.4179.200000114T287 E294 E295T287-G291 PolarHBondContact O-N 3.42Å; G291-E294 PolarHBondContact O-N 3.45Å; G291-E295 WeakPolarHBondContact O-CB 3.28Å; G291-E295 PolarHBondContact O-N 3.47Å; G291-E295 VanDerWaalsContact O-N 3.17Å
292F47.4Very low58Low127 Ų127120.2 Ų120.256%0.55762%0.616SS**Hα-helixtrans-70.5-35.6-175.9-91.7-79.3000113.6Q288 Q296Q288-F292 HydrophobicContact CB-CD2 4.37Å; Q288-F292 WeakPolarHBondContact O-CD2 3.44Å; Q288-F292 VanDerWaalsContact OE1-CD2 3.29Å; F292-Q296 WeakPolarHBondContact O-CB 3.37Å; F292-Q296 PolarHBondContact O-N 3.13Å; F292-Q296 VanDerWaalsContact O-N 3.13Å
293E52.4Low56.3Low134 Ų134119.1 Ų119.163%0.62662%0.623SS**Hα-helixtrans-70.9-31.2178.1-73.6-166.3149.900113R297E293-R297 VanDerWaalsContact O-CG 3.28Å; E293-R297 WeakPolarHBondContact O-CG 3.47Å; E293-R297 PolarHBondContact O-N 3.17Å
294E53.9Low54.3Low141 Ų141118 Ų11866%0.65963%0.631SS**Hα-helixtrans-81.4-33.6-178.2-156.8168.2-169.400111.8G291 R298G291-E294 PolarHBondContact O-N 3.45Å; E294-R298 PolarHBondContact O-N 3.22Å
295E54.3Low52.3Low150 Ų150116.4 Ų116.470%0.70164%0.641SS**Hα-helixtrans-74.9-37.4176-165.1129.6-141.500112.2G291 R297 R298 A299G291-E295 WeakPolarHBondContact O-CB 3.28Å; G291-E295 PolarHBondContact O-N 3.47Å; G291-E295 VanDerWaalsContact O-N 3.17Å; E295-R297 VanDerWaalsContact C-N 3.34Å; E295-R297 PolarHBondContact O-N 3.46Å; E295-R298 PolarHBondContact O-N 3.42Å; E295-A299 PolarHBondContact O-N 3.48Å; E295-A299 VanDerWaalsContact O-N 3.17Å
296Q52.8Low50.3Low123 Ų123122.1 Ų122.158%0.57566%0.657SS**Hα-helixtrans-66.1-34.3175.8-149.283.748.400112.3F292 R298 A299 V300F292-Q296 WeakPolarHBondContact O-CB 3.37Å; F292-Q296 PolarHBondContact O-N 3.13Å; F292-Q296 VanDerWaalsContact O-N 3.13Å; Q296-R298 VanDerWaalsContact C-N 3.31Å; Q296-R298 PolarHBondContact O-N 3.17Å; Q296-A299 PolarHBondContact O-N 3.41Å; Q296-V300 WeakPolarHBondContact O-CG2 3.37Å; Q296-V300 PolarHBondContact O-N 3.42Å
297R56.1Low49.2Very low184 Ų184126.7 Ų126.769%0.69467%0.667SS**Hα-helixtrans-70.4-23.9176.1-73.3175.7-171.7-112.13.4113.4E293 E295E293-R297 VanDerWaalsContact O-CG 3.28Å; E293-R297 WeakPolarHBondContact O-CG 3.47Å; E293-R297 PolarHBondContact O-N 3.17Å; E295-R297 VanDerWaalsContact C-N 3.34Å; E295-R297 PolarHBondContact O-N 3.46Å
298R56Low48.4Very low198 Ų198129 Ų12975%0.74768%0.675SS**Hα-helixtrans-82.6-31.2174.1-76.7-176.5168.5-120.5-0.3112.9E294 E295 Q296E294-R298 PolarHBondContact O-N 3.22Å; E295-R298 PolarHBondContact O-N 3.42Å; Q296-R298 VanDerWaalsContact C-N 3.31Å; Q296-R298 PolarHBondContact O-N 3.17Å
299A51.3Low47.7Very low56 Ų56129 Ų12946%0.46369%0.686SS.*Hα-helixtrans-74.6-29.3-179.500000113.9E295 Q296 I301E295-A299 PolarHBondContact O-N 3.48Å; E295-A299 VanDerWaalsContact O-N 3.17Å; Q296-A299 PolarHBondContact O-N 3.41Å; A299-I301 VanDerWaalsContact C-N 3.31Å; A299-I301 PolarHBondContact O-N 3.37Å
300V47.6Very low46.8Very low111 Ų111134.2 Ų134.267%0.67370%0.702SS**THydrogen-bonded Turntrans-73.4-17.6-175.6171.50000113.6Q296Q296-V300 WeakPolarHBondContact O-CG2 3.37Å; Q296-V300 PolarHBondContact O-N 3.42Å
