A0A060CVL0_MAIZE Loading...

ZF-HD homeobox protein

Putative transcription factor.

AlphaFold DB , UniProt , Accession A0A060CVL0, Species MAIZE (Zea mays, Maize), Gene ZHD20, Length 361 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M57.6Low60.3Low239 Ų239153 Ų153100%1.17779%0.786SS**  083.60-81.2-178.517400106.9
2E51.4Low60.3Low175 Ų175153.6 Ų153.682%0.81879%0.786SS**  trans-61.5134.4179.9-77.19010100112.2
3A55Low59.9Low101 Ų101155.6 Ų155.684%0.83579%0.786SS**  trans-80.1120.2169.200000109.7D5A3-D5 PolarHBondContact O-N 3.5Å
4M62.9Low60.2Low175 Ų175153.1 Ų153.186%0.86279%0.786SS**  trans-82.8105.9175.4-69.5-167.5172.300111.1V6M4-V6 PolarHBondContact O-N 2.91Å
5D57.4Low59Low139 Ų139154.1 Ų154.174%0.74379%0.793SS**  trans-69.592171.4-174.9-111.8000110.8A3 K7A3-D5 PolarHBondContact O-N 3.5Å; D5-K7 VanDerWaalsContact C-N 3.35Å; D5-K7 PolarHBondContact O-N 3.29Å
6V65Low57.9Low130 Ų130149.1 Ų149.179%0.78879%0.792SS**  trans-80.185.9176-176.90000109.7M4 Y8M4-V6 PolarHBondContact O-N 2.91Å; V6-Y8 PolarHBondContact O-N 3.1Å
7K63.8Low57Low165 Ų165145.5 Ų145.572%0.71779%0.788SS**  trans-65.288.6-178.8-170.4155.9-169.8153.90113.5D5 K9D5-K7 VanDerWaalsContact C-N 3.35Å; D5-K7 PolarHBondContact O-N 3.29Å; K7-K9 PolarHBondContact O-N 3Å; K7-K9 VanDerWaalsContact O-N 3.14Å
8Y53.3Low56.3Low200 Ų200142.3 Ų142.378%0.78478%0.784SS**  trans-64.5109.3174.4-175.2-98.2000111.6V6 P10V6-Y8 PolarHBondContact O-N 3.1Å; Y8-P10 HydrophobicContact CE1-CB 4.25Å
9K68.1Low56Low168 Ų168145.8 Ų145.873%0.7379%0.792SS**  trans-92.1116.4169.1-72.2179.4179.2174.50109.2K7 V11K7-K9 PolarHBondContact O-N 3Å; K7-K9 VanDerWaalsContact O-N 3.14Å; K9-V11 PolarHBondContact O-N 2.93Å
10P64Low55.6Low78 Ų78148.5 Ų148.551%0.50680%0.795SS.*  trans-67.6125.4174.727.7-32.9000110Y8 M12Y8-P10 HydrophobicContact CE1-CB 4.25Å; P10-M12 HydrophobicContact CG-CE 4.34Å; P10-M12 PolarHBondContact O-N 3.14Å
11V65.2Low55.4Low113 Ų113150.9 Ų150.969%0.68580%0.798SS**  trans-70.9101.4175.6-173.80000108.7K9 F13K9-V11 PolarHBondContact O-N 2.93Å; V11-F13 HydrophobicContact CB-CE2 4.36Å; V11-F13 HydrophobicContact CG1-CE2 4.15Å; V11-F13 HydrophobicContact CG1-CZ 4.14Å; V11-F13 WeakPolarHBondContact O-CD2 3.28Å; V11-F13 PolarHBondContact O-N 2.71Å
12M60.4Low54.9Low160 Ų160143.8 Ų143.879%0.78878%0.778SS**  trans-73.9104.7173.5-73.4-70.316000109.4P10 P14P10-M12 HydrophobicContact CG-CE 4.34Å; P10-M12 PolarHBondContact O-N 3.14Å; M12-P14 WeakPolarHBondContact O-CD 3.4Å
13F54.2Low55Low180 Ų180144.9 Ų144.979%0.78978%0.78SS**PPolyproline II helixtrans-74.7121.2168.9-67.7-85.1000109.1V11 N15V11-F13 HydrophobicContact CB-CE2 4.36Å; V11-F13 HydrophobicContact CG1-CE2 4.15Å; V11-F13 HydrophobicContact CG1-CZ 4.14Å; V11-F13 WeakPolarHBondContact O-CD2 3.28Å; V11-F13 PolarHBondContact O-N 2.71Å; F13-N15 PolarHBondContact O-N 2.82Å
14P64.2Low54.9Low120 Ų120145.9 Ų145.978%0.77978%0.778SS**PPolyproline II helixtrans-65.7134.9174.627.4-33000109.6M12 G16M12-P14 WeakPolarHBondContact O-CD 3.4Å; P14-G16 PolarHBondContact O-N 3.36Å
15N43Very low54.2Low168 Ų168142.2 Ų142.290%0.89878%0.775SS**PPolyproline II helixtrans-56.1120.7180-116.9-16.3000110.3F13 A17F13-N15 PolarHBondContact O-N 2.82Å; N15-A17 PolarHBondContact O-N 2.82Å
16G40.5Very low53.3Low74 Ų74140.6 Ų140.676%0.76378%0.782SS**PPolyproline II helixtrans-58.9119.9-179.100000111.4P14P14-G16 PolarHBondContact O-N 3.36Å
17A43.9Very low52.8Low88 Ų88141 Ų14173%0.72778%0.784SS**PPolyproline II helixtrans-60.4147.6-176.100000112.5N15 F19N15-A17 PolarHBondContact O-N 2.82Å; A17-F19 PolarHBondContact O-N 2.91Å; A17-F19 VanDerWaalsContact O-N 3.12Å
18A42.8Very low52.1Low88 Ų88136.7 Ų136.773%0.72778%0.78SS**  trans-66.7108.6-170.600000113.5K20A18-K20 PolarHBondContact O-N 2.91Å
19F52.3Low51.7Low210 Ų210133.4 Ų133.492%0.92178%0.782SS**  trans-71.895.9159.7-77-77.9000109.8A17 K21A17-F19 PolarHBondContact O-N 2.91Å; A17-F19 VanDerWaalsContact O-N 3.12Å; F19-K21 VanDerWaalsContact C-N 3.3Å; F19-K21 PolarHBondContact O-N 2.93Å
20K48Very low50.9Low198 Ų198129.1 Ų129.186%0.86178%0.778SS**  trans-63.487.6170.9-63.9177.6-177.7176.50109.5A18 A22A18-K20 PolarHBondContact O-N 2.91Å; K20-A22 PolarHBondContact O-N 3.16Å; K20-A22 VanDerWaalsContact O-N 3.12Å
21K49.6Very low50.8Low199 Ų199127.3 Ų127.387%0.86577%0.774SS**  trans-64112.5170.6-15892.7176.5-173.50107.6F19 K23F19-K21 VanDerWaalsContact C-N 3.3Å; F19-K21 PolarHBondContact O-N 2.93Å; K21-K23 PolarHBondContact O-N 3.33Å
22A48Very low51Low91 Ų91129.7 Ų129.775%0.75278%0.778SS**PPolyproline II helixtrans-56.9129.8177.300000109.7K20K20-A22 PolarHBondContact O-N 3.16Å; K20-A22 VanDerWaalsContact O-N 3.12Å
23K53Low51.6Low197 Ų197123.8 Ų123.886%0.85775%0.752SS**PPolyproline II helixtrans-69.9129.3174.7-58.9176.6-178.4179.40107.7K21K21-K23 PolarHBondContact O-N 3.33Å
24P54.3Low53.1Low122 Ų122119.3 Ų119.379%0.79274%0.735SS**PPolyproline II helixtrans-59.2150.7163.727.1-32.6000109.4
25A47.9Very low54.3Low98 Ų98114.8 Ų114.881%0.8170%0.703SS**PPolyproline II helixtrans-58.8155.7-168.700000113.6V27A25-V27 PolarHBondContact O-N 3.17Å; A25-V27 VanDerWaalsContact O-N 3.16Å
26A37.7Very low56.5Low106 Ų106112.5 Ų112.588%0.87668%0.682SS**  trans-62113.2-16900000113.5
27V54Low58.9Low137 Ų137112 Ų11283%0.8366%0.66SS**  trans-73.9139.6144.8168.70000107.3A25A25-V27 PolarHBondContact O-N 3.17Å; A25-V27 VanDerWaalsContact O-N 3.16Å
28A50Low61.3Low76 Ų76107.9 Ų107.963%0.62863%0.625SS**  trans-49.9154-179.500000112.5A30A28-A30 PolarHBondContact O-N 3.46Å
29P45.6Very low63.6Low130 Ų130107.7 Ų107.784%0.84461%0.611SS**  trans-62.299.3-17826.7-34.9000110.4G31P29-G31 PolarHBondContact O-N 3.23Å
30A50.4Low65.4Low78 Ų78101.5 Ų101.565%0.64558%0.584SS**PPolyproline II helixtrans-54.5130.2168.100000107.9A28A28-A30 PolarHBondContact O-N 3.46Å
31G61.1Low67.4Low41 Ų4194 Ų9442%0.42355%0.553SS.*PPolyproline II helixtrans-54.4156.2-169.400000112.9P29 P33P29-G31 PolarHBondContact O-N 3.23Å; G31-P33 VanDerWaalsContact O-N 3.15Å
32E70.2Confident69.3Low163 Ų16388.2 Ų88.276%0.76253%0.53SS*.PPolyproline II helixtrans-50.9125.7176.4-171.1175.7166.400109.2L34E32-L34 PolarHBondContact O-N 3.05Å
33P73.1Confident71.2Confident36 Ų3684.7 Ų84.723%0.23450%0.5CS..  trans-64.6108.2-169.923.1-33.4000109.8G31 Y35 R85G31-P33 VanDerWaalsContact O-N 3.15Å; P33-Y35 HydrophobicContact CG-CE2 4.37Å; P33-Y35 WeakPolarHBondContact O-CD2 3.41Å; P33-Y35 WeakPolarHBondContact O-CE2 3.34Å; P33-R85 HydrophobicContact CB-CG 4.03Å
34L85.8Confident72.8Confident85 Ų8578.1 Ų78.145%0.44548%0.482SS..EExtended strand (participates in β ladder)trans-67.1137.8177.3-62.7176.9000109.4E32 T86 E88E32-L34 PolarHBondContact O-N 3.05Å; L34-T86 PolarHBondContact N-O 3.25Å; L34-T86 PolarHBondContact O-N 3.03Å; L34-T86 VanDerWaalsContact O-O 3.12Å; L34-E88 HydrophobicContact CD1-CB 4.45Å; L34-E88 HydrophobicContact CD1-CG 4.42Å
35Y88.7Confident74.3Confident26 Ų2678.1 Ų78.110%0.10249%0.485CS..EExtended strand (participates in β ladder)trans-114.1123.9173.6-51.9-104.2000108.4P33 F57 R80 R84 R85P33-Y35 HydrophobicContact CG-CE2 4.37Å; P33-Y35 WeakPolarHBondContact O-CD2 3.41Å; P33-Y35 WeakPolarHBondContact O-CE2 3.34Å; Y35-F57 HydrophobicContact CD2-CD1 4.26Å; Y35-F57 HydrophobicContact CG-CB 4.48Å; Y35-F57 WeakPolarHBondContact O-CB 3.41Å; Y35-F57 PolarHBondContact O-N 3.38Å; Y35-R80 HydrophobicContact CD1-CB 4.19Å; Y35-R80 WeakPolarHBondContact CD1-O 3.33Å; Y35-R80 HydrophobicContact CE1-CB 4.13Å; Y35-R80 HydrophobicContact CE1-CG 4.42Å; Y35-R80 HydrophobicContact CE2-CB 4.47Å; Y35-R80 HydrophobicContact CG-CB 4.42Å; Y35-R84 CarbonylContact C-O 3.51Å; Y35-R84 WeakPolarHBondContact CA-O 3.48Å; Y35-R85 HydrophobicContact CD1-CB 3.98Å; Y35-R85 HydrophobicContact CD1-CG 4.27Å; Y35-R85 HydrophobicContact CE1-CB 4.09Å; Y35-R85 HydrophobicContact CE1-CG 4.09Å; Y35-R85 PolarHBondContact OH-NE 3.18Å; Y35-R85 PolarHBondContact OH-NH2 2.9Å
36R88.9Confident76Confident120 Ų12081.1 Ų81.145%0.45349%0.487SS..EExtended strand (participates in β ladder)trans-89.5-125.6-176.3-65.5-77.4178.6114.7-1.5109.9G55 E56 H83 R84 T86R36-G55 CarbonylContact C-O 3.54Å; R36-G55 WeakPolarHBondContact CA-O 3.39Å; R36-E56 CarbonylContact O-C 3.53Å; R36-E56 WeakPolarHBondContact O-CA 3.4Å; R36-H83 PolarHBondContact O-ND1 3.34Å; R36-R84 PolarHBondContact N-O 3.5Å; R36-T86 WeakPolarHBondContact CG-OG1 3.3Å
37E91.9Very high78.4Confident64 Ų6479.7 Ų79.730%0.29948%0.483SS..EExtended strand (participates in β ladder)trans-75.1145.3-167.678.2-71.4175.800113.4L39 C54 G55 H83 R84E37-L39 HydrophobicContact CG-CD2 4Å; E37-L39 PolarHBondContact O-N 3.01Å; E37-C54 CarbonylContact C-O 3.56Å; E37-C54 WeakPolarHBondContact CA-O 3.07Å; E37-G55 PolarHBondContact N-O 3.19Å; E37-H83 CarbonylContact O-C 3.46Å; E37-H83 VanDerWaalsContact O-CA 3.24Å; E37-H83 WeakPolarHBondContact O-CA 3.37Å; E37-R84 PolarHBondContact O-N 2.99Å; E37-R84 IonicContact OE1-CZ 2.65Å; E37-R84 VanDerWaalsContact OE1-CZ 3.29Å; E37-R84 IonicContact OE1-NE 3.02Å; E37-R84 PolarHBondContact OE1-NE 3Å; E37-R84 IonicContact OE1-NH2 3.15Å; E37-R84 PolarHBondContact OE1-NH2 3.37Å; E37-R84 IonicContact OE2-NE 3.29Å
38C93.5Very high80Confident1 Ų174.8 Ų74.81%0.00746%0.46CS..EExtended strand (participates in β ladder)trans-73.4120.4174.1-174.60000111.1K40 V51 C54C38-K40 VanDerWaalsContact C-N 3.33Å; C38-K40 WeakPolarHBondContact SG-CB 3.48Å; C38-V51 WeakPolarHBondContact O-CG1 3.04Å; C38-C54 PolarHBondContact N-O 3.01Å
39L91.4Very high81.9Confident83 Ų8378.4 Ų78.444%0.43546%0.463SS..  trans-93.618.7178.6-56.9177.3000113.1E37 F82 R84E37-L39 HydrophobicContact CG-CD2 4Å; E37-L39 PolarHBondContact O-N 3.01Å; L39-F82 WeakPolarHBondContact CB-O 3.44Å; L39-F82 PolarHBondContact N-O 2.86Å; L39-R84 HydrophobicContact CD1-CB 4.18Å
40K90.3Very high83.8Confident80 Ų8074.2 Ų74.235%0.34844%0.44SS..  trans-77.1127.9176.4-17574.1177.9-171.60109.3C38 H42 F82C38-K40 VanDerWaalsContact C-N 3.33Å; C38-K40 WeakPolarHBondContact SG-CB 3.48Å; K40-H42 PolarHBondContact O-CD2 3.13Å; K40-H42 PolarHBondContact O-N 3.47Å; K40-H42 VanDerWaalsContact O-N 3.11Å; K40-F82 HydrophobicContact CB-CB 4.46Å; K40-F82 HydrophobicContact CB-CD1 4.45Å; K40-F82 HydrophobicContact CD-CD1 3.77Å; K40-F82 HydrophobicContact CD-CE1 3.79Å; K40-F82 HydrophobicContact CD-CG 4.26Å; K40-F82 HydrophobicContact CD-CZ 4.28Å
41N91Very high85.5Confident40 Ų4073.6 Ų73.621%0.21443%0.428CS..  trans-70.8105.8163.5-178.76.9000108.8A43 A44 G48 H49 A50N41-A43 PolarHBondContact OD1-N 2.99Å; N41-A43 VanDerWaalsContact OD1-N 3.15Å; N41-A44 HydrophobicContact CB-CB 4.15Å; N41-A44 WeakPolarHBondContact O-CB 3.48Å; N41-A44 PolarHBondContact OD1-N 3.36Å; N41-G48 PolarHBondContact ND2-O 3.21Å; N41-G48 PolarHBondContact OD1-O 3.04Å; N41-H49 PolarHBondContact ND2-ND1 2.79Å; N41-H49 WeakPolarHBondContact OD1-CA 3.49Å; N41-A50 WeakPolarHBondContact CA-O 3.49Å; N41-A50 PolarHBondContact OD1-N 2.76Å; N41-A50 PolarHBondContact OD1-O 3.16Å
42H88Confident85.8Confident79 Ų7978.4 Ų78.437%0.36644%0.444SS..G310 helixtrans-76.7-34.2179.7-76.2-86.3000111.7K40 A44 A50K40-H42 PolarHBondContact O-CD2 3.13Å; K40-H42 PolarHBondContact O-N 3.47Å; K40-H42 VanDerWaalsContact O-N 3.11Å; H42-A44 PolarHBondContact O-N 2.98Å; H42-A50 PolarHBondContact N-O 3.24Å
43A88.6Confident86Confident17 Ų1771.8 Ų71.814%0.1442%0.42CS..G310 helixtrans-78.43.5176.100000114.7N41 S45 L46 G47 G48 A50N41-A43 PolarHBondContact OD1-N 2.99Å; N41-A43 VanDerWaalsContact OD1-N 3.15Å; A43-S45 PolarHBondContact O-N 2.91Å; A43-S45 VanDerWaalsContact O-N 3.13Å; A43-L46 CarbonylContact O-C 3.57Å; A43-L46 WeakPolarHBondContact O-CA 3.1Å; A43-L46 PolarHBondContact O-N 2.78Å; A43-G47 PolarHBondContact O-N 2.79Å; A43-G48 CarbonylContact C-O 3.57Å; A43-G48 PolarHBondContact O-N 2.96Å; A43-G48 VanDerWaalsContact O-N 3.07Å; A43-A50 HydrophobicContact CB-CB 3.68Å
