A0A096MMV1_PAPAN Loading...

RNA polymerase III subunit G

AlphaFold DB , UniProt , Accession A0A096MMV1, Species PAPAN (Papio anubis, Olive baboon), Gene POLR3G, Length 223 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M38.2Very low56.3Low250 Ų250142.9 Ų142.9100%1.23284%0.843SS**  0131.30-62.2-178.6179.300108
2A42.7Very low58.6Low94 Ų94143.2 Ų143.278%0.77782%0.82SS**  trans-103.8121.3176.300000109.5N4A2-N4 PolarHBondContact O-N 3.03Å
3G50.5Low61.1Low76 Ų76144.2 Ų144.278%0.78483%0.831SS**  trans-85.4107179.300000111.3K5G3-K5 PolarHBondContact O-N 3.47Å
4N46.5Very low63.2Low161 Ų161141.7 Ų141.786%0.86181%0.806SS**  trans-68.491.1176.1-78.4-2.3000110.9A2 G6A2-N4 PolarHBondContact O-N 3.03Å; N4-G6 PolarHBondContact O-N 3.08Å
5K52.7Low64.8Low205 Ų205140.9 Ų140.989%0.89180%0.798SS**  trans-74.688.4-179.8-166.2169.3-174173.40110.3G3 R7G3-K5 PolarHBondContact O-N 3.47Å; K5-R7 PolarHBondContact O-N 3.31Å
6G52.7Low66.2Low71 Ų71135.3 Ų135.373%0.73277%0.765SS**PPolyproline II helixtrans-53.9132.3-177.500000113.1N4N4-G6 PolarHBondContact O-N 3.08Å
7R58Low67.4Low252 Ų252135.3 Ų135.395%0.95176%0.757SS**PPolyproline II helixtrans-70.1133.1169.4-73.6175.7168.1157.6-5.1108.8K5K5-R7 PolarHBondContact O-N 3.31Å
8G59.2Low68.6Low75 Ų75132.6 Ų132.677%0.77376%0.755SS**PPolyproline II helixtrans-62.1148.317500000111.7
9R63.4Low69.7Low209 Ų209130.5 Ų130.579%0.78975%0.745SS**PPolyproline II helixtrans-64.1143.6172.3-67.1-178.6179.2-116.34.4109.6
10A76.7Confident70.6Confident88 Ų88126.9 Ų126.973%0.72774%0.737SS**PPolyproline II helixtrans-65.9143.917400000110.7
11A78.6Confident71.4Confident91 Ų91124 Ų12475%0.75272%0.716SS**PPolyproline II helixtrans-78.3145.5172.700000110.7
12Y84.2Confident73.6Confident146 Ų146115 Ų11557%0.57368%0.678SS**PPolyproline II helixtrans-82.9170.2170.5-58.2-63.5000111.1F14 I16Y12-F14 HydrophobicContact CD2-CE1 4.23Å; Y12-F14 AromaticContact CD2-CZ 3.87Å; Y12-F14 HydrophobicContact CD2-CZ 3.87Å; Y12-F14 AromaticContact CG-CE1 3.9Å; Y12-F14 HydrophobicContact CG-CE1 3.9Å; Y12-F14 HydrophobicContact CG-CZ 4.03Å; Y12-F14 PolarHBondContact O-N 3.33Å; Y12-I16 HydrophobicContact CD2-CD1 3.74Å; Y12-I16 HydrophobicContact CD2-CG1 4.01Å; Y12-I16 HydrophobicContact CE2-CD1 4.27Å
13T91.1Very high75.3Confident156 Ų156119.7 Ų119.796%0.95768%0.681SS**SBendtrans-71.5-11.1176.649.10000114