301I49.7Very low46.4Very low146 Ų146130 Ų13075%0.74970%0.7SS**THydrogen-bonded Turntrans-83.8-14.2-177.1-59.3175000112.4A299A299-I301 VanDerWaalsContact C-N 3.31Å; A299-I301 PolarHBondContact O-N 3.37Å
302V52.3Low46Very low124 Ų124133.5 Ų133.575%0.75273%0.725SS**SBendtrans-101.2-12.5-166.7178.60000114.8
303S45.9Very low45.6Very low106 Ų106130.7 Ų130.774%0.74173%0.732SS**  trans-108.874.4-17538.30000113.4
304S38.8Very low45.1Very low122 Ų122129.9 Ų129.985%0.85374%0.741SS**  trans-114.1112.7157.9-172.10000110.3
305G36.5Very low44.8Very low71 Ų71130.6 Ų130.673%0.73275%0.749SS**  trans108.195152.900000118.1
306R34.6Very low44.8Very low252 Ų252130.9 Ų130.995%0.95176%0.762SS**  172.6131.8106.2-101.5-178.1179.6-122.20.9112
307I41.6Very low44.4Very low149 Ų149129.6 Ų129.676%0.76477%0.772SS**  trans-81.9146.4167.5-62.2-178.6000108.6
308L36.7Very low44.1Very low149 Ų149126 Ų12678%0.7878%0.775SS**  162.4121.7126-81.7169000112.7
309S41.4Very low43.5Very low102 Ų102122.7 Ų122.771%0.71377%0.772SS**  trans30144.5138-35.20000120.3
310D34.1Very low43.3Very low161 Ų161124.4 Ų124.486%0.86178%0.781SS**  cis-171.6169.148.8-153.3-5.4000112.3
311A43.7Very low43.2Very low87 Ų87126.8 Ų126.872%0.71979%0.79SS**  trans-83.4168.6-172.600000116.3
312A39.6Very low42.8Very low110 Ų110123 Ų12391%0.90979%0.787SS**  trans135.1134.8154.500000110.7
313G37.4Very low43.3Very low69 Ų69122.8 Ų122.871%0.71179%0.788SS**  cis168.8161.53.300000108.9
314S43.5Very low43.8Very low117 Ų117126.2 Ų126.282%0.81880%0.798SS**  trans81.896.9154.8-57.50000121.4
315D47.8Very low44.3Very low155 Ų155127 Ų12783%0.82979%0.792SS**  24.7129.9112.4-62.3-29.5000120.7
316T52.5Low44.8Very low157 Ų157128.2 Ų128.296%0.96379%0.789SS**  -160.4143.3123.521.80000110.2
317A45.3Very low45.5Very low96 Ų96121.9 Ų121.979%0.79378%0.783SS**  trans-113149.2-163.600000113.2
318S49.7Very low45.5Very low107 Ų107122.3 Ų122.375%0.74879%0.786SS**  trans71.1142.5133.8-133.70000124.6
319N43.7Very low46.9Very low130 Ų130124.3 Ų124.370%0.69581%0.808SS**  trans92.5116.2156.1-84.832.5000118.4
320S47.3Very low47.1Very low92 Ų92125.4 Ų125.464%0.64381%0.812SS**  63.9132.155.4-48.70000110.5
321D45.3Very low47.8Very low161 Ų161123.5 Ų123.586%0.86181%0.81SS**  cis-152.2170.518.1-78.5-58.1000105.3
322G40.4Very low48Very low66 Ų66125.6 Ų125.668%0.6882%0.815SS**  cis171.6168.714.700000107.1
323P62.8Low48.5Very low119 Ų119126.5 Ų126.577%0.77381%0.809SS**  trans-96.4151.9179.936.4-28.3000111.3
324D56Low49.2Very low178 Ų178130.1 Ų130.195%0.95282%0.815SS**  trans-151.6157.1164.2-89.6-44.3000112.4
325D49.4Very low49.6Very low139 Ų139130.9 Ų130.974%0.74382%0.815SS**  trans-108.5171.2-143.4-170.119.2000113.3
326C47.7Very low49.7Very low97 Ų97129.2 Ų129.266%0.65581%0.814SS**  trans51.2120.9150.8-85.40000121.9
327S49.6Very low49.5Very low118 Ų118127.1 Ų127.183%0.82580%0.803SS**  163.8140.2103.5-71.90000113.6
328L41.6Very low49.9Very low158 Ų158129.7 Ų129.783%0.82780%0.804SS**  trans-63.5169.6169.4-70.7163.8000112.3
329P65Low49.9Very low191 Ų191131.7 Ų131.7100%1.2481%0.809SS**  -111.9071.5-5.926.2000115.4

Retrieved 329 of 329 residues in 335 ms (Link to these results)