44A87.2Confident86.6Confident58 Ų5871.5 Ų71.548%0.47942%0.418SS..G310 helixtrans-56.7-32.8-175.400000114N41 H42N41-A44 HydrophobicContact CB-CB 4.15Å; N41-A44 WeakPolarHBondContact O-CB 3.48Å; N41-A44 PolarHBondContact OD1-N 3.36Å; H42-A44 PolarHBondContact O-N 2.98Å
45S84.3Confident86.5Confident122 Ų12270.1 Ų70.185%0.85343%0.425SS*.G310 helixtrans-75.1-24.1176.8-55.40000113.3A43 G47A43-S45 PolarHBondContact O-N 2.91Å; A43-S45 VanDerWaalsContact O-N 3.13Å; S45-G47 VanDerWaalsContact C-N 3.29Å
46L85.2Confident86.5Confident161 Ų16174.7 Ų74.784%0.84345%0.447SS*.G310 helixtrans-90.17.4177.3-60172.7000112A43 G48A43-L46 CarbonylContact O-C 3.57Å; A43-L46 WeakPolarHBondContact O-CA 3.1Å; A43-L46 PolarHBondContact O-N 2.78Å; L46-G48 PolarHBondContact O-N 2.94Å
47G87.7Confident86.4Confident77 Ų7770.2 Ų70.279%0.79443%0.431SS*.THydrogen-bonded Turntrans75.3-1.4-17400000114.9A43 S45A43-G47 PolarHBondContact O-N 2.79Å; S45-G47 VanDerWaalsContact C-N 3.29Å
48G87.5Confident86.3Confident33 Ų3372 Ų7234%0.3444%0.44SS..  trans-91.1177.4-17700000114.9N41 A43 L46N41-G48 PolarHBondContact ND2-O 3.21Å; N41-G48 PolarHBondContact OD1-O 3.04Å; A43-G48 CarbonylContact C-O 3.57Å; A43-G48 PolarHBondContact O-N 2.96Å; A43-G48 VanDerWaalsContact O-N 3.07Å; L46-G48 PolarHBondContact O-N 2.94Å
49H89.4Confident86Confident153 Ų15375.5 Ų75.571%0.70846%0.463SS*.  trans-124.3104.6167.1-169.561.1000110.2N41N41-H49 PolarHBondContact ND2-ND1 2.79Å; N41-H49 WeakPolarHBondContact OD1-CA 3.49Å
50A86.8Confident85.7Confident42 Ų4273.2 Ų73.235%0.34745%0.454SS..  trans-136.7120.1172.800000108.5N41 H42 A43N41-A50 WeakPolarHBondContact CA-O 3.49Å; N41-A50 PolarHBondContact OD1-N 2.76Å; N41-A50 PolarHBondContact OD1-O 3.16Å; H42-A50 PolarHBondContact N-O 3.24Å; A43-A50 HydrophobicContact CB-CB 3.68Å
51V85Confident85.3Confident65 Ų6576.1 Ų76.139%0.39448%0.481SS..  trans-105.861.8173.3-172.30000107C38 G53C38-V51 WeakPolarHBondContact O-CG1 3.04Å; V51-G53 VanDerWaalsContact C-N 3.26Å; V51-G53 PolarHBondContact O-N 3.4Å; V51-G53 VanDerWaalsContact O-N 3.13Å
52D68.2Low84.9Confident141 Ų14177.7 Ų77.775%0.75451%0.507SS*.  trans-8478.7172.1-170.521.7000108.1
53G74.4Confident84.7Confident25 Ų2574.9 Ų74.926%0.25850%0.497SS..  trans-106.4149.3-171.600000112V51 G55V51-G53 VanDerWaalsContact C-N 3.26Å; V51-G53 PolarHBondContact O-N 3.4Å; V51-G53 VanDerWaalsContact O-N 3.13Å; G53-G55 PolarHBondContact O-N 2.91Å
54C84.6Confident84.3Confident29 Ų2978 Ų7820%0.19651%0.511CS..  trans-55136.4169.4-450000109.8E37 C38 E56 A75 C76E37-C54 CarbonylContact C-O 3.56Å; E37-C54 WeakPolarHBondContact CA-O 3.07Å; C38-C54 PolarHBondContact N-O 3.01Å; C54-E56 WeakPolarHBondContact CB-O 3.43Å; C54-E56 PolarHBondContact O-N 2.95Å; C54-A75 HydrophobicContact CB-CB 4.33Å; C54-A75 WeakPolarHBondContact SG-CB 3.26Å; C54-C76 WeakPolarHBondContact SG-CB 3.41Å; C54-C76 PolarHBondContact SG-N 3.06Å; C54-C76 VanDerWaalsContact SG-SG 3.62Å
55G84.2Confident84Confident57 Ų5780.2 Ų80.259%0.58852%0.521SS*.SBendtrans-67.3-20.1179.800000114.4R36 E37 G53R36-G55 CarbonylContact C-O 3.54Å; R36-G55 WeakPolarHBondContact CA-O 3.39Å; E37-G55 PolarHBondContact N-O 3.19Å; G53-G55 PolarHBondContact O-N 2.91Å
56E87.5Confident83.9Confident122 Ų12278.5 Ų78.557%0.5751%0.514SS*.SBendtrans-142.1156.1176.663.4-174.7176.600112R36 C54 M58R36-E56 CarbonylContact O-C 3.53Å; R36-E56 WeakPolarHBondContact O-CA 3.4Å; C54-E56 WeakPolarHBondContact CB-O 3.43Å; C54-E56 PolarHBondContact O-N 2.95Å; E56-M58 HydrophobicContact CG-CG 4.33Å; E56-M58 PolarHBondContact O-N 3.47Å
57F88.5Confident83.9Confident26 Ų2673.6 Ų73.611%0.11449%0.489CS..  trans-87.9102.4175.7-178.9-97.7000111.2Y35 P59 L71 C73 R80 H83Y35-F57 HydrophobicContact CD2-CD1 4.26Å; Y35-F57 HydrophobicContact CG-CB 4.48Å; Y35-F57 WeakPolarHBondContact O-CB 3.41Å; Y35-F57 PolarHBondContact O-N 3.38Å; F57-P59 HydrophobicContact CD1-CG 4.26Å; F57-P59 HydrophobicContact CE1-CB 4.15Å; F57-P59 HydrophobicContact CE1-CG 3.84Å; F57-L71 HydrophobicContact CZ-CB 4.21Å; F57-C73 HydrophobicContact CD2-CB 3.78Å; F57-C73 HydrophobicContact CE2-CB 3.83Å; F57-R80 HydrophobicContact CD1-CB 4.43Å; F57-R80 HydrophobicContact CD2-CB 4.02Å; F57-R80 HydrophobicContact CE1-CB 4.03Å; F57-R80 VanDerWaalsContact CE2-CA 3.49Å; F57-R80 HydrophobicContact CE2-CB 3.57Å; F57-R80 HydrophobicContact CG-CB 4.44Å; F57-R80 HydrophobicContact CZ-CB 3.61Å; F57-H83 HydrophobicContact CB-CB 4.38Å; F57-H83 AromaticContact CD2-CD2 3.68Å; F57-H83 AromaticContact CD2-CG 3.91Å; F57-H83 AromaticContact CD2-NE2 3.75Å
58M88.9Confident83.6Confident102 Ų10273.2 Ų73.250%0.50247%0.472SS..PPolyproline II helixtrans-90.5116.6166.8-55.9179.883.700109.4E56 C73 A74E56-M58 HydrophobicContact CG-CG 4.33Å; E56-M58 PolarHBondContact O-N 3.47Å; M58-C73 CarbonylContact O-C 3.57Å; M58-C73 VanDerWaalsContact O-CA 3.23Å; M58-C73 WeakPolarHBondContact O-CA 3.36Å; M58-A74 HydrophobicContact CB-CB 4.37Å; M58-A74 PolarHBondContact O-N 3.41Å
59P87.7Confident83.4Confident74 Ų7476.1 Ų76.148%0.48148%0.483SS..BIsolated β-bridgetrans-60.7140.1174.3-16.227.3000111.3F57 A63 L71F57-P59 HydrophobicContact CD1-CG 4.26Å; F57-P59 HydrophobicContact CE1-CB 4.15Å; F57-P59 HydrophobicContact CE1-CG 3.84Å; P59-A63 HydrophobicContact CB-CB 4.35Å; P59-L71 HydrophobicContact CB-CD2 4.27Å
60S85.8Confident83.4Confident35 Ų3570.4 Ų70.425%0.24546%0.461CS..PPolyproline II helixtrans-64.4148.6172.6-59.50000111.4G62 A63 K72S60-G62 PolarHBondContact O-N 2.94Å; S60-A63 WeakPolarHBondContact O-CB 3.47Å; S60-A63 PolarHBondContact O-N 3.07Å; S60-K72 PolarHBondContact N-O 2.91Å; S60-K72 PolarHBondContact OG-O 2.83Å
61P81.2Confident83.5Confident141 Ų14169.1 Ų69.192%0.91645%0.448SS*.THydrogen-bonded Turntrans-59-25.2-175.7-26.835000115.6
62G82.1Confident83.8Confident73 Ų7371 Ų7175%0.75345%0.451SS*.THydrogen-bonded Turntrans-92.28.3174.700000114.9S60S60-G62 PolarHBondContact O-N 2.94Å
63A83.5Confident84.9Confident19 Ų1964.2 Ų64.216%0.15742%0.415CS..  trans-78.3122.2-178.500000111.1P59 S60 P65 S70 L71P59-A63 HydrophobicContact CB-CB 4.35Å; S60-A63 WeakPolarHBondContact O-CB 3.47Å; S60-A63 PolarHBondContact O-N 3.07Å; A63-P65 WeakPolarHBondContact O-CD 3.3Å; A63-S70 WeakPolarHBondContact CA-OG 3.37Å; A63-L71 HydrophobicContact CB-CD2 3.99Å
64N81.5Confident85.7Confident82 Ų8265.8 Ų65.844%0.43943%0.425SS..  trans-84.3117.6175.6179.6-5.6000109.8A66 D67 S70N64-A66 PolarHBondContact O-N 2.83Å; N64-A66 WeakPolarHBondContact OD1-CB 3.42Å; N64-A66 PolarHBondContact OD1-N 2.9Å; N64-D67 HydrophobicContact CB-CB 4.1Å; N64-D67 PolarHBondContact O-N 3.46Å; N64-S70 PolarHBondContact N-OG 3.48Å
65P80.9Confident86Confident106 Ų10667.9 Ų67.969%0.68844%0.444SS*.THydrogen-bonded Turntrans-64.5-24179.326.1-34.3000113.5A63A63-P65 WeakPolarHBondContact O-CD 3.3Å
66A81.5Confident86.3Confident86 Ų8666.6 Ų66.671%0.71143%0.426SS*.THydrogen-bonded Turntrans-78.4-21.6174.200000113.3N64 P68N64-A66 PolarHBondContact O-N 2.83Å; N64-A66 WeakPolarHBondContact OD1-CB 3.42Å; N64-A66 PolarHBondContact OD1-N 2.9Å; A66-P68 WeakPolarHBondContact O-CD 3.48Å
67D83.9Confident86.4Confident58 Ų5863 Ų6331%0.3142%0.422SS..  trans-95.9107.2172.5178.6-3000110.2N64 T69 S70N64-D67 HydrophobicContact CB-CB 4.1Å; N64-D67 PolarHBondContact O-N 3.46Å; D67-T69 PolarHBondContact O-N 3.46Å; D67-T69 WeakPolarHBondContact OD1-CB 3.31Å; D67-T69 PolarHBondContact OD1-N 3.02Å; D67-T69 PolarHBondContact OD1-OG1 3.1Å; D67-T69 PolarHBondContact OD2-OG1 3.28Å; D67-S70 PolarHBondContact O-N 3.07Å
68P83Confident86.5Confident69 Ų6962.5 Ų62.545%0.44842%0.421SS..THydrogen-bonded Turntrans-63.3-15.8-177.128.4-36.7000114.4A66 H79 R80A66-P68 WeakPolarHBondContact O-CD 3.48Å; P68-H79 PolarHBondContact O-CE1 2.77Å; P68-H79 PolarHBondContact O-NE2 2.65Å; P68-R80 PolarHBondContact O-NE 2.88Å; P68-R80 PolarHBondContact O-NH2 2.95Å
69T83.7Confident86.7Confident93 Ų9359.4 Ų59.457%0.57141%0.405SS*.THydrogen-bonded Turntrans-92.9-23.2-177.2750000113.6D67 H79D67-T69 PolarHBondContact O-N 3.46Å; D67-T69 WeakPolarHBondContact OD1-CB 3.31Å; D67-T69 PolarHBondContact OD1-N 3.02Å; D67-T69 PolarHBondContact OD1-OG1 3.1Å; D67-T69 PolarHBondContact OD2-OG1 3.28Å; T69-H79 VanDerWaalsContact C-NE2 3.34Å; T69-H79 WeakPolarHBondContact CA-NE2 3.46Å; T69-H79 PolarHBondContact N-NE2 3.15Å; T69-H79 PolarHBondContact O-CD2 2.91Å; T69-H79 PolarHBondContact O-NE2 2.92Å
70S87.4Confident86.8Confident34 Ų3458.2 Ų58.224%0.23839%0.391CS..THydrogen-bonded Turntrans-74.9-24.2-180-172.50000113A63 N64 D67 K72A63-S70 WeakPolarHBondContact CA-OG 3.37Å; N64-S70 PolarHBondContact N-OG 3.48Å; D67-S70 PolarHBondContact O-N 3.07Å; S70-K72 PolarHBondContact O-N 3.37Å
71L89.1Confident87Confident15 Ų1562.2 Ų62.28%0.07941%0.41CS..  trans-70.189-176.4-70.6160.1000113.4F57 P59 A63 H79 R80F57-L71 HydrophobicContact CZ-CB 4.21Å; P59-L71 HydrophobicContact CB-CD2 4.27Å; A63-L71 HydrophobicContact CB-CD2 3.99Å; L71-H79 PolarHBondContact O-CD2 3.37Å; L71-H79 VanDerWaalsContact O-CD2 3.31Å; L71-R80 HydrophobicContact CB-CG 4.14Å; L71-R80 PolarHBondContact O-N 3.49Å
72K92.4Very high87.5Confident103 Ų10359.6 Ų59.645%0.44839%0.385SS..BIsolated β-bridgetrans-110.1144.8174.7-63.3170.7-175.1-66.10111.1S60 S70 C78S60-K72 PolarHBondContact N-O 2.91Å; S60-K72 PolarHBondContact OG-O 2.83Å; S70-K72 PolarHBondContact O-N 3.37Å; K72-C78 CarbonylContact C-O 3.15Å; K72-C78 WeakPolarHBondContact CA-O 3.08Å
73C91.6Very high87.9Confident0 Ų056.5 Ų56.50%035%0.35CS..BIsolated β-bridgetrans-67.8129174.7-177.80000109.4F57 M58 A75 C76 G77 C78 H83F57-C73 HydrophobicContact CD2-CB 3.78Å; F57-C73 HydrophobicContact CE2-CB 3.83Å; M58-C73 CarbonylContact O-C 3.57Å; M58-C73 VanDerWaalsContact O-CA 3.23Å; M58-C73 WeakPolarHBondContact O-CA 3.36Å; C73-A75 VanDerWaalsContact C-N 3.27Å; C73-A75 PolarHBondContact O-N 3.11Å; C73-C76 VanDerWaalsContact CB-SG 3.59Å; C73-C76 VanDerWaalsContact SG-SG 3.63Å; C73-G77 WeakPolarHBondContact O-CA 3.32Å; C73-G77 PolarHBondContact O-N 3.12Å; C73-C78 WeakPolarHBondContact CB-O 3.23Å; C73-C78 PolarHBondContact N-O 3.38Å; C73-H83 WeakPolarHBondContact CB-NE2 3.41Å
74A90.8Very high88.3Confident58 Ų5861.9 Ų61.948%0.47937%0.367SS..THydrogen-bonded Turntrans-61.8-35.117700000112.3M58M58-A74 HydrophobicContact CB-CB 4.37Å; M58-A74 PolarHBondContact O-N 3.41Å
75A89.9Confident88.7Confident72 Ų7264.8 Ų64.860%0.59537%0.372SS*.THydrogen-bonded Turntrans-88.2-41.2-172.300000114.2C54 C73C54-A75 HydrophobicContact CB-CB 4.33Å; C54-A75 WeakPolarHBondContact SG-CB 3.26Å; C73-A75 VanDerWaalsContact C-N 3.27Å; C73-A75 PolarHBondContact O-N 3.11Å
76C91.2Very high88.7Confident30 Ų3061.7 Ų61.720%0.20335%0.351CS..THydrogen-bonded Turntrans-108.81.4177.664.60000115C54 C73 C78 H83C54-C76 WeakPolarHBondContact SG-CB 3.41Å; C54-C76 PolarHBondContact SG-N 3.06Å; C54-C76 VanDerWaalsContact SG-SG 3.62Å; C73-C76 VanDerWaalsContact CB-SG 3.59Å; C73-C76 VanDerWaalsContact SG-SG 3.63Å; C76-C78 PolarHBondContact O-N 3.48Å; C76-H83 PolarHBondContact SG-NE2 2.78Å; C76-H83 VanDerWaalsContact SG-NE2 3.44Å
77G89.8Confident88.3Confident47 Ų4761.5 Ų61.549%0.48534%0.341SS..  trans65.7-4.4-177.100000115.5C73C73-G77 WeakPolarHBondContact O-CA 3.32Å; C73-G77 PolarHBondContact O-N 3.12Å
78C91.5Very high87Confident15 Ų1563.6 Ų63.610%0.10135%0.349CS..  trans-73.6144.3-175.7-68.40000111.5K72 C73 C76 F82K72-C78 CarbonylContact C-O 3.15Å; K72-C78 WeakPolarHBondContact CA-O 3.08Å; C73-C78 WeakPolarHBondContact CB-O 3.23Å; C73-C78 PolarHBondContact N-O 3.38Å; C76-C78 PolarHBondContact O-N 3.48Å; C78-F82 HydrophobicContact CB-CB 4.09Å; C78-F82 HydrophobicContact CB-CD2 4.11Å; C78-F82 HydrophobicContact CB-CG 4.4Å