14F89.6Confident76.5Confident110 Ų110120 Ų12048%0.48268%0.684SS.*SBendtrans-114.3154.617963.7-92.1000111.5Y12 I16 V19Y12-F14 HydrophobicContact CD2-CE1 4.23Å; Y12-F14 AromaticContact CD2-CZ 3.87Å; Y12-F14 HydrophobicContact CD2-CZ 3.87Å; Y12-F14 AromaticContact CG-CE1 3.9Å; Y12-F14 HydrophobicContact CG-CE1 3.9Å; Y12-F14 HydrophobicContact CG-CZ 4.03Å; Y12-F14 PolarHBondContact O-N 3.33Å; F14-I16 HydrophobicContact CE2-CG1 4.35Å; F14-I16 PolarHBondContact O-N 3.19Å; F14-I16 VanDerWaalsContact O-N 3.14Å; F14-V19 HydrophobicContact CD2-CG2 3.94Å; F14-V19 HydrophobicContact CE2-CG2 3.95Å
15N88.6Confident78Confident130 Ų130116.9 Ų116.970%0.69566%0.664SS**  trans-73.7104.3-178.8-65.9-35.5000111.1E17 A18N15-E17 VanDerWaalsContact C-N 3.26Å; N15-E17 PolarHBondContact O-N 3.48Å; N15-A18 HydrophobicContact CB-CB 4Å; N15-A18 WeakPolarHBondContact O-CB 3.39Å; N15-A18 PolarHBondContact O-N 3.49Å; N15-A18 VanDerWaalsContact O-N 3.08Å
16I86.7Confident79.4Confident51 Ų51114.8 Ų114.826%0.26266%0.655SS.*G310 helixtrans-56.5-39.8179.5-62.1172.3000111.8Y12 F14 A18 V19 G20 F21Y12-I16 HydrophobicContact CD2-CD1 3.74Å; Y12-I16 HydrophobicContact CD2-CG1 4.01Å; Y12-I16 HydrophobicContact CE2-CD1 4.27Å; F14-I16 HydrophobicContact CE2-CG1 4.35Å; F14-I16 PolarHBondContact O-N 3.19Å; F14-I16 VanDerWaalsContact O-N 3.14Å; I16-A18 VanDerWaalsContact C-N 3.27Å; I16-A18 PolarHBondContact O-N 2.8Å; I16-V19 WeakPolarHBondContact O-CB 3.42Å; I16-V19 PolarHBondContact O-N 2.56Å; I16-G20 PolarHBondContact O-N 3.09Å; I16-F21 HydrophobicContact CG2-CB 3.76Å; I16-F21 PolarHBondContact O-N 3.14Å
17E86.4Confident81Confident135 Ų135114 Ų11463%0.63163%0.634SS**G310 helixtrans-64.5-30.2179.5-63.8175174.700112.3N15 V19 G20 F21N15-E17 VanDerWaalsContact C-N 3.26Å; N15-E17 PolarHBondContact O-N 3.48Å; E17-V19 VanDerWaalsContact C-N 3.29Å; E17-V19 PolarHBondContact O-N 2.84Å; E17-G20 PolarHBondContact O-N 3.33Å; E17-F21 WeakPolarHBondContact CA-O 3.48Å
18A89.3Confident82.5Confident87 Ų87106.7 Ų106.772%0.71962%0.619SS**G310 helixtrans-77-13.8175.200000113.6N15 I16 G20N15-A18 HydrophobicContact CB-CB 4Å; N15-A18 WeakPolarHBondContact O-CB 3.39Å; N15-A18 PolarHBondContact O-N 3.49Å; N15-A18 VanDerWaalsContact O-N 3.08Å; I16-A18 VanDerWaalsContact C-N 3.27Å; I16-A18 PolarHBondContact O-N 2.8Å; A18-G20 VanDerWaalsContact C-N 3.31Å
19V88.6Confident84Confident93 Ų93108.8 Ų108.856%0.56461%0.612SS**G310 helixtrans-85.6-9.3170.4-176.60000111.1F14 I16 E17 F21F14-V19 HydrophobicContact CD2-CG2 3.94Å; F14-V19 HydrophobicContact CE2-CG2 3.95Å; I16-V19 WeakPolarHBondContact O-CB 3.42Å; I16-V19 PolarHBondContact O-N 2.56Å; E17-V19 VanDerWaalsContact C-N 3.29Å; E17-V19 PolarHBondContact O-N 2.84Å; V19-F21 HydrophobicContact CG1-CD2 4.44Å
20G88.6Confident85.3Confident57 Ų57104.2 Ų104.259%0.58861%0.607SS**THydrogen-bonded Turntrans99.712.5177.200000115.3I16 E17 A18I16-G20 PolarHBondContact O-N 3.09Å; E17-G20 PolarHBondContact O-N 3.33Å; A18-G20 VanDerWaalsContact C-N 3.31Å