79H91.9Very high85.7Confident37 Ų3763.9 Ų63.917%0.17136%0.364CS..BIsolated β-bridgetrans-63.7146.3172.2-174.9-95.1000110.7P68 T69 L71 N81 F82P68-H79 PolarHBondContact O-CE1 2.77Å; P68-H79 PolarHBondContact O-NE2 2.65Å; T69-H79 VanDerWaalsContact C-NE2 3.34Å; T69-H79 WeakPolarHBondContact CA-NE2 3.46Å; T69-H79 PolarHBondContact N-NE2 3.15Å; T69-H79 PolarHBondContact O-CD2 2.91Å; T69-H79 PolarHBondContact O-NE2 2.92Å; L71-H79 PolarHBondContact O-CD2 3.37Å; L71-H79 VanDerWaalsContact O-CD2 3.31Å; H79-N81 PolarHBondContact CE1-ND2 3.08Å; H79-N81 PolarHBondContact CE1-OD1 3.07Å; H79-N81 WeakPolarHBondContact ND1-CB 3.49Å; H79-N81 VanDerWaalsContact ND1-CG 3.35Å; H79-N81 PolarHBondContact ND1-N 2.83Å; H79-N81 VanDerWaalsContact ND1-N 3.17Å; H79-N81 PolarHBondContact O-N 2.79Å; H79-F82 HydrophobicContact CB-CD2 4.05Å; H79-F82 HydrophobicContact CB-CE2 4.26Å; H79-F82 WeakPolarHBondContact O-CB 3.49Å; H79-F82 WeakPolarHBondContact O-CD2 3.37Å; H79-F82 PolarHBondContact O-N 3.01Å
80R91.1Very high83.8Confident49 Ų4963.3 Ų63.319%0.18536%0.364CS..G310 helixtrans-49.6-27.8179.659.4179.2176.5163.97.6115.2Y35 F57 P68 L71 F82 H83Y35-R80 HydrophobicContact CD1-CB 4.19Å; Y35-R80 WeakPolarHBondContact CD1-O 3.33Å; Y35-R80 HydrophobicContact CE1-CB 4.13Å; Y35-R80 HydrophobicContact CE1-CG 4.42Å; Y35-R80 HydrophobicContact CE2-CB 4.47Å; Y35-R80 HydrophobicContact CG-CB 4.42Å; F57-R80 HydrophobicContact CD1-CB 4.43Å; F57-R80 HydrophobicContact CD2-CB 4.02Å; F57-R80 HydrophobicContact CE1-CB 4.03Å; F57-R80 VanDerWaalsContact CE2-CA 3.49Å; F57-R80 HydrophobicContact CE2-CB 3.57Å; F57-R80 HydrophobicContact CG-CB 4.44Å; F57-R80 HydrophobicContact CZ-CB 3.61Å; P68-R80 PolarHBondContact O-NE 2.88Å; P68-R80 PolarHBondContact O-NH2 2.95Å; L71-R80 HydrophobicContact CB-CG 4.14Å; L71-R80 PolarHBondContact O-N 3.49Å; R80-F82 PolarHBondContact O-N 3.28Å; R80-H83 PolarHBondContact O-N 3.45Å
81N89.8Confident82.3Confident120 Ų12066.4 Ų66.464%0.64238%0.383SS*.G310 helixtrans-67.7-14.6176.5-68.6-5.4000113.9H79H79-N81 PolarHBondContact CE1-ND2 3.08Å; H79-N81 PolarHBondContact CE1-OD1 3.07Å; H79-N81 WeakPolarHBondContact ND1-CB 3.49Å; H79-N81 VanDerWaalsContact ND1-CG 3.35Å; H79-N81 PolarHBondContact ND1-N 2.83Å; H79-N81 VanDerWaalsContact ND1-N 3.17Å; H79-N81 PolarHBondContact O-N 2.79Å
82F90.4Very high80.7Confident86 Ų8671.3 Ų71.338%0.37742%0.416SS..G310 helixtrans-84.5-14.6169.6-66.8-72.3000112.6L39 K40 C78 H79 R80L39-F82 WeakPolarHBondContact CB-O 3.44Å; L39-F82 PolarHBondContact N-O 2.86Å; K40-F82 HydrophobicContact CB-CB 4.46Å; K40-F82 HydrophobicContact CB-CD1 4.45Å; K40-F82 HydrophobicContact CD-CD1 3.77Å; K40-F82 HydrophobicContact CD-CE1 3.79Å; K40-F82 HydrophobicContact CD-CG 4.26Å; K40-F82 HydrophobicContact CD-CZ 4.28Å; C78-F82 HydrophobicContact CB-CB 4.09Å; C78-F82 HydrophobicContact CB-CD2 4.11Å; C78-F82 HydrophobicContact CB-CG 4.4Å; H79-F82 HydrophobicContact CB-CD2 4.05Å; H79-F82 HydrophobicContact CB-CE2 4.26Å; H79-F82 WeakPolarHBondContact O-CB 3.49Å; H79-F82 WeakPolarHBondContact O-CD2 3.37Å; H79-F82 PolarHBondContact O-N 3.01Å; R80-F82 PolarHBondContact O-N 3.28Å
83H91.9Very high79Confident7 Ų774.4 Ų74.43%0.03243%0.432CS..EExtended strand (participates in β ladder)trans-89.4144.5176.3-71.2-116.7000110.8R36 E37 F57 C73 C76 R80 R85R36-H83 PolarHBondContact O-ND1 3.34Å; E37-H83 CarbonylContact O-C 3.46Å; E37-H83 VanDerWaalsContact O-CA 3.24Å; E37-H83 WeakPolarHBondContact O-CA 3.37Å; F57-H83 HydrophobicContact CB-CB 4.38Å; F57-H83 AromaticContact CD2-CD2 3.68Å; F57-H83 AromaticContact CD2-CG 3.91Å; F57-H83 AromaticContact CD2-NE2 3.75Å; C73-H83 WeakPolarHBondContact CB-NE2 3.41Å; C76-H83 PolarHBondContact SG-NE2 2.78Å; C76-H83 VanDerWaalsContact SG-NE2 3.44Å; R80-H83 PolarHBondContact O-N 3.45Å; H83-R85 PolarHBondContact O-N 3.31Å
84R89.9Confident77.4Confident133 Ų13380.1 Ų80.150%0.50247%0.469SS..EExtended strand (participates in β ladder)trans-64.5119.3175.8-171.4-179.1-55.3-99.4-3.4109.7Y35 R36 E37 L39Y35-R84 CarbonylContact C-O 3.51Å; Y35-R84 WeakPolarHBondContact CA-O 3.48Å; R36-R84 PolarHBondContact N-O 3.5Å; E37-R84 PolarHBondContact O-N 2.99Å; E37-R84 IonicContact OE1-CZ 2.65Å; E37-R84 VanDerWaalsContact OE1-CZ 3.29Å; E37-R84 IonicContact OE1-NE 3.02Å; E37-R84 PolarHBondContact OE1-NE 3Å; E37-R84 IonicContact OE1-NH2 3.15Å; E37-R84 PolarHBondContact OE1-NH2 3.37Å; E37-R84 IonicContact OE2-NE 3.29Å; L39-R84 HydrophobicContact CD1-CB 4.18Å
85R90.1Very high76Confident143 Ų14381.5 Ų81.554%0.5448%0.48SS..EExtended strand (participates in β ladder)trans-78.7126.2174.4-174.9-172.4-105-144.60.9110.3P33 Y35 H83P33-R85 HydrophobicContact CB-CG 4.03Å; Y35-R85 HydrophobicContact CD1-CB 3.98Å; Y35-R85 HydrophobicContact CD1-CG 4.27Å; Y35-R85 HydrophobicContact CE1-CB 4.09Å; Y35-R85 HydrophobicContact CE1-CG 4.09Å; Y35-R85 PolarHBondContact OH-NE 3.18Å; Y35-R85 PolarHBondContact OH-NH2 2.9Å; H83-R85 PolarHBondContact O-N 3.31Å
86T81Confident74.6Confident40 Ų4083.6 Ų83.625%0.24549%0.488CS..EExtended strand (participates in β ladder)trans-105.1133.5167.4-56.10000108.5L34 R36L34-T86 PolarHBondContact N-O 3.25Å; L34-T86 PolarHBondContact O-N 3.03Å; L34-T86 VanDerWaalsContact O-O 3.12Å; R36-T86 WeakPolarHBondContact CG-OG1 3.3Å
87V74.7Confident73.3Confident83 Ų8385.6 Ų85.650%0.50351%0.506SS..  trans-97.8104.7169179.40000106.9G89 S90V87-G89 PolarHBondContact O-N 3.46Å; V87-S90 PolarHBondContact O-N 2.91Å
88E55.5Low71.9Confident102 Ų10289.4 Ų89.448%0.47752%0.523SS..THydrogen-bonded Turntrans-64.5113.8176.5-154.567.5-166.800108.4L34L34-E88 HydrophobicContact CD1-CB 4.45Å; L34-E88 HydrophobicContact CD1-CG 4.42Å
89G56.3Low70.2Confident75 Ų7596.1 Ų96.177%0.77356%0.556SS**THydrogen-bonded Turntrans126.5-3.5-174.600000116.3V87V87-G89 PolarHBondContact O-N 3.46Å
90S42.8Very low68.7Low80 Ų8098.8 Ų98.856%0.55959%0.585SS**SBendtrans-80.8131.2159.3-174.40000108.8V87V87-S90 PolarHBondContact O-N 2.91Å
91P56.2Low67.5Low99 Ų99104 Ų10464%0.64362%0.616SS**PPolyproline II helixtrans-56.4152168.926.2-34000109.4Q93P91-Q93 PolarHBondContact O-N 3.28Å
92P56.1Low66.8Low118 Ų118103.6 Ų103.677%0.76662%0.62SS**PPolyproline II helixtrans-53.5120.1177.523.5-33.3000107.9P94P92-P94 WeakPolarHBondContact O-CD 3.42Å; P92-P94 VanDerWaalsContact O-N 3.08Å
93Q55.8Low66.2Low169 Ų169105 Ų10579%0.7964%0.638SS**PPolyproline II helixtrans-54.7122168.8-66.1-178.45.700105.3P91 A95P91-Q93 PolarHBondContact O-N 3.28Å; Q93-A95 PolarHBondContact O-N 3.15Å; Q93-A95 VanDerWaalsContact O-N 3.07Å
94P59.1Low65.6Low120 Ų120110.1 Ų110.178%0.77967%0.672SS**PPolyproline II helixtrans-54.4126.8-179.822.3-32.2000106.5P92P92-P94 WeakPolarHBondContact O-CD 3.42Å; P92-P94 VanDerWaalsContact O-N 3.08Å
95A61.7Low65.1Low86 Ų86109.3 Ų109.371%0.71168%0.684SS**PPolyproline II helixtrans-48.5134.7175.100000107.1Q93 A97Q93-A95 PolarHBondContact O-N 3.15Å; Q93-A95 VanDerWaalsContact O-N 3.07Å; A95-A97 PolarHBondContact O-N 3.22Å
96P60.4Low64.7Low117 Ų117108 Ų10876%0.7669%0.693SS**PPolyproline II helixtrans-52.8116.3179.122.4-32.4000106.7
97A63.5Low64.7Low72 Ų72111.6 Ų111.660%0.59572%0.718SS**PPolyproline II helixtrans-48.7134.4178.200000106.7A95 L99A95-A97 PolarHBondContact O-N 3.22Å; A97-L99 VanDerWaalsContact C-N 3.34Å; A97-L99 PolarHBondContact O-N 3.34Å
98P60.2Low64.7Low127 Ų127113 Ų11383%0.82573%0.728SS**  trans-56.2104.3-171.722.8-33.2000107.4A100P98-A100 VanDerWaalsContact C-N 3.35Å; P98-A100 PolarHBondContact O-N 2.85Å
99L55.7Low65.5Low155 Ų155113.7 Ų113.781%0.81274%0.741SS**  trans-64.8106.7179.8-69.1179.3000104.1A97 L101A97-L99 VanDerWaalsContact C-N 3.34Å; A97-L99 PolarHBondContact O-N 3.34Å; L99-L101 PolarHBondContact O-N 2.8Å
100A61Low66.1Low94 Ų94116.1 Ų116.178%0.77775%0.747SS**  trans-49.7111.8175.400000106.2P98P98-A100 VanDerWaalsContact C-N 3.35Å; P98-A100 PolarHBondContact O-N 2.85Å
101L65.8Low66.9Low158 Ų158117.6 Ų117.683%0.82775%0.752SS**PPolyproline II helixtrans-55.7128.7-174.8-72.3168.2000106.7L99L99-L101 PolarHBondContact O-N 2.8Å
102P74Confident66.8Low111 Ų111121 Ų12172%0.72176%0.764SS**PPolyproline II helixtrans-55.4138.2171.825.2-33000107.5
103P78.8Confident66.7Low116 Ų116123.2 Ų123.275%0.75376%0.764SS**PPolyproline II helixtrans-55.3144.1-179.623.6-33.7000109.6
104P79.7Confident66.2Low115 Ų115118.6 Ų118.675%0.74776%0.762SS**PPolyproline II helixtrans-57.6143.1178.725.6-34.3000109.8
105P79.4Confident65.5Low116 Ų116121.7 Ų121.775%0.75377%0.766SS**PPolyproline II helixtrans-60.3146.3175.127-34.2000110
106P81.6Confident64.9Low115 Ų115124.3 Ų124.375%0.74777%0.773SS**PPolyproline II helixtrans-61.7150.9177.127.1-34.8000111
107P80Confident64.3Low116 Ų116127.1 Ų127.175%0.75378%0.776SS**PPolyproline II helixtrans-62148176.227.5-34.8000111
108P75.3Confident63.3Low112 Ų112135 Ų13573%0.72779%0.79SS**PPolyproline II helixtrans-62.714917328.4-34.7000110.5S110P108-S110 PolarHBondContact O-N 3.45Å
109P71.9Confident62.5Low116 Ų116132.3 Ų132.375%0.75379%0.786SS**PPolyproline II helixtrans-63.7125.518026.3-34000110.9V111P109-V111 PolarHBondContact O-N 3.2Å
110S69.5Low61.7Low127 Ų127127.7 Ų127.789%0.88878%0.776SS**  trans-66.699.9173.6-64.60000110.3P108 L112P108-S110 PolarHBondContact O-N 3.45Å; S110-L112 PolarHBondContact O-N 2.91Å; S110-L112 VanDerWaalsContact O-N 3.1Å
111V59.5Low60.8Low110 Ų110132.2 Ų132.267%0.66778%0.781SS**  trans-76.199.6175.4-160.70000108.8P109 H113P109-V111 PolarHBondContact O-N 3.2Å; V111-H113 PolarHBondContact O-N 3.21Å
112L53.5Low60Low172 Ų172131.1 Ų131.190%0.90178%0.776SS**  trans-66.789.3178.4-172.975000110.7S110S110-L112 PolarHBondContact O-N 2.91Å; S110-L112 VanDerWaalsContact O-N 3.1Å
113H54.6Low58.7Low163 Ų163131.4 Ų131.476%0.75578%0.775SS**  trans-91122.8167.9-85.977.1000109.9V111V111-H113 PolarHBondContact O-N 3.21Å
114G44.5Very low57.7Low72 Ų72130.5 Ų130.574%0.74277%0.77SS**  trans-68.3140.4-169.500000113.9T116G114-T116 PolarHBondContact O-N 2.96Å
115Q44Very low56.1Low186 Ų186134.1 Ų134.187%0.86978%0.777SS**  trans-79.7112.4165.7-71.3170.5-12.600109.3
116T49.4Very low54.8Low141 Ų141135.6 Ų135.687%0.86578%0.778SS**  trans-97.4111.8161.342.40000108.7G114G114-T116 PolarHBondContact O-N 2.96Å
117H48.3Very low53.2Low176 Ų176139.7 Ų139.782%0.81578%0.779SS**PPolyproline II helixtrans-80.4153.8179-114.4-111.4000112.1
118R42.2Very low51.9Low236 Ų236141.1 Ų141.189%0.89178%0.775SS**PPolyproline II helixtrans-64.9138.2-172.7-61.6167.974.8-179.15.9113.9
119G44.2Very low50.7Low72 Ų72141.1 Ų141.174%0.74278%0.775SS**PPolyproline II helix-91160.3123.800000108.4
120G39.4Very low49.2Very low58 Ų58138.9 Ų138.960%0.59877%0.773SS**  cis123.9131.818.800000106.9
121E41.7Very low48.4Very low189 Ų189139.2 Ų139.288%0.88377%0.769SS**  trans71.2138.4-178.4-54.8157.58600114.2
122D49.5Very low48.4Very low134 Ų134141 Ų14172%0.71778%0.78SS**  cis-164147.8-11.3-131.8-123.8000111.9
123T46.7Very low48.3Very low117 Ų117140.2 Ų140.272%0.71878%0.777SS**  trans81.8149.2131-73.10000120.6
124P55.9Low48.6Very low98 Ų98136.8 Ų136.864%0.63678%0.776SS**  -140.9176.5-10131.1-3.8000118.4
125E46.9Very low49.3Very low190 Ų190141 Ų14189%0.88878%0.782SS**  trans40.8123.5145.9-64.9177.6105.700125
126D52.2Low50.1Low147 Ų147138.8 Ų138.879%0.78678%0.776SS**  trans-149.6110.4146.3-162-115.3000106.4
127R48.5Very low50.7Low202 Ų202137 Ų13776%0.76277%0.767SS**  63.4129.183.1-170.4172172777.2112.3
128H52.7Low51Low146 Ų146134.7 Ų134.768%0.67676%0.761SS**  cis-157.81622.3-160.6-102.4000110
129P48.9Very low52.3Low112 Ų112129.1 Ų129.173%0.72776%0.758SS**  trans-98.4174.6175.838.2-37.4000115
130G41.9Very low53Low68 Ų68132.7 Ų132.770%0.70176%0.76SS**  trans172.7107.6166.400000117.9
131V52.1Low54.3Low134 Ų134135.5 Ų135.581%0.81277%0.77SS**  trans26.6135.7143.2-61.50000123.6
132V59.9Low55.1Low148 Ų148136 Ų13690%0.89777%0.773SS**  trans-151.8145.1133.6-78.30000110.7
133D50.8Low55.4Low156 Ų156132.9 Ų132.983%0.83477%0.772SS**  trans-95.4-165.4-177.2-65.4-106.6000113.5
134A61.3Low56Low90 Ų90132.3 Ų132.374%0.74477%0.773SS**  trans86.7137.1175.900000116.4
135D58.8Low55.9Low161 Ų161136.7 Ų136.786%0.86179%0.785SS**  cis-153.8159.22.7-127.4-137.9000111.3
136D60.3Low56.3Low140 Ų140138 Ų13875%0.74978%0.783SS**  trans-85-169.4169.7-145.7-133.4000108.9
137P61.9Low56.2Low104 Ų104137.2 Ų137.268%0.67578%0.779SS**  cis-138.7170.12.144.1-25.4000118
138D54.9Low56.3Low127 Ų127135.3 Ų135.368%0.67978%0.779SS**  trans25.3132137.2-139.4-80.5000122.1