21F87.1Confident86.1Confident66 Ų66105.4 Ų105.429%0.28961%0.605SS.*  trans-103.1109.9170.6-69.8-78.4000110.5I16 E17 V19 E25 L27I16-F21 HydrophobicContact CG2-CB 3.76Å; I16-F21 PolarHBondContact O-N 3.14Å; E17-F21 WeakPolarHBondContact CA-O 3.48Å; V19-F21 HydrophobicContact CG1-CD2 4.44Å; F21-E25 WeakPolarHBondContact CA-OE2 3.42Å; F21-L27 HydrophobicContact CB-CD2 4.08Å; F21-L27 HydrophobicContact CD1-CD2 3.84Å; F21-L27 HydrophobicContact CD2-CD2 3.85Å; F21-L27 HydrophobicContact CE1-CD2 4.19Å; F21-L27 HydrophobicContact CE2-CD2 4.2Å; F21-L27 HydrophobicContact CG-CD2 3.66Å; F21-L27 HydrophobicContact CZ-CD2 4.36Å
22S84.5Confident86.8Confident63 Ų63109.2 Ų109.244%0.44161%0.612SS.*  trans-77.9165.7174.995.10000112.5G24 E25S22-G24 PolarHBondContact O-N 2.97Å; S22-E25 WeakPolarHBondContact CB-OE1 3.19Å; S22-E25 VanDerWaalsContact N-CD 3.29Å; S22-E25 PolarHBondContact N-OE2 2.78Å; S22-E25 PolarHBondContact O-N 3.45Å; S22-E25 VanDerWaalsContact O-N 3.09Å; S22-E25 PolarHBondContact OG-OE1 2.98Å
23K77.1Confident87.3Confident192 Ų192110.1 Ų110.184%0.83562%0.619SS**THydrogen-bonded Turntrans-68.888.5-167.9-172177.2-179.4174.30113.5
24G76.3Confident87.5Confident82 Ų82107.5 Ų107.585%0.84561%0.605SS**THydrogen-bonded Turntrans128.3-2.9178.100000114.1S22S22-G24 PolarHBondContact O-N 2.97Å
25E79.1Confident87.7Confident95 Ų95107.5 Ų107.544%0.44462%0.616SS.*  trans-70.4161.2179.2-74.6170.1-168.800113.6F21 S22 L27F21-E25 WeakPolarHBondContact CA-OE2 3.42Å; S22-E25 WeakPolarHBondContact CB-OE1 3.19Å; S22-E25 VanDerWaalsContact N-CD 3.29Å; S22-E25 PolarHBondContact N-OE2 2.78Å; S22-E25 PolarHBondContact O-N 3.45Å; S22-E25 VanDerWaalsContact O-N 3.09Å; S22-E25 PolarHBondContact OG-OE1 2.98Å; E25-L27 PolarHBondContact O-N 2.88Å
26K81.8Confident88.1Confident161 Ų161105.5 Ų105.570%0.761%0.61SS**  trans-7690-179-163.4-166.4175.4-157.50110.8D29K26-D29 WeakPolarHBondContact CE-OD2 3.48Å; K26-D29 IonicContact NZ-OD1 3.92Å; K26-D29 IonicContact NZ-OD2 2.78Å; K26-D29 PolarHBondContact NZ-OD2 3.46Å
27L86.4Confident88.6Confident55 Ų55110.8 Ų110.829%0.28864%0.638SS.*PPolyproline II helixtrans-52.3151.2162.1-70.4169.3000111.2F21 E25F21-L27 HydrophobicContact CB-CD2 4.08Å; F21-L27 HydrophobicContact CD1-CD2 3.84Å; F21-L27 HydrophobicContact CD2-CD2 3.85Å; F21-L27 HydrophobicContact CE1-CD2 4.19Å; F21-L27 HydrophobicContact CE2-CD2 4.2Å; F21-L27 HydrophobicContact CG-CD2 3.66Å; F21-L27 HydrophobicContact CZ-CD2 4.36Å; E25-L27 PolarHBondContact O-N 2.88Å