139S69.9Low56.2Low118 Ų118136.7 Ų136.783%0.82579%0.786SS**  trans-155.868.2166.8-165.90000112.5
140D58.1Low56.4Low148 Ų148142.4 Ų142.479%0.79179%0.793SS**  trans-68.5135.3160.8-85.1-50.2000111.2
141S67.1Low57Low116 Ų116143.9 Ų143.981%0.81179%0.792SS**  trans-152.2107.8170.9-150.70000111.7
142E58.1Low56.7Low200 Ų200144.7 Ų144.794%0.93580%0.797SS**  trans-81.4154.2179.9-52.2-178.994.900111.8
143G56.6Low56.7Low68 Ų68142.5 Ų142.570%0.70179%0.788SS**  trans175.299.317200000118.5
144S59.3Low57.4Low106 Ų106140.6 Ų140.674%0.74178%0.784SS**  trans53.295.215361.70000120.1
145E53.3Low57.5Low189 Ų189141.8 Ų141.888%0.88379%0.785SS**  26.1118.9106.5-168.517087.300118.5
146Y56.3Low58Low218 Ų218139.5 Ų139.586%0.85578%0.778SS**  trans-148.6133.2145.946.7-91.8000111.2
147D49.3Very low58.1Low130 Ų130137.6 Ų137.670%0.69577%0.774SS**  trans-34.3148.4177.2-96.5-156.6000119
148E51.5Low57.8Low163 Ų163141.6 Ų141.676%0.76278%0.783SS**  31.6128.9114.1-86.1-178.661.300117.5
149E50.8Low57.7Low175 Ų175143.8 Ų143.882%0.81879%0.789SS**  cis-151.7175.621-54.1177.178.200110.9
150R51.5Low57.2Low232 Ų232144.1 Ų144.188%0.87579%0.785SS**  trans112.9117.2146.2-159.2168.2-168.4174.45.5119.9
151S54.8Low57.2Low99 Ų99143 Ų14369%0.69279%0.786SS**  trans63.688153.6-680000119S153S151-S153 PolarHBondContact O-N 3.36Å
152V46.6Very low56.7Low151 Ų151141.5 Ų141.592%0.91578%0.781SS**  trans-49.8124.2156.3177.70000110.8
153S58.8Low56.7Low101 Ų101137.8 Ų137.871%0.70677%0.774SS**  trans-129.5138.5161.5-73.60000108.6S151S151-S153 PolarHBondContact O-N 3.36Å
154P65.3Low56.7Low116 Ų116140.5 Ų140.575%0.75378%0.777SS**PPolyproline II helixtrans-69.4150.8-173.628.6-35.1000112.1
155P65.4Low56.3Low116 Ų116139.8 Ų139.875%0.75378%0.777SS**PPolyproline II helixtrans-66.1149.1178.628.4-35.1000111.6
156P67.7Low56.4Low112 Ų112139.3 Ų139.373%0.72778%0.775SS**PPolyproline II helixtrans-65.3147.1174.828.8-34.7000110.7H158P156-H158 PolarHBondContact O-N 3.28Å
157P63.6Low56.3Low101 Ų101137.4 Ų137.466%0.65677%0.774SS**PPolyproline II helixtrans-63.9138.6-179.527.1-34.5000111H159P157-H159 PolarHBondContact O-N 3.13Å
158H55.6Low57.2Low187 Ų187136.1 Ų136.187%0.86677%0.773SS**  trans-60.9102.6172.4-66.6-80.4000110P156 V160P156-H158 PolarHBondContact O-N 3.28Å; H158-V160 PolarHBondContact O-N 2.69Å
159H52.9Low58Low174 Ų174133.7 Ų133.781%0.80677%0.771SS**  trans-68101.3169.9-80.2-76.8000109.3P157P157-H159 PolarHBondContact O-N 3.13Å
160V57.7Low58.8Low124 Ų124130.6 Ų130.675%0.75277%0.766SS**  trans-52.4132.6165.2-69.40000109.3H158 A162H158-V160 PolarHBondContact O-N 2.69Å; V160-A162 PolarHBondContact O-N 2.78Å; V160-A162 VanDerWaalsContact O-N 3.1Å
161P59.4Low59.5Low125 Ų125125.1 Ų125.181%0.81276%0.761SS**  trans-65.7115.6173.226.4-31.9000108.2
162A56.2Low59.5Low85 Ų85124.9 Ų124.970%0.70276%0.759SS**  trans-55.9138.2171.900000109.1V160 V164V160-A162 PolarHBondContact O-N 2.78Å; V160-A162 VanDerWaalsContact O-N 3.1Å; A162-V164 PolarHBondContact O-N 3.38Å
163P58.6Low59.8Low122 Ų122127.9 Ų127.979%0.79276%0.756SS**  trans-57135.9-178.524.4-34.1000109.4A165P163-A165 PolarHBondContact O-N 3.23Å
164V55.7Low59.6Low124 Ų124129.7 Ų129.775%0.75275%0.751SS**  trans-59.1103.5-17568.90000109.5A162 Q166A162-V164 PolarHBondContact O-N 3.38Å; V164-Q166 PolarHBondContact O-N 2.94Å
165A51.6Low59.3Low91 Ų91127.9 Ų127.975%0.75274%0.74SS**  trans-65.2102.6171.200000106.3P163 Q167P163-A165 PolarHBondContact O-N 3.23Å; A165-Q167 VanDerWaalsContact C-N 3.25Å; A165-Q167 PolarHBondContact O-N 3.08Å
166Q54.3Low58.3Low179 Ų179126.7 Ų126.784%0.83674%0.739SS**  trans-63.690.9178.5-66.1-178.413.200108V164V164-Q166 PolarHBondContact O-N 2.94Å
167Q54.7Low57.4Low178 Ų178126.2 Ų126.283%0.83275%0.745SS**PPolyproline II helixtrans-62.3123.6179.1-170.3178.8-6.500107.4A165A165-Q167 VanDerWaalsContact C-N 3.25Å; A165-Q167 PolarHBondContact O-N 3.08Å
168P67.9Low56.8Low103 Ų103125.1 Ų125.167%0.66974%0.744SS**PPolyproline II helixtrans-59.4143.2-178.523.5-33.2000109.6
169P69Low56.9Low113 Ų113121 Ų12173%0.73473%0.734SS**PPolyproline II helixtrans-57.5143179.925-34.2000109.8
170P68.5Low56.6Low109 Ų109120.7 Ų120.771%0.70873%0.733SS**PPolyproline II helixtrans-57.6139.4179.525-34.3000109.5S172P170-S172 PolarHBondContact O-N 3.37Å; P170-S172 VanDerWaalsContact O-N 3.08Å
171P65.4Low56.3Low117 Ų117123 Ų12376%0.7674%0.735SS**PPolyproline II helixtrans-55.7122.8-178.322.4-32.8000109.1Y173P171-Y173 VanDerWaalsContact C-N 3.34Å; P171-Y173 PolarHBondContact O-N 2.84Å
172S54.8Low56.1Low95 Ų95124.4 Ų124.466%0.66473%0.731SS**  trans-66.296.6179.6-790000109P170 F174P170-S172 PolarHBondContact O-N 3.37Å; P170-S172 VanDerWaalsContact O-N 3.08Å; S172-F174 VanDerWaalsContact C-N 3.25Å; S172-F174 PolarHBondContact O-N 3.03Å
173Y52.7Low55.8Low213 Ų213128.8 Ų128.884%0.83574%0.739SS**  trans-67.187.6176.5-140.7-79.9000108.9P171P171-Y173 VanDerWaalsContact C-N 3.34Å; P171-Y173 PolarHBondContact O-N 2.84Å
174F54.1Low55.6Low139 Ų139130.1 Ų130.161%0.6174%0.738SS**  trans-61.3128159.6-83.6-95.5000107.1S172 A176 M217S172-F174 VanDerWaalsContact C-N 3.25Å; S172-F174 PolarHBondContact O-N 3.03Å; F174-A176 VanDerWaalsContact C-N 3.33Å; F174-A176 PolarHBondContact O-N 3.2Å; F174-M217 HydrophobicContact CE1-CE 3.63Å; F174-M217 HydrophobicContact CE1-SD 4.08Å; F174-M217 HydrophobicContact CZ-CE 3.92Å
175P58.9Low55.7Low79 Ų79132.2 Ų132.251%0.51374%0.744SS.*  trans-68.9101.816428.6-29000107A177 P218P175-A177 PolarHBondContact O-N 3.48Å; P175-A177 VanDerWaalsContact O-N 3.12Å; P175-P218 HydrophobicContact CG-CG 3.43Å; P175-P218 VanDerWaalsContact CG-CG 3.43Å
176A45.6Very low55.2Low90 Ų90132.2 Ų132.274%0.74474%0.739SS**  trans-53.1119.615700000107F174 A178F174-A176 VanDerWaalsContact C-N 3.33Å; F174-A176 PolarHBondContact O-N 3.2Å; A176-A178 PolarHBondContact O-N 3.26Å
177A48.8Very low55Low103 Ų103131.5 Ų131.585%0.85174%0.74SS**  trans-71.570.1172.900000109P175P175-A177 PolarHBondContact O-N 3.48Å; P175-A177 VanDerWaalsContact O-N 3.12Å
178A50.5Low54.5Low77 Ų77126.5 Ų126.564%0.63674%0.737SS**  trans-65.2123.516600000107.2A176 H180A176-A178 PolarHBondContact O-N 3.26Å; A178-H180 PolarHBondContact O-N 2.95Å
179P58.1Low53.5Low101 Ų101127.9 Ų127.966%0.65675%0.745SS**  trans-62.2129.7175.526.3-32.9000108.2Q181P179-Q181 PolarHBondContact O-N 2.93Å
180H47Very low52.3Low168 Ų168126 Ų12678%0.77875%0.746SS**  trans-56.5114.2168.3-82.5-95.5000108A178 H182A178-H180 PolarHBondContact O-N 2.95Å; H180-H182 PolarHBondContact O-N 3.31Å
181Q50.8Low51.1Low172 Ų172125.4 Ų125.480%0.80475%0.751SS**  trans-69.572.7169.4-66.8-70.3-17.200108.6P179 M183P179-Q181 PolarHBondContact O-N 2.93Å; Q181-M183 PolarHBondContact O-N 3.12Å; Q181-M183 VanDerWaalsContact O-N 3.13Å
182H55Low49.9Very low154 Ų154124.3 Ų124.371%0.71375%0.752SS**  trans-65.3108.1162.3-86.6-88.3000107.1H180 L184H180-H182 PolarHBondContact O-N 3.31Å; H182-L184 VanDerWaalsContact C-N 3.31Å; H182-L184 PolarHBondContact O-N 2.78Å
183M50.5Low49.2Very low177 Ų177126.1 Ų126.187%0.87276%0.759SS**  trans-5994.1169.7-77.9-73.5-172.300109.5Q181 L185Q181-M183 PolarHBondContact O-N 3.12Å; Q181-M183 VanDerWaalsContact O-N 3.13Å; M183-L185 PolarHBondContact O-N 2.87Å
184L53Low48.8Very low151 Ų151120.6 Ų120.679%0.79176%0.757SS**  trans-75.1106167.9-99.5165.9000108.2H182 S186H182-L184 VanDerWaalsContact C-N 3.31Å; H182-L184 PolarHBondContact O-N 2.78Å; L184-S186 PolarHBondContact O-N 2.72Å
185L57.6Low48.2Very low167 Ų167118.2 Ų118.287%0.87476%0.763SS**  trans-76.6108.1161.2-79.388.1000107.9M183M183-L185 PolarHBondContact O-N 2.87Å
186S41.3Very low47.5Very low92 Ų92119.4 Ų119.464%0.64378%0.779SS**  trans-83.6143.3-175.3-99.70000113.7L184L184-S186 PolarHBondContact O-N 2.72Å
187L49.9Very low47.5Very low163 Ų163119.7 Ų119.785%0.85378%0.781SS**  trans56.8121.1144.5-87.763000120.8
188G45.3Very low47.5Very low74 Ų74123 Ų12376%0.76378%0.779SS**  trans-169.593.4150.500000110
189P47.5Very low47.2Very low131 Ų131129.7 Ų129.785%0.85179%0.788SS**  trans-86.6139.5-176.333.3-32.7000112.2
190G43.4Very low46.6Very low73 Ų73131.7 Ų131.775%0.75379%0.793SS**  trans-162.9103.5177.900000114.2
191A42Very low46.4Very low98 Ų98127.9 Ų127.981%0.8179%0.79SS**  trans43.9119.8153.400000121.5
192A41.3Very low46.3Very low93 Ų93126 Ų12677%0.76979%0.793SS**  trans52.4152.1135.600000120
193V40.8Very low45.8Very low134 Ų134122.9 Ų122.981%0.81279%0.793SS**  cis-15815525.5-142.40000108.8
194A42.7Very low45.7Very low96 Ų96123.3 Ų123.379%0.79379%0.794SS**  trans59.9149.815100000119.8
195A41.3Very low45.5Very low90 Ų90123.3 Ų123.374%0.74479%0.793SS**  cis-166.9162.8-16.400000109.3
196A45.3Very low44.7Very low104 Ų104121 Ų12186%0.8679%0.786SS**  trans60.9143.3152.600000119.6
197A45.1Very low44.9Very low95 Ų95122.2 Ų122.279%0.78579%0.792SS**  cis-151.8165-7.100000110.9
198Q49Very low44.6Very low172 Ų172120 Ų12080%0.80479%0.791SS**  trans-76.2163.6-175.5-48.3109.318.900113.8
199R43.7Very low44.9Very low218 Ų218122.2 Ų122.282%0.82379%0.794SS**  -179.8110.2122.3-75-120.3154.8175.1-6.9109.5
200L45.9Very low45.3Very low144 Ų144120.1 Ų120.175%0.75479%0.788SS**  61.410896.9-68.9150.5000112.6
201A43.3Very low46.3Very low88 Ų88122 Ų12273%0.72779%0.787SS**  121.2169.85400000108
202P48.3Very low47.4Very low133 Ų133122.7 Ų122.786%0.86478%0.783SS**  cis-129.1-167.2-13.140.6-21.8000114.5
203A45Very low48Very low87 Ų87125.3 Ų125.372%0.71979%0.792SS**  trans-68.1159.4-171.700000118.7
204Q47.3Very low48.6Very low187 Ų187121.5 Ų121.587%0.87478%0.78SS**  trans-130.7152.3152.1-84.3-73.79.400108.7
205L49.9Very low48.9Very low150 Ų150120.7 Ų120.779%0.78578%0.781SS**  trans-95.3139.6-157.3-65.9161.5000114.9
206T40.8Very low49.9Very low118 Ų118121 Ų12172%0.72478%0.783SS**  trans9.3147.6142.552.90000120.4
207P45.3Very low51Low119 Ų119121.8 Ų121.877%0.77377%0.771SS**  cis-135.6152.540.237.1-19.3000118.5S209P207-S209 PolarHBondContact O-N 3.19Å
208S42.9Very low52Low117 Ų117121 Ų12182%0.81876%0.757SS**  trans-61.6118.2168.8-60.10000112.1
209S52Low53.1Low120 Ų120122.6 Ų122.684%0.83976%0.756SS**  trans-90.696.5150.4-65.70000107.8P207P207-S209 PolarHBondContact O-N 3.19Å
210A56.3Low54.5Low87 Ų87120.4 Ų120.472%0.71975%0.753SS**PPolyproline II helixtrans-63129.7172.800000109.3
211P65.4Low55.6Low112 Ų112125 Ų12573%0.72776%0.76SS**PPolyproline II helixtrans-70.2138.3177.129.2-33.3000109.6
212P64.1Low57Low112 Ų112128.3 Ų128.373%0.72776%0.758SS**PPolyproline II helixtrans-63.8140.1173.727-33.8000109.9G214P212-G214 PolarHBondContact O-N 3.39Å
213P54.5Low58.5Low149 Ų149133.4 Ų133.497%0.96876%0.76SS**  trans-76.858.4172.834-35.4000110.3
214G53.5Low60.3Low53 Ų53133.6 Ų133.655%0.54675%0.753SS.*  trans-109.2122.5175.800000109.6P212 A216P212-G214 PolarHBondContact O-N 3.39Å; G214-A216 PolarHBondContact O-N 2.95Å
215G49.1Very low62.2Low80 Ų80134.1 Ų134.183%0.82575%0.752SS**  trans-58.694.2-174.200000113.3M217G215-M217 PolarHBondContact O-N 3.4Å
216A61.2Low64.1Low95 Ų95128.5 Ų128.579%0.78572%0.721SS**  trans-66.897.3171.300000108.8G214G214-A216 PolarHBondContact O-N 2.95Å
217M67.5Low66.6Low121 Ų121126.5 Ų126.560%0.59671%0.709SS**  trans-39135.6168.8-74.7-78.2175.800109.8F174 G215 R219F174-M217 HydrophobicContact CE1-CE 3.63Å; F174-M217 HydrophobicContact CE1-SD 4.08Å; F174-M217 HydrophobicContact CZ-CE 3.92Å; G215-M217 PolarHBondContact O-N 3.4Å; M217-R219 PolarHBondContact O-N 3.13Å
218P66.3Low68.9Low78 Ų78124.8 Ų124.851%0.50670%0.704SS.*  trans-56.8105.8176.7-13.722.3000108P175 K220P175-P218 HydrophobicContact CG-CG 3.43Å; P175-P218 VanDerWaalsContact CG-CG 3.43Å; P218-K220 VanDerWaalsContact C-N 3.31Å; P218-K220 PolarHBondContact O-N 3.49Å
219R72.6Confident71.3Confident207 Ų207124.3 Ų124.378%0.78169%0.69SS**  trans-65.198.6-178.4-62.1-17890.1-179.16.6105.6M217 R221M217-R219 PolarHBondContact O-N 3.13Å; R219-R221 PolarHBondContact O-N 2.87Å
220K73.3Confident73.3Confident172 Ų172120.9 Ų120.975%0.74866%0.66SS**  trans-46115.8176.1-8492.2172-173.90106P218 F222P218-K220 VanDerWaalsContact C-N 3.31Å; P218-K220 PolarHBondContact O-N 3.49Å; K220-F222 PolarHBondContact O-N 3.11Å