28P89.5Confident89.1Confident98 Ų98113 Ų11364%0.63665%0.646SS**PPolyproline II helixtrans-60.6148.6177.226-35.2000112.1
29D89.8Confident89.4Confident120 Ų120113.2 Ų113.264%0.64264%0.639SS**PPolyproline II helixtrans-72.1144.4-178.9-65.9-59.8000111.2K26 V31K26-D29 WeakPolarHBondContact CE-OD2 3.48Å; K26-D29 IonicContact NZ-OD1 3.92Å; K26-D29 IonicContact NZ-OD2 2.78Å; K26-D29 PolarHBondContact NZ-OD2 3.46Å; D29-V31 PolarHBondContact O-N 3.16Å
30V91.5Very high89.8Confident113 Ų113116.4 Ų116.469%0.68565%0.654SS**PPolyproline II helixtrans-79.6118.2-176.5-179.90000109.8L32V30-L32 PolarHBondContact O-N 3.41Å; V30-L32 VanDerWaalsContact O-N 3.16Å
31V92.9Very high90.1Very high113 Ų113117.7 Ų117.769%0.68565%0.65SS**  trans-64.6111.5177.8177.40000110.1D29 K33D29-V31 PolarHBondContact O-N 3.16Å; V31-K33 WeakPolarHBondContact CG1-O 3.12Å
32L93.6Very high90.5Very high171 Ų171122 Ų12290%0.89568%0.676SS**  trans-83.1-20.9-173.9-59.2-179.2000114.4V30V30-L32 PolarHBondContact O-N 3.41Å; V30-L32 VanDerWaalsContact O-N 3.16Å
33K94.3Very high91.1Very high164 Ų164128.5 Ų128.571%0.71369%0.692SS**SBendtrans-142.6139.8-179.6-171.1-174.372.7170.90108V31V31-K33 WeakPolarHBondContact CG1-O 3.12Å
34P95.8Very high92Very high102 Ų102126.9 Ų126.966%0.66269%0.685SS**PPolyproline II helixtrans-55.7150.2172.523.7-34.7000111.7
35P94.4Very high93Very high109 Ų109128.8 Ų128.871%0.70868%0.682SS**PPolyproline II helixtrans-55.3155.4169.3-24.735.1000112.3
36P96.4Very high93.9Very high88 Ų88130.7 Ų130.757%0.57170%0.7SS**PPolyproline II helixtrans-64.8155173.330.2-35.8000111.4F38P36-F38 PolarHBondContact O-N 3.06Å
37L97.3Very high94.6Very high162 Ų162128.5 Ų128.585%0.84870%0.703SS**SBendtrans-61.7-33.3175.5-65.1175.8000112.4
38F96.2Very high95Very high183 Ų183133.7 Ų133.780%0.80373%0.73SS**SBendtrans-119.497.9176.2-55.8-68.9000108P36P36-F38 PolarHBondContact O-N 3.06Å
39P96.1Very high95.3Very high90 Ų90136.9 Ų136.958%0.58473%0.734SS**  trans-73.2150.6168.331.6-34000110.2
40D96.6Very high95.6Very high161 Ų161137.4 Ų137.486%0.86174%0.741SS**  trans-62.4142175.2-68.8-63.4000111.9
41T95Very high95.8Very high84 Ų84133.2 Ų133.252%0.51572%0.721SS.*  trans-109.6128.2179.163.80000110.7Y43T41-Y43 PolarHBondContact O-N 2.95Å; T41-Y43 PolarHBondContact OG1-O 2.88Å
42D97.1Very high96Very high156 Ų156136.2 Ų136.283%0.83473%0.728SS**SBendtrans-55.5-27.5-179.5-61.2-28.2000113.6
43Y96.5Very high96.2Very high200 Ų200130 Ų13078%0.78471%0.705SS**  trans-125.6157.6-178.8-59.3-74.6000111.9T41T41-Y43 PolarHBondContact O-N 2.95Å; T41-Y43 PolarHBondContact OG1-O 2.88Å