221R69.8Low75.1Confident241 Ų241121.5 Ų121.591%0.90965%0.647SS**  trans-51.4114.7-165.9175.5-176.4-92.1-148.3-3.5108.6R219 R223R219-R221 PolarHBondContact O-N 2.87Å; R221-R223 PolarHBondContact O-N 3.11Å
222F73Confident76.6Confident157 Ų157122.5 Ų122.569%0.68964%0.641SS**  trans-54.9116.9-176.5-76.3-86.8000109.6K220 T224K220-F222 PolarHBondContact O-N 3.11Å; F222-T224 PolarHBondContact O-N 3.44Å
223R79.1Confident78Confident240 Ų240121.7 Ų121.791%0.90662%0.624SS**  trans-71.2112.1174.2-177.2-179.8-179.9108.41107.4R221 K225R221-R223 PolarHBondContact O-N 3.11Å; R223-K225 PolarHBondContact O-N 2.95Å
224T82Confident79.9Confident91 Ų91114.6 Ų114.656%0.55858%0.578SS**  trans-58.3122.9-179.5510000110.7F222F222-T224 PolarHBondContact O-N 3.44Å
225K87Confident81.9Confident198 Ų198114.5 Ų114.586%0.86156%0.563SS**  trans-109.6107.5174.5-176.3-175178.5-174.10108.1R223R223-K225 PolarHBondContact O-N 2.95Å
226F91.2Very high84.1Confident32 Ų32114.2 Ų114.214%0.1454%0.54CS..  trans-75.4146.9173.4-51.4-76.5000110.7Q230 K231 M234 V262 V266 W270F226-Q230 HydrophobicContact CB-CB 4.12Å; F226-K231 HydrophobicContact CB-CG 3.87Å; F226-K231 WeakPolarHBondContact O-CE 3.49Å; F226-M234 HydrophobicContact CD1-SD 4.03Å; F226-M234 HydrophobicContact CE1-CE 4.35Å; F226-M234 HydrophobicContact CE1-SD 4.31Å; F226-M234 HydrophobicContact CG-SD 4.35Å; F226-M234 HydrophobicContact CZ-CE 4.48Å; F226-V262 HydrophobicContact CD1-CG2 4.11Å; F226-V262 HydrophobicContact CE1-CG1 3.97Å; F226-V262 HydrophobicContact CE1-CG2 4.15Å; F226-V266 HydrophobicContact CE1-CG1 3.95Å; F226-V266 HydrophobicContact CZ-CG1 3.51Å; F226-W270 AromaticContact CE2-CD1 3.74Å
227T93.2Very high85.7Confident76 Ų76110 Ų11047%0.46650%0.504SS..  trans-64.6167.6169.270.60000110.8Q230 K231T227-Q230 WeakPolarHBondContact OG1-CB 3.34Å; T227-Q230 WeakPolarHBondContact OG1-CG 3.35Å; T227-Q230 PolarHBondContact OG1-N 3.28Å; T227-K231 WeakPolarHBondContact O-CG 3.44Å; T227-K231 PolarHBondContact O-N 3.09Å
228A93Very high87Confident82 Ų82104.2 Ų104.268%0.67848%0.476SS*.Hα-helixtrans-62.4-46.7173.800000110.9Q230 K231 Q232A228-Q230 PolarHBondContact O-N 3.38Å; A228-K231 WeakPolarHBondContact O-CB 3.47Å; A228-K231 PolarHBondContact O-N 3.42Å; A228-K231 VanDerWaalsContact O-N 3.16Å; A228-Q232 PolarHBondContact O-N 3.05Å
229E94.3Very high88.3Confident108 Ų108105 Ų10551%0.50547%0.473SS..Hα-helixtrans-58.4-46.3176.6-169.2-166.9167.800112.7K231 Q232 R233E229-K231 VanDerWaalsContact C-N 3.31Å; E229-K231 PolarHBondContact O-N 2.91Å; E229-Q232 WeakPolarHBondContact O-CB 3.39Å; E229-Q232 PolarHBondContact O-N 3.12Å; E229-Q232 VanDerWaalsContact O-N 3.13Å; E229-R233 PolarHBondContact O-N 3.31Å; E229-R233 IonicContact OE1-CZ 3.31Å; E229-R233 VanDerWaalsContact OE1-CZ 3.31Å; E229-R233 IonicContact OE1-NE 2.7Å; E229-R233 PolarHBondContact OE1-NE 3.45Å; E229-R233 VanDerWaalsContact OE1-NE 3.14Å; E229-R233 IonicContact OE1-NH2 2.71Å; E229-R233 PolarHBondContact OE1-NH2 3.46Å
230Q93.7Very high89.3Confident47 Ų47103 Ų10322%0.2247%0.466CS..Hα-helixtrans-57.8-43.7175.6-80.6177.4-32.700111.4F226 T227 A228 Q232 M234 M260F226-Q230 HydrophobicContact CB-CB 4.12Å; T227-Q230 WeakPolarHBondContact OG1-CB 3.34Å; T227-Q230 WeakPolarHBondContact OG1-CG 3.35Å; T227-Q230 PolarHBondContact OG1-N 3.28Å; A228-Q230 PolarHBondContact O-N 3.38Å; Q230-Q232 VanDerWaalsContact C-N 3.33Å; Q230-Q232 PolarHBondContact O-N 3.01Å; Q230-M234 VanDerWaalsContact O-CB 3.26Å; Q230-M234 WeakPolarHBondContact O-CB 3.47Å; Q230-M234 WeakPolarHBondContact O-CG 3.43Å; Q230-M234 PolarHBondContact O-N 3.49Å; Q230-M260 PolarHBondContact NE2-O 2.8Å
231K94.5Very high90.2Very high101 Ų10196 Ų9644%0.43944%0.436SS..Hα-helixtrans-63.6-39.2177.1-67.5168.7-170.5171.90112F226 T227 A228 E229 M234 Q235 W270F226-K231 HydrophobicContact CB-CG 3.87Å; F226-K231 WeakPolarHBondContact O-CE 3.49Å; T227-K231 WeakPolarHBondContact O-CG 3.44Å; T227-K231 PolarHBondContact O-N 3.09Å; A228-K231 WeakPolarHBondContact O-CB 3.47Å; A228-K231 PolarHBondContact O-N 3.42Å; A228-K231 VanDerWaalsContact O-N 3.16Å; E229-K231 VanDerWaalsContact C-N 3.31Å; E229-K231 PolarHBondContact O-N 2.91Å; K231-M234 PolarHBondContact O-N 3.21Å; K231-Q235 VanDerWaalsContact O-CB 3.3Å; K231-Q235 WeakPolarHBondContact O-CB 3.17Å; K231-Q235 PolarHBondContact O-N 3.46Å; K231-W270 HydrophobicContact CB-CZ2 4.49Å
232Q94.8Very high91.3Very high132 Ų13286.7 Ų86.762%0.61742%0.415SS*.Hα-helixtrans-64.5-51.1177.5-176.8179.6-7.600111.3A228 E229 Q230 M234 Q235 E236A228-Q232 PolarHBondContact O-N 3.05Å; E229-Q232 WeakPolarHBondContact O-CB 3.39Å; E229-Q232 PolarHBondContact O-N 3.12Å; E229-Q232 VanDerWaalsContact O-N 3.13Å; Q230-Q232 VanDerWaalsContact C-N 3.33Å; Q230-Q232 PolarHBondContact O-N 3.01Å; Q232-M234 VanDerWaalsContact C-N 3.3Å; Q232-M234 PolarHBondContact O-N 2.92Å; Q232-Q235 WeakPolarHBondContact O-CB 3.42Å; Q232-Q235 PolarHBondContact O-N 3.26Å; Q232-Q235 VanDerWaalsContact O-N 3.11Å; Q232-E236 PolarHBondContact O-N 2.88Å
233R94.8Very high92.3Very high96 Ų9679.6 Ų79.636%0.36238%0.384SS..Hα-helixtrans-61.8-36.9176.1-65.3-169.2-169.4-157.64.5112.3E229 L237 D259 M260E229-R233 PolarHBondContact O-N 3.31Å; E229-R233 IonicContact OE1-CZ 3.31Å; E229-R233 VanDerWaalsContact OE1-CZ 3.31Å; E229-R233 IonicContact OE1-NE 2.7Å; E229-R233 PolarHBondContact OE1-NE 3.45Å; E229-R233 VanDerWaalsContact OE1-NE 3.14Å; E229-R233 IonicContact OE1-NH2 2.71Å; E229-R233 PolarHBondContact OE1-NH2 3.46Å; R233-L237 WeakPolarHBondContact O-CB 3.34Å; R233-L237 PolarHBondContact O-N 3.27Å; R233-L237 VanDerWaalsContact O-N 3.12Å; R233-D259 IonicContact NH1-OD2 2.93Å; R233-D259 PolarHBondContact NH1-OD2 2.9Å; R233-M260 HydrophobicContact CB-CG 4.21Å; R233-M260 HydrophobicContact CB-SD 3.43Å; R233-M260 WeakPolarHBondContact CB-SD 3.41Å
234M94.9Very high93Very high0 Ų077 Ų770%037%0.374CS..Hα-helixtrans-67.8-36173.8-70.5170.777.600112.4F226 Q230 K231 Q232 S238 M260 V262 F267 W270F226-M234 HydrophobicContact CD1-SD 4.03Å; F226-M234 HydrophobicContact CE1-CE 4.35Å; F226-M234 HydrophobicContact CE1-SD 4.31Å; F226-M234 HydrophobicContact CG-SD 4.35Å; F226-M234 HydrophobicContact CZ-CE 4.48Å; Q230-M234 VanDerWaalsContact O-CB 3.26Å; Q230-M234 WeakPolarHBondContact O-CB 3.47Å; Q230-M234 WeakPolarHBondContact O-CG 3.43Å; Q230-M234 PolarHBondContact O-N 3.49Å; K231-M234 PolarHBondContact O-N 3.21Å; Q232-M234 VanDerWaalsContact C-N 3.3Å; Q232-M234 PolarHBondContact O-N 2.92Å; M234-S238 WeakPolarHBondContact O-CB 3.49Å; M234-S238 PolarHBondContact O-N 2.7Å; M234-S238 VanDerWaalsContact O-N 3.08Å; M234-S238 PolarHBondContact O-OG 2.93Å; M234-M260 HydrophobicContact CG-CE 3.54Å; M234-M260 HydrophobicContact CG-SD 3.83Å; M234-V262 HydrophobicContact CE-CG1 3.88Å; M234-V262 HydrophobicContact SD-CG1 4.16Å; M234-V262 HydrophobicContact SD-CG2 4.07Å; M234-F267 HydrophobicContact CB-CD2 4.19Å; M234-F267 HydrophobicContact CB-CE2 4.06Å; M234-F267 HydrophobicContact CE-CB 4.42Å; M234-F267 HydrophobicContact CE-CD2 3.8Å; M234-F267 HydrophobicContact CG-CD2 4.01Å; M234-F267 HydrophobicContact CG-CE2 4.33Å; M234-F267 WeakPolarHBondContact O-CE2 2.95Å; M234-W270 HydrophobicContact CB-CD2 4.35Å; M234-W270 HydrophobicContact CB-CE3 3.98Å; M234-W270 HydrophobicContact CB-CH2 3.79Å; M234-W270 HydrophobicContact CB-CZ2 4.12Å; M234-W270 HydrophobicContact CB-CZ3 3.7Å; M234-W270 HydrophobicContact CE-CB 3.6Å; M234-W270 HydrophobicContact CE-CD2 3.47Å; M234-W270 VanDerWaalsContact CE-CD2 3.47Å; M234-W270 HydrophobicContact CE-CE3 3.84Å; M234-W270 HydrophobicContact CE-CG 3.35Å; M234-W270 WeakPolarHBondContact O-CZ3 3.36Å; M234-W270 HydrophobicContact SD-CD2 4.44Å
235Q94.3Very high93.4Very high51 Ų5174.5 Ų74.524%0.23836%0.357CS..Hα-helixtrans-65.8-51.4174.9178-174.9-1800110.5K231 Q232 L237 S238 E239 W243 W270 F278K231-Q235 VanDerWaalsContact O-CB 3.3Å; K231-Q235 WeakPolarHBondContact O-CB 3.17Å; K231-Q235 PolarHBondContact O-N 3.46Å; Q232-Q235 WeakPolarHBondContact O-CB 3.42Å; Q232-Q235 PolarHBondContact O-N 3.26Å; Q232-Q235 VanDerWaalsContact O-N 3.11Å; Q235-L237 PolarHBondContact O-N 2.87Å; Q235-S238 CarbonylContact O-C 3.59Å; Q235-S238 WeakPolarHBondContact O-CA 3.15Å; Q235-S238 WeakPolarHBondContact O-CB 3.38Å; Q235-S238 PolarHBondContact O-N 2.77Å; Q235-E239 HydrophobicContact CG-CG 4.42Å; Q235-E239 VanDerWaalsContact CG-OE1 3.31Å; Q235-E239 WeakPolarHBondContact CG-OE1 3.41Å; Q235-E239 PolarHBondContact NE2-OE1 3.05Å; Q235-E239 WeakPolarHBondContact O-CG 3.3Å; Q235-E239 PolarHBondContact O-N 3.3Å; Q235-W243 HydrophobicContact CG-CZ2 4.24Å; Q235-W270 HydrophobicContact CB-CH2 4.08Å; Q235-F278 HydrophobicContact CG-CD1 4.14Å; Q235-F278 HydrophobicContact CG-CE1 3.99Å; Q235-F278 HydrophobicContact CG-CZ 4.4Å; Q235-F278 VanDerWaalsContact OE1-CE1 3.31Å
236E94.9Very high93.6Very high74 Ų7468.9 Ų68.935%0.34633%0.334SS..Hα-helixtrans-57.5-46.6-179.5-170.3-167.3167.100111.6Q232 S238 E239 R240Q232-E236 PolarHBondContact O-N 2.88Å; E236-S238 VanDerWaalsContact C-N 3.28Å; E236-S238 PolarHBondContact O-N 3.39Å; E236-E239 PolarHBondContact O-N 2.92Å; E236-R240 VanDerWaalsContact O-CG 3.3Å; E236-R240 WeakPolarHBondContact O-CG 3.43Å; E236-R240 PolarHBondContact O-N 2.99Å; E236-R240 IonicContact OE1-CZ 3.14Å; E236-R240 VanDerWaalsContact OE1-CZ 3.25Å; E236-R240 IonicContact OE1-NE 2.79Å; E236-R240 PolarHBondContact OE1-NE 2.77Å; E236-R240 VanDerWaalsContact OE1-NE 3.15Å; E236-R240 IonicContact OE1-NH2 3.8Å; E236-R240 PolarHBondContact OE1-NH2 3.07Å
237L94.8Very high93.7Very high5 Ų575.6 Ų75.63%0.02636%0.363CS..Hα-helixtrans-60.1-39.2173.4-18063.1000111.7R233 Q235 R240 L241 V253 W256 F267R233-L237 WeakPolarHBondContact O-CB 3.34Å; R233-L237 PolarHBondContact O-N 3.27Å; R233-L237 VanDerWaalsContact O-N 3.12Å; Q235-L237 PolarHBondContact O-N 2.87Å; L237-R240 PolarHBondContact O-N 3.02Å; L237-L241 HydrophobicContact CD1-CD1 4.06Å; L237-L241 HydrophobicContact CD1-CG 4.3Å; L237-L241 HydrophobicContact CG-CD1 3.9Å; L237-L241 WeakPolarHBondContact O-CB 3.38Å; L237-L241 WeakPolarHBondContact O-CD1 3.48Å; L237-L241 WeakPolarHBondContact O-CG 3.32Å; L237-L241 PolarHBondContact O-N 2.67Å; L237-V253 HydrophobicContact CD1-CG2 4.41Å; L237-V253 HydrophobicContact CD2-CG1 4.46Å; L237-V253 HydrophobicContact CD2-CG2 4.32Å; L237-W256 HydrophobicContact CB-CD2 4.44Å; L237-W256 HydrophobicContact CB-CZ2 4.37Å; L237-W256 HydrophobicContact CD1-CD2 4.05Å; L237-W256 HydrophobicContact CD1-CE3 4.21Å; L237-W256 HydrophobicContact CD1-CG 4.28Å; L237-W256 HydrophobicContact CD2-CB 4.05Å; L237-W256 HydrophobicContact CD2-CD2 4.27Å; L237-W256 HydrophobicContact CD2-CG 3.74Å; L237-W256 HydrophobicContact CG-CD2 4.48Å; L237-W256 HydrophobicContact CG-CG 4.44Å; L237-F267 HydrophobicContact CB-CE2 4.49Å; L237-F267 HydrophobicContact CB-CZ 4.28Å; L237-F267 HydrophobicContact CD2-CE1 3.96Å; L237-F267 HydrophobicContact CD2-CE2 3.98Å; L237-F267 HydrophobicContact CD2-CZ 3.6Å; L237-F267 HydrophobicContact CG-CE1 4.45Å; L237-F267 HydrophobicContact CG-CE2 4.43Å; L237-F267 HydrophobicContact CG-CZ 3.85Å
238S94.7Very high93.7Very high0 Ų080.5 Ų80.50%037%0.373CS..Hα-helixtrans-68.3-35.8178.8-60.20000112.5M234 Q235 E236 L241 G242 W243 F267 W270M234-S238 WeakPolarHBondContact O-CB 3.49Å; M234-S238 PolarHBondContact O-N 2.7Å; M234-S238 VanDerWaalsContact O-N 3.08Å; M234-S238 PolarHBondContact O-OG 2.93Å; Q235-S238 CarbonylContact O-C 3.59Å; Q235-S238 WeakPolarHBondContact O-CA 3.15Å; Q235-S238 WeakPolarHBondContact O-CB 3.38Å; Q235-S238 PolarHBondContact O-N 2.77Å; E236-S238 VanDerWaalsContact C-N 3.28Å; E236-S238 PolarHBondContact O-N 3.39Å; S238-L241 CarbonylContact O-C 3.59Å; S238-L241 PolarHBondContact O-N 2.89Å; S238-G242 PolarHBondContact O-N 3.03Å; S238-W243 WeakPolarHBondContact O-CA 3.47Å; S238-W243 PolarHBondContact O-N 3.37Å; S238-F267 WeakPolarHBondContact OG-CZ 3.06Å; S238-W270 WeakPolarHBondContact OG-CZ3 2.95Å