44K96.1Very high96.3Very high158 Ų158125.9 Ų125.969%0.68769%0.688SS**  trans-114.8155.9174.6-60.4-56.4179.1-165.30109.7
45P96.8Very high96.4Very high121 Ų121126.5 Ų126.579%0.78668%0.683SS**PPolyproline II helixtrans-62.6156.9178.526.6-35.7000112.3
46V97.3Very high96.5Very high135 Ų135128.6 Ų128.682%0.81868%0.677SS**PPolyproline II helixtrans-66.8137.5175.2-176.50000109.5
47P96.6Very high96.6Very high115 Ų115130 Ų13075%0.74768%0.677SS**PPolyproline II helixtrans-55.2153.8173.7-2735.7000113.4
48L95.7Very high96.6Very high164 Ų164126.6 Ų126.686%0.85966%0.66SS**PPolyproline II helixtrans-65.5152.8172.7-64.2175.5000110.8
49K96.3Very high96.7Very high166 Ų166119.6 Ų119.672%0.72264%0.636SS**PPolyproline II helixtrans-71.6141.4170.5-66.7-175.9177.9-1750110.1E54K49-E54 HydrophobicContact CB-CG 4.03Å; K49-E54 VanDerWaalsContact CD-OE1 3.27Å; K49-E54 WeakPolarHBondContact CD-OE1 3.42Å
50T94.6Very high96.8Very high130 Ų130118.1 Ų118.180%0.79862%0.623SS**  trans-113.2146.2173.350.50000110
51G96.8Very high96.9Very high26 Ų26116.6 Ų116.627%0.26861%0.608SS.*SBendtrans151.5148.9-177.200000112.8G53 E54 E55G51-G53 PolarHBondContact O-N 2.92Å; G51-G53 VanDerWaalsContact O-N 3.14Å; G51-E54 PolarHBondContact O-N 3.01Å; G51-E54 VanDerWaalsContact O-N 3.1Å; G51-E55 PolarHBondContact O-N 3.32Å
52E96.8Very high97Very high176 Ų176117.2 Ų117.282%0.82261%0.605SS**Hα-helixtrans-55.2-33.9-176.5-60172178.200113Y56E52-Y56 VanDerWaalsContact O-CB 3.29Å; E52-Y56 WeakPolarHBondContact O-CB 3.34Å; E52-Y56 PolarHBondContact O-N 3.36Å
53G97.2Very high97Very high41 Ų41115 Ų11542%0.42359%0.59SS.*Hα-helixtrans-71.7-44177.600000113.3G51 M57G51-G53 PolarHBondContact O-N 2.92Å; G51-G53 VanDerWaalsContact O-N 3.14Å; G53-M57 WeakPolarHBondContact O-CE 3.39Å; G53-M57 WeakPolarHBondContact O-CG 3.27Å; G53-M57 PolarHBondContact O-N 3.02Å
54E97.1Very high97.1Very high76 Ų76109.8 Ų109.836%0.35558%0.575SS.*Hα-helixtrans-62.1-41172.1-81.782.217300112.1K49 G51 M57 L58K49-E54 HydrophobicContact CB-CG 4.03Å; K49-E54 VanDerWaalsContact CD-OE1 3.27Å; K49-E54 WeakPolarHBondContact CD-OE1 3.42Å; G51-E54 PolarHBondContact O-N 3.01Å; G51-E54 VanDerWaalsContact O-N 3.1Å; E54-M57 HydrophobicContact CG-CE 4.44Å; E54-M57 PolarHBondContact O-N 3.48Å; E54-L58 PolarHBondContact O-N 2.81Å
55E96.9Very high97.1Very high116 Ų116107.7 Ų107.754%0.54256%0.563SS.*Hα-helixtrans-67.6-43.2177-73.3163.9-147.400112G51 M57 L58 A59G51-E55 PolarHBondContact O-N 3.32Å; E55-M57 VanDerWaalsContact C-N 3.35Å; E55-M57 PolarHBondContact O-N 2.85Å; E55-L58 WeakPolarHBondContact O-CB 3.22Å; E55-L58 PolarHBondContact O-N 2.74Å; E55-L58 VanDerWaalsContact O-N 3.11Å; E55-A59 PolarHBondContact O-N 2.93Å