239E94.2Very high93.7Very high94 Ų9477.5 Ų77.544%0.43935%0.346SS..Hα-helixtrans-67.2-47.4173.9-71.7166.4175.400111Q235 E236 L241 G242 W243Q235-E239 HydrophobicContact CG-CG 4.42Å; Q235-E239 VanDerWaalsContact CG-OE1 3.31Å; Q235-E239 WeakPolarHBondContact CG-OE1 3.41Å; Q235-E239 PolarHBondContact NE2-OE1 3.05Å; Q235-E239 WeakPolarHBondContact O-CG 3.3Å; Q235-E239 PolarHBondContact O-N 3.3Å; E236-E239 PolarHBondContact O-N 2.92Å; E239-L241 PolarHBondContact O-N 3.3Å; E239-G242 PolarHBondContact O-N 2.83Å; E239-W243 HydrophobicContact CG-CZ2 4.27Å
240R93.5Very high93.6Very high167 Ų16774.3 Ų74.363%0.6333%0.331SS*.Hα-helixtrans-55.5-32.8172.4-69.7171.4179.4-137.94.4112.8E236 L237E236-R240 VanDerWaalsContact O-CG 3.3Å; E236-R240 WeakPolarHBondContact O-CG 3.43Å; E236-R240 PolarHBondContact O-N 2.99Å; E236-R240 IonicContact OE1-CZ 3.14Å; E236-R240 VanDerWaalsContact OE1-CZ 3.25Å; E236-R240 IonicContact OE1-NE 2.79Å; E236-R240 PolarHBondContact OE1-NE 2.77Å; E236-R240 VanDerWaalsContact OE1-NE 3.15Å; E236-R240 IonicContact OE1-NH2 3.8Å; E236-R240 PolarHBondContact OE1-NH2 3.07Å; L237-R240 PolarHBondContact O-N 3.02Å
241L93.3Very high93.5Very high23 Ų2375.5 Ų75.512%0.1235%0.349CS..THydrogen-bonded Turntrans-89.45176.9-65168.8000114.4L237 S238 E239 W243 R244 L245 D249 V253 F267L237-L241 HydrophobicContact CD1-CD1 4.06Å; L237-L241 HydrophobicContact CD1-CG 4.3Å; L237-L241 HydrophobicContact CG-CD1 3.9Å; L237-L241 WeakPolarHBondContact O-CB 3.38Å; L237-L241 WeakPolarHBondContact O-CD1 3.48Å; L237-L241 WeakPolarHBondContact O-CG 3.32Å; L237-L241 PolarHBondContact O-N 2.67Å; S238-L241 CarbonylContact O-C 3.59Å; S238-L241 PolarHBondContact O-N 2.89Å; E239-L241 PolarHBondContact O-N 3.3Å; L241-W243 PolarHBondContact O-N 3.19Å; L241-W243 VanDerWaalsContact O-N 3.12Å; L241-R244 PolarHBondContact O-N 2.8Å; L241-L245 HydrophobicContact CD1-CD1 4.38Å; L241-D249 HydrophobicContact CD2-CB 3.62Å; L241-V253 HydrophobicContact CD1-CG2 3.52Å; L241-V253 HydrophobicContact CD2-CG2 4.17Å; L241-V253 HydrophobicContact CG-CG2 4.44Å; L241-F267 HydrophobicContact CD1-CE1 4.17Å; L241-F267 HydrophobicContact CD1-CZ 4.33Å
242G92.3Very high93.4Very high47 Ų4775 Ų7549%0.48535%0.354SS..THydrogen-bonded Turntrans57.427.9-175.200000113.7S238 E239 R244S238-G242 PolarHBondContact O-N 3.03Å; E239-G242 PolarHBondContact O-N 2.83Å; G242-R244 PolarHBondContact O-N 2.96Å
243W93.6Very high93.4Very high7 Ų768.7 Ų68.73%0.02733%0.325CS..THydrogen-bonded Turntrans51.536.9-173.6-6176.3000113.2Q235 S238 E239 L241 W270 M271 N274 K275 F278 L279Q235-W243 HydrophobicContact CG-CZ2 4.24Å; S238-W243 WeakPolarHBondContact O-CA 3.47Å; S238-W243 PolarHBondContact O-N 3.37Å; E239-W243 HydrophobicContact CG-CZ2 4.27Å; L241-W243 PolarHBondContact O-N 3.19Å; L241-W243 VanDerWaalsContact O-N 3.12Å; W243-W270 HydrophobicContact CH2-CH2 4.12Å; W243-W270 HydrophobicContact CH2-CZ3 4Å; W243-W270 HydrophobicContact CZ3-CZ3 4.01Å; W243-M271 HydrophobicContact CD2-CG 4.45Å; W243-M271 HydrophobicContact CE3-CG 3.62Å; W243-M271 HydrophobicContact CZ3-CG 4.15Å; W243-N274 HydrophobicContact CH2-CB 4.21Å; W243-N274 HydrophobicContact CZ3-CB 3.82Å; W243-K275 HydrophobicContact CB-CB 4.37Å; W243-K275 HydrophobicContact CB-CD 3.89Å; W243-K275 HydrophobicContact CB-CG 3.79Å; W243-K275 HydrophobicContact CD2-CB 4.45Å; W243-K275 VanDerWaalsContact CE3-CA 3.42Å; W243-K275 HydrophobicContact CE3-CB 3.9Å; W243-K275 HydrophobicContact CE3-CG 4.46Å; W243-K275 HydrophobicContact CG-CG 4.32Å; W243-K275 WeakPolarHBondContact O-CE 3.43Å; W243-K275 PolarHBondContact O-NZ 3.12Å; W243-F278 HydrophobicContact CH2-CB 3.93Å; W243-F278 AromaticContact CH2-CD2 3.26Å; W243-F278 HydrophobicContact CH2-CD2 3.26Å; W243-F278 AromaticContact CH2-CE2 3.93Å; W243-F278 HydrophobicContact CH2-CE2 3.93Å; W243-F278 AromaticContact CH2-CG 3.72Å; W243-F278 HydrophobicContact CH2-CG 3.72Å; W243-F278 HydrophobicContact CZ2-CB 3.38Å; W243-F278 HydrophobicContact CZ2-CD1 4.37Å; W243-F278 AromaticContact CZ2-CD2 3.64Å; W243-F278 HydrophobicContact CZ2-CD2 3.64Å; W243-F278 AromaticContact CZ2-CG 3.54Å; W243-F278 HydrophobicContact CZ2-CG 3.54Å; W243-F278 HydrophobicContact CZ3-CD2 4.1Å; W243-L279 HydrophobicContact CB-CD1 4.08Å; W243-L279 HydrophobicContact CB-CG 4.28Å; W243-L279 VanDerWaalsContact CD1-CD2 3.47Å; W243-L279 HydrophobicContact CG-CD1 4.35Å; W243-L279 HydrophobicContact CG-CD2 4.12Å; W243-L279 HydrophobicContact CG-CG 4.01Å
244R93.6Very high93.4Very high185 Ų18567 Ų6770%0.69832%0.323SS*.  trans-147.5105.2178.9-175.3177.9-176.7160.50.8111.1L241 G242 Q246L241-R244 PolarHBondContact O-N 2.8Å; G242-R244 PolarHBondContact O-N 2.96Å; R244-Q246 PolarHBondContact O-N 3.44Å
245L91.1Very high93.5Very high39 Ų3973.5 Ų73.520%0.20435%0.353CS..  trans-70.9117.7177.2-173.769.7000111.2L241 E250 V253 M271L241-L245 HydrophobicContact CD1-CD1 4.38Å; L245-E250 HydrophobicContact CD2-CG 4.41Å; L245-E250 HydrophobicContact CG-CG 4.46Å; L245-V253 HydrophobicContact CD1-CB 4Å; L245-V253 HydrophobicContact CD1-CG1 4.03Å; L245-V253 HydrophobicContact CD1-CG2 3.63Å; L245-M271 HydrophobicContact CB-CE 4.21Å
246Q91.7Very high93.4Very high81 Ų8174 Ų7438%0.37935%0.353SS..  trans-97.1164.5172.6-54.416584.700111.1R244 R248 D249R244-Q246 PolarHBondContact O-N 3.44Å; Q246-R248 VanDerWaalsContact C-N 3.32Å; Q246-R248 HydrophobicContact CB-CG 4.06Å; Q246-R248 VanDerWaalsContact NE2-CZ 3.33Å; Q246-R248 PolarHBondContact O-N 3.06Å; Q246-D249 VanDerWaalsContact CB-OD2 3.31Å; Q246-D249 WeakPolarHBondContact CB-OD2 3.4Å; Q246-D249 PolarHBondContact NE2-OD2 3.44Å; Q246-D249 PolarHBondContact O-N 2.81Å
247K92.6Very high93.4Very high172 Ų17270.6 Ų70.675%0.74834%0.337SS*.SBendtrans-61.8-37.5179.6-170.668-167.5167.80112.9D249 E250K247-D249 VanDerWaalsContact C-N 3.34Å; K247-D249 PolarHBondContact O-N 2.86Å; K247-E250 WeakPolarHBondContact CD-OE2 3.32Å; K247-E250 WeakPolarHBondContact CE-OE2 3.39Å; K247-E250 IonicContact NZ-OE2 2.95Å; K247-E250 PolarHBondContact NZ-OE2 3.3Å; K247-E250 WeakPolarHBondContact O-CB 3.31Å; K247-E250 PolarHBondContact O-N 2.85Å
248R92.8Very high93.4Very high180 Ų18078.4 Ų78.468%0.67937%0.366SS*.THydrogen-bonded Turntrans-65.2-33.3178.359.1173.8-177.599.2-24.1113.6Q246 E250Q246-R248 VanDerWaalsContact C-N 3.32Å; Q246-R248 HydrophobicContact CB-CG 4.06Å; Q246-R248 VanDerWaalsContact NE2-CZ 3.33Å; Q246-R248 PolarHBondContact O-N 3.06Å; R248-E250 VanDerWaalsContact C-N 3.28Å; R248-E250 PolarHBondContact O-N 2.98Å
249D92.3Very high93.4Very high19 Ų1983.8 Ų83.810%0.10240%0.395CS..THydrogen-bonded Turntrans-84.6-5.8-176.2-47.8-44.9000111.8L241 Q246 K247 A251 V252 V253L241-D249 HydrophobicContact CD2-CB 3.62Å; Q246-D249 VanDerWaalsContact CB-OD2 3.31Å; Q246-D249 WeakPolarHBondContact CB-OD2 3.4Å; Q246-D249 PolarHBondContact NE2-OD2 3.44Å; Q246-D249 PolarHBondContact O-N 2.81Å; K247-D249 VanDerWaalsContact C-N 3.34Å; K247-D249 PolarHBondContact O-N 2.86Å; D249-A251 PolarHBondContact O-N 2.86Å; D249-V252 PolarHBondContact O-N 3.17Å; D249-V253 WeakPolarHBondContact O-CB 3.46Å; D249-V253 VanDerWaalsContact O-CG2 3.3Å; D249-V253 WeakPolarHBondContact O-CG2 3.5Å; D249-V253 PolarHBondContact O-N 3.04Å
250E92.5Very high93.3Very high40 Ų4080 Ų8019%0.18738%0.378CS..Hα-helixtrans-63.9-22.7-173.3-82.3-146.3102.600115L245 K247 R248 D254 K264L245-E250 HydrophobicContact CD2-CG 4.41Å; L245-E250 HydrophobicContact CG-CG 4.46Å; K247-E250 WeakPolarHBondContact CD-OE2 3.32Å; K247-E250 WeakPolarHBondContact CE-OE2 3.39Å; K247-E250 IonicContact NZ-OE2 2.95Å; K247-E250 PolarHBondContact NZ-OE2 3.3Å; K247-E250 WeakPolarHBondContact O-CB 3.31Å; K247-E250 PolarHBondContact O-N 2.85Å; R248-E250 VanDerWaalsContact C-N 3.28Å; R248-E250 PolarHBondContact O-N 2.98Å; E250-D254 WeakPolarHBondContact O-CB 3.46Å; E250-D254 PolarHBondContact O-N 3.34Å; E250-K264 PolarHBondContact O-NZ 3.24Å; E250-K264 WeakPolarHBondContact OE1-CE 3.15Å; E250-K264 IonicContact OE1-NZ 3.25Å; E250-K264 PolarHBondContact OE1-NZ 1.84Å
251A93.2Very high93.3Very high73 Ų7375.2 Ų75.260%0.60338%0.38SS*.Hα-helixtrans-80.3-51.717600000111.2D249 V253 D254 E255D249-A251 PolarHBondContact O-N 2.86Å; A251-V253 VanDerWaalsContact C-N 3.25Å; A251-V253 PolarHBondContact O-N 2.96Å; A251-D254 WeakPolarHBondContact O-CB 3.31Å; A251-D254 PolarHBondContact O-N 3.45Å; A251-E255 PolarHBondContact O-N 3.01Å; A251-E255 VanDerWaalsContact O-N 3.07Å
252V92.1Very high93.3Very high90 Ų9074.4 Ų74.455%0.54538%0.376SS..Hα-helixtrans-55.7-42.6175.5-179.40000111D249 D254 E255 W256D249-V252 PolarHBondContact O-N 3.17Å; V252-D254 VanDerWaalsContact C-N 3.35Å; V252-D254 PolarHBondContact O-N 3.31Å; V252-E255 PolarHBondContact O-N 3.28Å; V252-W256 WeakPolarHBondContact O-CB 3.47Å; V252-W256 PolarHBondContact O-N 2.78Å
253V94.9Very high93.4Very high0 Ų074.4 Ų74.40%038%0.376CS..Hα-helixtrans-68.6-32.5177.4172.50000112.3L237 L241 L245 D249 A251 C257 K264 F267L237-V253 HydrophobicContact CD1-CG2 4.41Å; L237-V253 HydrophobicContact CD2-CG1 4.46Å; L237-V253 HydrophobicContact CD2-CG2 4.32Å; L241-V253 HydrophobicContact CD1-CG2 3.52Å; L241-V253 HydrophobicContact CD2-CG2 4.17Å; L241-V253 HydrophobicContact CG-CG2 4.44Å; L245-V253 HydrophobicContact CD1-CB 4Å; L245-V253 HydrophobicContact CD1-CG1 4.03Å; L245-V253 HydrophobicContact CD1-CG2 3.63Å; D249-V253 WeakPolarHBondContact O-CB 3.46Å; D249-V253 VanDerWaalsContact O-CG2 3.3Å; D249-V253 WeakPolarHBondContact O-CG2 3.5Å; D249-V253 PolarHBondContact O-N 3.04Å; A251-V253 VanDerWaalsContact C-N 3.25Å; A251-V253 PolarHBondContact O-N 2.96Å; V253-C257 WeakPolarHBondContact O-CB 3.35Å; V253-C257 PolarHBondContact O-N 2.95Å; V253-C257 PolarHBondContact O-SG 3.35Å; V253-K264 HydrophobicContact CG1-CG 4.48Å; V253-F267 HydrophobicContact CG1-CD1 3.7Å; V253-F267 HydrophobicContact CG1-CE1 3.82Å
254D95.1Very high93.4Very high60 Ų6076.3 Ų76.332%0.32139%0.385SS..Hα-helixtrans-68.7-43.2176.7-161.983.4000111.7E250 A251 V252 C257 R258 K264E250-D254 WeakPolarHBondContact O-CB 3.46Å; E250-D254 PolarHBondContact O-N 3.34Å; A251-D254 WeakPolarHBondContact O-CB 3.31Å; A251-D254 PolarHBondContact O-N 3.45Å; V252-D254 VanDerWaalsContact C-N 3.35Å; V252-D254 PolarHBondContact O-N 3.31Å; D254-C257 WeakPolarHBondContact O-CB 3.24Å; D254-C257 PolarHBondContact O-N 3.41Å; D254-R258 WeakPolarHBondContact O-CB 3.4Å; D254-R258 PolarHBondContact O-N 3.13Å; D254-R258 IonicContact OD2-CZ 3.86Å; D254-R258 IonicContact OD2-NH2 2.67Å; D254-R258 PolarHBondContact OD2-NH2 3.14Å; D254-K264 HydrophobicContact CB-CD 4.14Å; D254-K264 WeakPolarHBondContact OD1-CD 3.38Å
255E95Very high93.4Very high137 Ų13769.9 Ų69.964%0.6438%0.376SS*.Hα-helixtrans-62.3-50.7176-169.9179.5114.700112A251 V252 C257 R258 D259A251-E255 PolarHBondContact O-N 3.01Å; A251-E255 VanDerWaalsContact O-N 3.07Å; V252-E255 PolarHBondContact O-N 3.28Å; E255-C257 VanDerWaalsContact C-N 3.31Å; E255-C257 PolarHBondContact O-N 3.29Å; E255-R258 VanDerWaalsContact O-CB 3.28Å; E255-R258 WeakPolarHBondContact O-CB 3.21Å; E255-R258 PolarHBondContact O-N 3.01Å; E255-D259 PolarHBondContact O-N 3.45Å
256W93.2Very high93.6Very high60 Ų6070.9 Ų70.923%0.22738%0.384CS..Hα-helixtrans-62.8-37.7177-166.8-58.6000112L237 V252 R258 M260L237-W256 HydrophobicContact CB-CD2 4.44Å; L237-W256 HydrophobicContact CB-CZ2 4.37Å; L237-W256 HydrophobicContact CD1-CD2 4.05Å; L237-W256 HydrophobicContact CD1-CE3 4.21Å; L237-W256 HydrophobicContact CD1-CG 4.28Å; L237-W256 HydrophobicContact CD2-CB 4.05Å; L237-W256 HydrophobicContact CD2-CD2 4.27Å; L237-W256 HydrophobicContact CD2-CG 3.74Å; L237-W256 HydrophobicContact CG-CD2 4.48Å; L237-W256 HydrophobicContact CG-CG 4.44Å; V252-W256 WeakPolarHBondContact O-CB 3.47Å; V252-W256 PolarHBondContact O-N 2.78Å; W256-R258 VanDerWaalsContact C-N 3.31Å; W256-R258 PolarHBondContact O-N 2.8Å; W256-M260 VanDerWaalsContact CD1-SD 3.53Å; W256-M260 PolarHBondContact NE1-SD 3.22Å; W256-M260 WeakPolarHBondContact O-CG 3.41Å; W256-M260 PolarHBondContact O-N 2.88Å
257C94.8Very high93.7Very high3 Ų367.1 Ų67.12%0.0237%0.366CS..Hα-helixtrans-62.1-38172.9-81.50000112.5V253 D254 E255 G261 V262 K264 F267V253-C257 WeakPolarHBondContact O-CB 3.35Å; V253-C257 PolarHBondContact O-N 2.95Å; V253-C257 PolarHBondContact O-SG 3.35Å; D254-C257 WeakPolarHBondContact O-CB 3.24Å; D254-C257 PolarHBondContact O-N 3.41Å; E255-C257 VanDerWaalsContact C-N 3.31Å; E255-C257 PolarHBondContact O-N 3.29Å; C257-G261 PolarHBondContact O-N 3.33Å; C257-V262 CarbonylContact C-O 3.48Å; C257-V262 WeakPolarHBondContact CA-O 3.3Å; C257-V262 WeakPolarHBondContact CB-O 3.45Å; C257-V262 CarbonylContact O-C 3.55Å; C257-V262 PolarHBondContact O-N 3.39Å; C257-K264 HydrophobicContact CB-CB 4.43Å; C257-F267 VanDerWaalsContact SG-CB 3.57Å
258R95.4Very high93.8Very high170 Ų17063.5 Ų63.564%0.64235%0.35SS*.Hα-helixtrans-66.2-46.3178.3-163.8-176.5-54.71458.1111.5D254 E255 W256 G261D254-R258 WeakPolarHBondContact O-CB 3.4Å; D254-R258 PolarHBondContact O-N 3.13Å; D254-R258 IonicContact OD2-CZ 3.86Å; D254-R258 IonicContact OD2-NH2 2.67Å; D254-R258 PolarHBondContact OD2-NH2 3.14Å; E255-R258 VanDerWaalsContact O-CB 3.28Å; E255-R258 WeakPolarHBondContact O-CB 3.21Å; E255-R258 PolarHBondContact O-N 3.01Å; W256-R258 VanDerWaalsContact C-N 3.31Å; W256-R258 PolarHBondContact O-N 2.8Å; R258-G261 PolarHBondContact O-N 3.45Å; R258-G261 VanDerWaalsContact O-N 3.17Å
259D94.9Very high93.9Very high113 Ų11359.8 Ų59.860%0.60435%0.347SS*.Hα-helixtrans-57-49176.2178.768.4000112.2R233 E255 G261R233-D259 IonicContact NH1-OD2 2.93Å; R233-D259 PolarHBondContact NH1-OD2 2.9Å; E255-D259 PolarHBondContact O-N 3.45Å; D259-G261 PolarHBondContact O-N 2.9Å; D259-G261 VanDerWaalsContact O-N 3.16Å
260M92.3Very high94Very high15 Ų1560 Ų607%0.07435%0.347CS..THydrogen-bonded Turntrans-71.3-7.6179.5-61.2-175.6-53.300114.7Q230 R233 M234 W256 V262Q230-M260 PolarHBondContact NE2-O 2.8Å; R233-M260 HydrophobicContact CB-CG 4.21Å; R233-M260 HydrophobicContact CB-SD 3.43Å; R233-M260 WeakPolarHBondContact CB-SD 3.41Å; M234-M260 HydrophobicContact CG-CE 3.54Å; M234-M260 HydrophobicContact CG-SD 3.83Å; W256-M260 VanDerWaalsContact CD1-SD 3.53Å; W256-M260 PolarHBondContact NE1-SD 3.22Å; W256-M260 WeakPolarHBondContact O-CG 3.41Å; W256-M260 PolarHBondContact O-N 2.88Å; M260-V262 VanDerWaalsContact C-N 3.3Å; M260-V262 HydrophobicContact CB-CB 4.47Å; M260-V262 HydrophobicContact CB-CG2 4.14Å; M260-V262 HydrophobicContact CE-CB 4.4Å; M260-V262 PolarHBondContact O-N 3.03Å
261G93.5Very high94Very high66 Ų6658.9 Ų58.968%0.6834%0.342SS*.THydrogen-bonded Turntrans67.125.4-170.800000114.3C257 R258 D259C257-G261 PolarHBondContact O-N 3.33Å; R258-G261 PolarHBondContact O-N 3.45Å; R258-G261 VanDerWaalsContact O-N 3.17Å; D259-G261 PolarHBondContact O-N 2.9Å; D259-G261 VanDerWaalsContact O-N 3.16Å
262V93Very high93.9Very high6 Ų662 Ų624%0.03634%0.344CS..  trans-115.4112.2-177.2179.40000110.3F226 M234 C257 M260 K264 V266 F267F226-V262 HydrophobicContact CD1-CG2 4.11Å; F226-V262 HydrophobicContact CE1-CG1 3.97Å; F226-V262 HydrophobicContact CE1-CG2 4.15Å; M234-V262 HydrophobicContact CE-CG1 3.88Å; M234-V262 HydrophobicContact SD-CG1 4.16Å; M234-V262 HydrophobicContact SD-CG2 4.07Å; C257-V262 CarbonylContact C-O 3.48Å; C257-V262 WeakPolarHBondContact CA-O 3.3Å; C257-V262 WeakPolarHBondContact CB-O 3.45Å; C257-V262 CarbonylContact O-C 3.55Å; C257-V262 PolarHBondContact O-N 3.39Å; M260-V262 VanDerWaalsContact C-N 3.3Å; M260-V262 HydrophobicContact CB-CB 4.47Å; M260-V262 HydrophobicContact CB-CG2 4.14Å; M260-V262 HydrophobicContact CE-CB 4.4Å; M260-V262 PolarHBondContact O-N 3.03Å; V262-K264 PolarHBondContact O-N 3.49Å; V262-V266 HydrophobicContact CG1-CB 4.23Å; V262-V266 HydrophobicContact CG1-CG1 4.21Å; V262-F267 HydrophobicContact CG1-CB 4.38Å
263G92.9Very high93.9Very high47 Ų4763.4 Ų63.449%0.48535%0.348SS..  trans-57.1135.4-179.900000113.5G265 V266 F267G263-G265 PolarHBondContact O-N 3.46Å; G263-V266 WeakPolarHBondContact O-CA 3.49Å; G263-V266 VanDerWaalsContact O-CB 3.23Å; G263-V266 WeakPolarHBondContact O-CB 3.38Å; G263-V266 PolarHBondContact O-N 3.23Å; G263-F267 PolarHBondContact O-N 3.02Å
264K94.3Very high93.7Very high46 Ų4664.6 Ų64.620%0.236%0.355CS..Hα-helixtrans-50.4-35.7-177.4176.5174.1169.7-177.90115.2E250 V253 D254 C257 V262 K268E250-K264 PolarHBondContact O-NZ 3.24Å; E250-K264 WeakPolarHBondContact OE1-CE 3.15Å; E250-K264 IonicContact OE1-NZ 3.25Å; E250-K264 PolarHBondContact OE1-NZ 1.84Å; V253-K264 HydrophobicContact CG1-CG 4.48Å; D254-K264 HydrophobicContact CB-CD 4.14Å; D254-K264 WeakPolarHBondContact OD1-CD 3.38Å; C257-K264 HydrophobicContact CB-CB 4.43Å; V262-K264 PolarHBondContact O-N 3.49Å; K264-K268 WeakPolarHBondContact O-CB 3.41Å; K264-K268 PolarHBondContact O-N 2.9Å
265G93.8Very high93.4Very high51 Ų5164.6 Ų64.653%0.52635%0.351SS..Hα-helixtrans-65.8-37.2173.300000113.3G263 V269G263-G265 PolarHBondContact O-N 3.46Å; G265-V269 WeakPolarHBondContact O-CG2 3.47Å; G265-V269 PolarHBondContact O-N 2.88Å
266V94.1Very high92.7Very high60 Ų6065.2 Ų65.236%0.36435%0.354SS..Hα-helixtrans-69.4-45175.2-176.90000110.4F226 V262 G263 K268 V269 W270F226-V266 HydrophobicContact CE1-CG1 3.95Å; F226-V266 HydrophobicContact CZ-CG1 3.51Å; V262-V266 HydrophobicContact CG1-CB 4.23Å; V262-V266 HydrophobicContact CG1-CG1 4.21Å; G263-V266 WeakPolarHBondContact O-CA 3.49Å; G263-V266 VanDerWaalsContact O-CB 3.23Å; G263-V266 WeakPolarHBondContact O-CB 3.38Å; G263-V266 PolarHBondContact O-N 3.23Å; V266-K268 PolarHBondContact O-N 2.83Å; V266-V269 PolarHBondContact O-N 3Å; V266-W270 WeakPolarHBondContact O-CB 3.47Å; V266-W270 PolarHBondContact O-N 2.78Å
267F95Very high92.2Very high1 Ų166.4 Ų66.40%0.00437%0.365CS..Hα-helixtrans-57.1-46.1173.6175.5-104.6000112M234 L237 S238 L241 V253 C257 V262 G263 V269 W270 M271M234-F267 HydrophobicContact CB-CD2 4.19Å; M234-F267 HydrophobicContact CB-CE2 4.06Å; M234-F267 HydrophobicContact CE-CB 4.42Å; M234-F267 HydrophobicContact CE-CD2 3.8Å; M234-F267 HydrophobicContact CG-CD2 4.01Å; M234-F267 HydrophobicContact CG-CE2 4.33Å; M234-F267 WeakPolarHBondContact O-CE2 2.95Å; L237-F267 HydrophobicContact CB-CE2 4.49Å; L237-F267 HydrophobicContact CB-CZ 4.28Å; L237-F267 HydrophobicContact CD2-CE1 3.96Å; L237-F267 HydrophobicContact CD2-CE2 3.98Å; L237-F267 HydrophobicContact CD2-CZ 3.6Å; L237-F267 HydrophobicContact CG-CE1 4.45Å; L237-F267 HydrophobicContact CG-CE2 4.43Å; L237-F267 HydrophobicContact CG-CZ 3.85Å; S238-F267 WeakPolarHBondContact OG-CZ 3.06Å; L241-F267 HydrophobicContact CD1-CE1 4.17Å; L241-F267 HydrophobicContact CD1-CZ 4.33Å; V253-F267 HydrophobicContact CG1-CD1 3.7Å; V253-F267 HydrophobicContact CG1-CE1 3.82Å; C257-F267 VanDerWaalsContact SG-CB 3.57Å; V262-F267 HydrophobicContact CG1-CB 4.38Å; G263-F267 PolarHBondContact O-N 3.02Å; F267-V269 PolarHBondContact O-N 3.22Å; F267-W270 HydrophobicContact CE2-CE3 4.42Å; F267-W270 PolarHBondContact O-N 3.19Å; F267-M271 HydrophobicContact CE1-SD 4.35Å; F267-M271 HydrophobicContact CZ-SD 4.41Å; F267-M271 WeakPolarHBondContact O-CB 3.49Å; F267-M271 PolarHBondContact O-N 3.29Å
268K95Very high91.4Very high96 Ų9669 Ų6942%0.41738%0.376SS..Hα-helixtrans-57.3-44.8176.9-176.3-179.8-63.8-175.30112.7K264 V266 H272K264-K268 WeakPolarHBondContact O-CB 3.41Å; K264-K268 PolarHBondContact O-N 2.9Å; V266-K268 PolarHBondContact O-N 2.83Å; K268-H272 WeakPolarHBondContact O-CB 3.23Å; K268-H272 PolarHBondContact O-N 3.17Å; K268-H272 VanDerWaalsContact O-N 3.09Å
269V93.6Very high90.3Very high102 Ų10265.6 Ų65.662%0.61837%0.37SS*.Hα-helixtrans-68.7-40.9177.1172.80000111.3G265 V266 F267 H272 N273G265-V269 WeakPolarHBondContact O-CG2 3.47Å; G265-V269 PolarHBondContact O-N 2.88Å; V266-V269 PolarHBondContact O-N 3Å; F267-V269 PolarHBondContact O-N 3.22Å; V269-H272 PolarHBondContact O-N 3.46Å; V269-N273 WeakPolarHBondContact O-CB 3.38Å; V269-N273 PolarHBondContact O-N 2.92Å
270W94.2Very high88.7Confident25 Ų2562.6 Ų62.610%0.09537%0.366CS..Hα-helixtrans-61.9-47.8176.1-179.896.7000111.7F226 K231 M234 Q235 S238 W243 V266 F267 H272 N273 N274F226-W270 AromaticContact CE2-CD1 3.74Å; K231-W270 HydrophobicContact CB-CZ2 4.49Å; M234-W270 HydrophobicContact CB-CD2 4.35Å; M234-W270 HydrophobicContact CB-CE3 3.98Å; M234-W270 HydrophobicContact CB-CH2 3.79Å; M234-W270 HydrophobicContact CB-CZ2 4.12Å; M234-W270 HydrophobicContact CB-CZ3 3.7Å; M234-W270 HydrophobicContact CE-CB 3.6Å; M234-W270 HydrophobicContact CE-CD2 3.47Å; M234-W270 VanDerWaalsContact CE-CD2 3.47Å; M234-W270 HydrophobicContact CE-CE3 3.84Å; M234-W270 HydrophobicContact CE-CG 3.35Å; M234-W270 WeakPolarHBondContact O-CZ3 3.36Å; M234-W270 HydrophobicContact SD-CD2 4.44Å; Q235-W270 HydrophobicContact CB-CH2 4.08Å; S238-W270 WeakPolarHBondContact OG-CZ3 2.95Å; W243-W270 HydrophobicContact CH2-CH2 4.12Å; W243-W270 HydrophobicContact CH2-CZ3 4Å; W243-W270 HydrophobicContact CZ3-CZ3 4.01Å; V266-W270 WeakPolarHBondContact O-CB 3.47Å; V266-W270 PolarHBondContact O-N 2.78Å; F267-W270 HydrophobicContact CE2-CE3 4.42Å; F267-W270 PolarHBondContact O-N 3.19Å; W270-H272 VanDerWaalsContact C-N 3.35Å; W270-H272 PolarHBondContact O-N 2.71Å; W270-N273 PolarHBondContact O-N 3.18Å; W270-N274 PolarHBondContact NE1-ND2 3.06Å; W270-N274 WeakPolarHBondContact O-CB 3.5Å; W270-N274 PolarHBondContact O-N 3.44Å; W270-N274 PolarHBondContact O-ND2 2.86Å
271M94.1Very high86.5Confident15 Ų1563.8 Ų63.87%0.07438%0.382CS..Hα-helixtrans-61.2-43.9178.4-174.1-170.375.500110.5W243 L245 F267 N274 K275W243-M271 HydrophobicContact CD2-CG 4.45Å; W243-M271 HydrophobicContact CE3-CG 3.62Å; W243-M271 HydrophobicContact CZ3-CG 4.15Å; L245-M271 HydrophobicContact CB-CE 4.21Å; F267-M271 HydrophobicContact CE1-SD 4.35Å; F267-M271 HydrophobicContact CZ-SD 4.41Å; F267-M271 WeakPolarHBondContact O-CB 3.49Å; F267-M271 PolarHBondContact O-N 3.29Å; M271-N274 PolarHBondContact O-N 3.25Å; M271-K275 VanDerWaalsContact O-CB 3.31Å; M271-K275 WeakPolarHBondContact O-CB 3.15Å; M271-K275 PolarHBondContact O-N 2.85Å
272H91.1Very high84.1Confident140 Ų14068.2 Ų68.265%0.64839%0.385SS*.Hα-helixtrans-60.8-44.6174.6176.672.4000112.6K268 V269 W270K268-H272 WeakPolarHBondContact O-CB 3.23Å; K268-H272 PolarHBondContact O-N 3.17Å; K268-H272 VanDerWaalsContact O-N 3.09Å; V269-H272 PolarHBondContact O-N 3.46Å; W270-H272 VanDerWaalsContact C-N 3.35Å; W270-H272 PolarHBondContact O-N 2.71Å
273N90.6Very high81.8Confident118 Ų11872.6 Ų72.663%0.63142%0.416SS*.Hα-helixtrans-67.2-35.4-179.9-175.1-113.9000113V269 W270V269-N273 WeakPolarHBondContact O-CB 3.38Å; V269-N273 PolarHBondContact O-N 2.92Å; W270-N273 PolarHBondContact O-N 3.18Å
274N91Very high79.6Confident26 Ų2674 Ų7414%0.13942%0.423CS..Hα-helixtrans-92.6-20.2-174.6-74.9-78.8000114.1W243 W270 M271 H276 N277 F278W243-N274 HydrophobicContact CH2-CB 4.21Å; W243-N274 HydrophobicContact CZ3-CB 3.82Å; W270-N274 PolarHBondContact NE1-ND2 3.06Å; W270-N274 WeakPolarHBondContact O-CB 3.5Å; W270-N274 PolarHBondContact O-N 3.44Å; W270-N274 PolarHBondContact O-ND2 2.86Å; M271-N274 PolarHBondContact O-N 3.25Å; N274-H276 PolarHBondContact O-N 3.32Å; N274-N277 WeakPolarHBondContact O-CA 3.48Å; N274-N277 WeakPolarHBondContact O-CB 3.48Å; N274-N277 PolarHBondContact O-N 3.06Å; N274-F278 HydrophobicContact CB-CD2 4.05Å; N274-F278 HydrophobicContact CB-CE2 3.92Å; N274-F278 WeakPolarHBondContact O-CD2 3.4Å; N274-F278 PolarHBondContact O-N 3.23Å
275K88.8Confident77.5Confident59 Ų5982 Ų8226%0.25745%0.452SS..Hα-helixtrans-43.3-44.9-176178.8168.9-173.2162.30114.8W243 M271 N277 F278 L279W243-K275 HydrophobicContact CB-CB 4.37Å; W243-K275 HydrophobicContact CB-CD 3.89Å; W243-K275 HydrophobicContact CB-CG 3.79Å; W243-K275 HydrophobicContact CD2-CB 4.45Å; W243-K275 VanDerWaalsContact CE3-CA 3.42Å; W243-K275 HydrophobicContact CE3-CB 3.9Å; W243-K275 HydrophobicContact CE3-CG 4.46Å; W243-K275 HydrophobicContact CG-CG 4.32Å; W243-K275 WeakPolarHBondContact O-CE 3.43Å; W243-K275 PolarHBondContact O-NZ 3.12Å; M271-K275 VanDerWaalsContact O-CB 3.31Å; M271-K275 WeakPolarHBondContact O-CB 3.15Å; M271-K275 PolarHBondContact O-N 2.85Å; K275-N277 VanDerWaalsContact C-N 3.35Å; K275-F278 PolarHBondContact O-N 3.19Å; K275-L279 HydrophobicContact CD-CD1 4.14Å; K275-L279 HydrophobicContact CG-CD1 3.67Å; K275-L279 HydrophobicContact CG-CG 4.13Å; K275-L279 VanDerWaalsContact O-CB 3.32Å; K275-L279 WeakPolarHBondContact O-CB 3.34Å; K275-L279 PolarHBondContact O-N 2.91Å
276H81.3Confident75.4Confident150 Ų15088.4 Ų88.469%0.69446%0.46SS*.Hα-helixtrans-75.1-19.9-178.8-66.9-76.4000114.4N274N274-H276 PolarHBondContact O-N 3.32Å
277N82.8Confident73.3Confident86 Ų8689.8 Ų89.846%0.4647%0.472SS..Hα-helixtrans-74.7-29.3175-64.4-25.2000112.1N274 K275N274-N277 WeakPolarHBondContact O-CA 3.48Å; N274-N277 WeakPolarHBondContact O-CB 3.48Å; N274-N277 PolarHBondContact O-N 3.06Å; K275-N277 VanDerWaalsContact C-N 3.35Å
278F78.4Confident71.1Confident57 Ų5794.1 Ų94.125%0.2550%0.498CS..Hα-helixtrans-105.4-42.5-174.2-65.6-81.7000113Q235 W243 N274 K275 G280Q235-F278 HydrophobicContact CG-CD1 4.14Å; Q235-F278 HydrophobicContact CG-CE1 3.99Å; Q235-F278 HydrophobicContact CG-CZ 4.4Å; Q235-F278 VanDerWaalsContact OE1-CE1 3.31Å; W243-F278 HydrophobicContact CH2-CB 3.93Å; W243-F278 AromaticContact CH2-CD2 3.26Å; W243-F278 HydrophobicContact CH2-CD2 3.26Å; W243-F278 AromaticContact CH2-CE2 3.93Å; W243-F278 HydrophobicContact CH2-CE2 3.93Å; W243-F278 AromaticContact CH2-CG 3.72Å; W243-F278 HydrophobicContact CH2-CG 3.72Å; W243-F278 HydrophobicContact CZ2-CB 3.38Å; W243-F278 HydrophobicContact CZ2-CD1 4.37Å; W243-F278 AromaticContact CZ2-CD2 3.64Å; W243-F278 HydrophobicContact CZ2-CD2 3.64Å; W243-F278 AromaticContact CZ2-CG 3.54Å; W243-F278 HydrophobicContact CZ2-CG 3.54Å; W243-F278 HydrophobicContact CZ3-CD2 4.1Å; N274-F278 HydrophobicContact CB-CD2 4.05Å; N274-F278 HydrophobicContact CB-CE2 3.92Å; N274-F278 WeakPolarHBondContact O-CD2 3.4Å; N274-F278 PolarHBondContact O-N 3.23Å; K275-F278 PolarHBondContact O-N 3.19Å; F278-G280 PolarHBondContact O-N 3.16Å
279L72.6Confident69Low98 Ų9894.5 Ų94.551%0.51351%0.513SS..THydrogen-bonded Turntrans-71.8-12.8173.8-68.6-169.8000114.2W243 K275 G281W243-L279 HydrophobicContact CB-CD1 4.08Å; W243-L279 HydrophobicContact CB-CG 4.28Å; W243-L279 VanDerWaalsContact CD1-CD2 3.47Å; W243-L279 HydrophobicContact CG-CD1 4.35Å; W243-L279 HydrophobicContact CG-CD2 4.12Å; W243-L279 HydrophobicContact CG-CG 4.01Å; K275-L279 HydrophobicContact CD-CD1 4.14Å; K275-L279 HydrophobicContact CG-CD1 3.67Å; K275-L279 HydrophobicContact CG-CG 4.13Å; K275-L279 VanDerWaalsContact O-CB 3.32Å; K275-L279 WeakPolarHBondContact O-CB 3.34Å; K275-L279 PolarHBondContact O-N 2.91Å; L279-G281 PolarHBondContact O-N 3.32Å
280G59.6Low66.9Low50 Ų5094 Ų9452%0.51552%0.52SS..THydrogen-bonded Turntrans-75.80.9-177.300000115.2F278F278-G280 PolarHBondContact O-N 3.16Å
281G46.8Very low64.8Low41 Ų4197.1 Ų97.142%0.42355%0.546SS..  trans75.2138.1-170.600000112.2L279 S283L279-G281 PolarHBondContact O-N 3.32Å; G281-S283 PolarHBondContact O-N 3.12Å
282H42.3Very low62.7Low158 Ų158101.8 Ų101.873%0.73158%0.58SS**SBendtrans-59.7137.2169-68.8-100.5000109.5A284H282-A284 VanDerWaalsContact C-N 3.29Å; H282-A284 PolarHBondContact O-N 2.8Å
283S45.9Very low60.4Low98 Ų9898.9 Ų98.969%0.68559%0.587SS**SBendtrans62.4-29.7173.6-59.40000120.9G281 R285G281-S283 PolarHBondContact O-N 3.12Å; S283-R285 PolarHBondContact O-N 3.03Å
284A47.4Very low58.2Low76 Ų7698.1 Ų98.163%0.62860%0.598SS**THydrogen-bonded Turntrans-67.9-13.5-159.100000118.7H282H282-A284 VanDerWaalsContact C-N 3.29Å; H282-A284 PolarHBondContact O-N 2.8Å
285R49.5Very low55.7Low215 Ų215101.9 Ų101.981%0.81163%0.633SS**THydrogen-bonded Turntrans-129.26.9-175.5-91.9-173.7177.9-91.31.4117S283S283-R285 PolarHBondContact O-N 3.03Å
286R50.1Low53.3Low186 Ų186103.6 Ų103.670%0.70266%0.657SS**THydrogen-bonded Turntrans-95.4-17172.7-84.6-175.6-81.5-98.60.3114.1
287S49.3Very low51.5Low89 Ų89104 Ų10462%0.62266%0.664SS**SBendtrans-97.3-5.3-175.1-46.10000115.3
288V49.6Very low49.7Very low91 Ų91106.8 Ų106.855%0.55268%0.678SS**SBendtrans-104.816.1-175.2-62.60000114.1
289S50.1Low48.1Very low104 Ų104113.3 Ų113.373%0.72771%0.709SS**SBendtrans-1389.4177.2-51.70000113.4
290A50.3Low46.8Very low93 Ų93114.9 Ų114.977%0.76972%0.723SS**SBendtrans-106.7-1.6174.600000113
291S50.1Low46.3Very low90 Ų90117.8 Ų117.863%0.62973%0.733SS**SBendtrans-118.12.5-171.348.30000114.7
292S48.3Very low45.9Very low112 Ų112121.4 Ų121.478%0.78375%0.751SS**SBendtrans-101.216.7-175.7-49.30000114.5
293G43Very low46Very low79 Ų79118.2 Ų118.281%0.81475%0.751SS**SBendtrans-126.66.8-171.900000116.6
294A44Very low45.9Very low102 Ų102121.3 Ų121.384%0.84376%0.76SS**SBendtrans-12730.3-169.500000114.3
295A40.2Very low45.7Very low106 Ų106122.7 Ų122.788%0.87677%0.772SS**SBendtrans-136.247.7179.200000112.1
296A38.5Very low45.2Very low94 Ų94115.8 Ų115.878%0.77777%0.768SS**  trans-151.882.9173.100000110.3
297L43Very low44.8Very low158 Ų158112 Ų11283%0.82778%0.776SS**  trans-169128157.6-101.9163000110.2
298L44Very low44.7Very low145 Ų145112.4 Ų112.476%0.75979%0.785SS**  trans68.496.5152.8-52.6170000119.8
299Q45.4Very low44.6Very low194 Ų194112.6 Ų112.691%0.90780%0.796SS**  trans-154.397.1130.8-120.5153.974.500112.3
300T44.5Very low44.7Very low131 Ų131112.7 Ų112.780%0.80479%0.794SS**  trans-90.5144.3147.140.20000107.4
301P49.4Very low44.4Very low111 Ų111114 Ų11472%0.72180%0.798SS**  -145.2153.6103.738.9-24.3000116
302C38.6Very low44.5Very low118 Ų118119.2 Ų119.280%0.79781%0.81SS**  trans14.2142157.364.60000124.7
303A44Very low44.8Very low90 Ų90120 Ų12074%0.74481%0.805SS**  trans106101.7130.800000120.8
304N43.8Very low45Very low163 Ų163122.1 Ų122.187%0.87280%0.804SS**  trans72.4135.6137.5-85.50.2000123.2
305A44.1Very low45Very low106 Ų106121.3 Ų121.388%0.87679%0.793SS**  trans58.9133.2164.800000116.7
306G38.1Very low45.2Very low70 Ų70127.7 Ų127.772%0.72279%0.794SS**  cis147.8134.63.800000109.8
307A42.9Very low45.9Very low106 Ų106131.8 Ų131.888%0.87680%0.802SS**  trans74.7145.8173.300000119.8
308A45.7Very low46.7Very low97 Ų97130.4 Ų130.480%0.80280%0.8SS**  trans67.5102.7157.400000120
309A47.7Very low47.7Very low96 Ų96129 Ų12979%0.79380%0.8SS**  trans-68.7162.6151.200000111
310P53.8Low49Very low106 Ų106125.5 Ų125.569%0.68879%0.794SS**  -137.2152.4117.436.9-27.2000114.7F312P310-F312 HydrophobicContact CG-CE2 4.47Å
311S44.3Very low50Low121 Ų121124.5 Ų124.585%0.84679%0.79SS**  trans-58.5139.6172-50.60000112.6
312F50.5Low50.3Low199 Ų199125.1 Ų125.187%0.87379%0.793SS**  trans-125.7144.9162.9-95.5-89.8000112.5P310P310-F312 HydrophobicContact CG-CE2 4.47Å
313N54.6Low51.4Low127 Ų127126.4 Ų126.468%0.67980%0.797SS**  trans-95130.3-157.4179.8-10.5000112S315N313-S315 VanDerWaalsContact C-N 3.28Å; N313-S315 PolarHBondContact O-N 2.9Å
314P48.4Very low51.6Low124 Ų124129.8 Ų129.881%0.80580%0.802SS**SBendtrans-77.274177.234.1-36.2000111.4
315S44.6Very low51.5Low86 Ų86128.2 Ų128.260%0.60180%0.798SS**  trans-155.274.2175.5-78.70000112N313N313-S315 VanDerWaalsContact C-N 3.28Å; N313-S315 PolarHBondContact O-N 2.9Å
316R43.2Very low51.6Low240 Ų240128.7 Ų128.791%0.90680%0.795SS**  trans170.782.8155.7-95.1155.7-165.1-81.21.6111.2
317L52.5Low52Low179 Ų179130.7 Ų130.794%0.93780%0.798SS**  trans-134.799156.6-77.3176.9000108.5
318T60.1Low52.4Low130 Ų130131.7 Ų131.780%0.79880%0.796SS**PPolyproline II helixtrans-70.4144.6175.4390000111
319P66.6Low52.7Low115 Ų115133.9 Ų133.975%0.74780%0.8SS**PPolyproline II helixtrans-69.2148.1174.930.4-35000111.3
320P72Confident52.3Low121 Ų121132.4 Ų132.479%0.78679%0.793SS**PPolyproline II helixtrans-69.5144171.929.2-33.8000111.3
321P65.1Low51.9Low110 Ų110137.7 Ų137.771%0.71481%0.806SS**PPolyproline II helixtrans-76.7160.618032.1-35.8000112.8
322P56.3Low52Low123 Ų123139 Ų13980%0.79980%0.804SS**PPolyproline II helixtrans-72.1131.3177.930.1-34.4000111.5
323V62Low51.9Low145 Ų145137.4 Ų137.488%0.87980%0.803SS**PPolyproline II helixtrans-83.2122.7175.5-178.10000109.8
324L48.3Very low51.5Low162 Ų162139 Ų13985%0.84881%0.811SS**PPolyproline II helixtrans-89.3161.2174-77.3172.2000112.4
325T41Very low51Low129 Ų129136.4 Ų136.479%0.79181%0.807SS**PPolyproline II helixtrans-60.4149.7-168.3-168.60000116.2
326S46.8Very low50.7Low116 Ų116137.2 Ų137.281%0.81182%0.819SS**  trans-164.9111.8148.1-79.60000110.7
327S45.2Very low50.5Low112 Ų112130.2 Ų130.278%0.78381%0.812SS**  trans36.7133.8158-55.10000121
328P52.1Low49.9Very low128 Ų128127.1 Ų127.183%0.83181%0.806SS**  -129.2165.297.436.8-31.2000115
329T50.9Low49.2Very low143 Ų143126.6 Ų126.688%0.87781%0.807SS**  trans-64.3144.4-175.342.90000114.3
330G40.8Very low48.5Very low64 Ų64126.6 Ų126.666%0.6681%0.81SS**  trans-78.4170-164.500000118.2
331F43.9Very low47.8Very low217 Ų217126.6 Ų126.695%0.95281%0.81SS**  trans-141.4131138.8-86.7-75.7000106.7
332N46.2Very low47.3Very low150 Ų150127 Ų12780%0.80281%0.812SS**  trans-132.6125-172-171.412.4000109.4
333I49.5Very low46.7Very low165 Ų165127.1 Ų127.185%0.84681%0.811SS**  trans-144.499.1176.9-33.2172.1000107.9
334N45.4Very low46.3Very low160 Ų160126.2 Ų126.286%0.85681%0.805SS**  trans-159.9146.6175.6-128.823.5000110.8
335G39.1Very low46.3Very low70 Ų70124.9 Ų124.972%0.72280%0.804SS**  trans94.2106.4179.600000112.2
336A38.3Very low46.5Very low103 Ų103122.9 Ų122.985%0.85180%0.801SS**  cis78.6115.836.800000115.2
337A38.2Very low46.6Very low93 Ų93124.2 Ų124.277%0.76980%0.799SS**  trans78.4129.5154.900000121.3
338S39.7Very low47.1Very low114 Ų114126.2 Ų126.280%0.79780%0.796SS**  trans73.1102.5145.7-54.80000120.3
339S46.7Very low47Very low118 Ų118125.7 Ų125.783%0.82579%0.79SS**  176.4142.4106.340.30000114.6
340S50.2Low46.8Very low115 Ų115125.1 Ų125.180%0.80478%0.782SS**  trans11.8143.7158.4-46.20000123.9
341P58.6Low47.5Very low122 Ų122129.8 Ų129.879%0.79279%0.792SS**  trans-95.2175.8175.440.7-36.8000113.9
342P54.2Low48Very low118 Ų118122.5 Ų122.577%0.76677%0.772SS**  trans-134.8150.7135.736.9-25.3000115.8
343T42.7Very low48.4Very low126 Ų126123.5 Ų123.577%0.77378%0.777SS**  trans-20.9145.3145.3-20.10000113.7
344V53.7Low48.2Very low125 Ų125118.8 Ų118.876%0.75877%0.769SS**  cis-147.8-178.136.3-121.20000108.8
345T48.2Very low48.5Very low134 Ų134115.8 Ų115.882%0.82277%0.767SS**  cis-148.2-175.720.9-21.70000112.1
346A46.8Very low49.5Very low88 Ų88118 Ų11873%0.72777%0.771SS**  trans-84156.2177.400000115
347D47.7Very low50.7Low144 Ų144118.5 Ų118.577%0.7777%0.768SS**  -170.8136.3105.7-157.1-136.1000112.4
348H55.5Low51.9Low153 Ų153119.7 Ų119.771%0.70877%0.768SS**  trans27145.7144.2-101.3-87.3000122.5
349T49.9Very low52.8Low117 Ų117123 Ų12372%0.71877%0.771SS**  cis-152.7150.422.6-57.20000113.6
350D48.6Very low53.4Low132 Ų132122.5 Ų122.571%0.70677%0.768SS**  trans-34.4144.3161.2-143.6-82000118.8
351N55.4Low53.7Low161 Ų161125.7 Ų125.786%0.86180%0.801SS**  -157.6147125.4-154.1-7.6000111.1
352A54.1Low53.5Low64 Ų64125.9 Ų125.953%0.52980%0.801SS.*  trans-125.4-174.1-162.500000114.8
353N52.9Low53.4Low171 Ų171126.3 Ų126.391%0.91480%0.803SS**  trans76.1140.2-177.7-57.8-43.6000116
354G45.4Very low54Low67 Ų67126.3 Ų126.369%0.69181%0.805SS**  cis175.7125.1-5.600000107.9
355A53.2Low54Low97 Ų97126.4 Ų126.480%0.80281%0.808SS**  97.7137.884.500000113.9
356S59.1Low54.4Low116 Ų116125.9 Ų125.981%0.81181%0.807SS**  trans81.5145.9172.1-31.50000117.7
357S64.7Low54.9Low113 Ų113128.5 Ų128.579%0.7981%0.812SS**  cis-172.4147.1-25.5-92.70000107.9
358P62.9Low55.4Low119 Ų119127.4 Ų127.477%0.77382%0.815SS**  trans-108140.3174.636.3-28.3000113.5
359H57.6Low55.4Low183 Ų183125.4 Ų125.485%0.84782%0.823SS**  trans-160.3146.5159.7-135-92.5000114.9
360S59.6Low55.9Low108 Ų108126.1 Ų126.176%0.75583%0.832SS**  trans66.5104.9159-67.60000121.4
361A56.7Low56.5Low182 Ų182125.5 Ų125.5100%1.50484%0.843SS**  -147.2012600000108.8

Retrieved 361 of 361 residues in 535 ms (Link to these results)