56Y97.9Very high97.1Very high153 Ų153106.4 Ų106.460%0.655%0.547SS*.Hα-helixtrans-59.4-43.1172.8175.2-105.3000112.3E52 L58 A59 L60E52-Y56 VanDerWaalsContact O-CB 3.29Å; E52-Y56 WeakPolarHBondContact O-CB 3.34Å; E52-Y56 PolarHBondContact O-N 3.36Å; Y56-L58 VanDerWaalsContact C-N 3.29Å; Y56-L58 PolarHBondContact O-N 3Å; Y56-A59 PolarHBondContact O-N 2.97Å; Y56-L60 HydrophobicContact CE1-CD2 4.35Å; Y56-L60 WeakPolarHBondContact O-CB 3.46Å; Y56-L60 PolarHBondContact O-N 2.9Å
57M97.9Very high97.1Very high116 Ų116102.8 Ų102.857%0.57153%0.525SS*.Hα-helixtrans-66-30.1175.2-73.2-173.3-68.800112.9G53 E54 E55 K61G53-M57 WeakPolarHBondContact O-CE 3.39Å; G53-M57 WeakPolarHBondContact O-CG 3.27Å; G53-M57 PolarHBondContact O-N 3.02Å; E54-M57 HydrophobicContact CG-CE 4.44Å; E54-M57 PolarHBondContact O-N 3.48Å; E55-M57 VanDerWaalsContact C-N 3.35Å; E55-M57 PolarHBondContact O-N 2.85Å; M57-K61 VanDerWaalsContact O-CB 3.28Å; M57-K61 WeakPolarHBondContact O-CB 3.36Å; M57-K61 PolarHBondContact O-N 3.18Å
58L97.3Very high97Very high92 Ų92103.1 Ų103.148%0.48252%0.518SS..Hα-helixtrans-71.2-44.9174.8179.760.3000111.8E54 E55 Y56 K61 Q62E54-L58 PolarHBondContact O-N 2.81Å; E55-L58 WeakPolarHBondContact O-CB 3.22Å; E55-L58 PolarHBondContact O-N 2.74Å; E55-L58 VanDerWaalsContact O-N 3.11Å; Y56-L58 VanDerWaalsContact C-N 3.29Å; Y56-L58 PolarHBondContact O-N 3Å; L58-K61 WeakPolarHBondContact O-CB 3.29Å; L58-K61 PolarHBondContact O-N 3.14Å; L58-Q62 PolarHBondContact O-N 3.4Å; L58-Q62 VanDerWaalsContact O-N 3.14Å
59A97.9Very high97Very high36 Ų36101.6 Ų101.630%0.29850%0.504SS..Hα-helixtrans-61.4-50.2175.500000111.4E55 Y56 K61 Q62 E63E55-A59 PolarHBondContact O-N 2.93Å; Y56-A59 PolarHBondContact O-N 2.97Å; A59-K61 PolarHBondContact O-N 2.95Å; A59-K61 VanDerWaalsContact O-N 3.17Å; A59-Q62 WeakPolarHBondContact O-CA 3.28Å; A59-Q62 WeakPolarHBondContact O-CB 3.38Å; A59-Q62 PolarHBondContact O-N 3.42Å; A59-E63 PolarHBondContact O-N 3.11Å
60L98.1Very high96.8Very high59 Ų59101.5 Ų101.531%0.30950%0.499SS..Hα-helixtrans-58-33.5176.4-176.562.6000112.2Y56 Q62 L64Y56-L60 HydrophobicContact CE1-CD2 4.35Å; Y56-L60 WeakPolarHBondContact O-CB 3.46Å; Y56-L60 PolarHBondContact O-N 2.9Å; L60-Q62 VanDerWaalsContact C-N 3.35Å; L60-L64 HydrophobicContact CD1-CD1 4.44Å; L60-L64 HydrophobicContact CD1-CG 4.34Å; L60-L64 HydrophobicContact CG-CD1 4.07Å; L60-L64 HydrophobicContact CG-CG 4.44Å; L60-L64 VanDerWaalsContact O-CB 3.28Å; L60-L64 WeakPolarHBondContact O-CB 3.42Å; L60-L64 WeakPolarHBondContact O-CD1 3.5Å; L60-L64 WeakPolarHBondContact O-CG 3.27Å; L60-L64 PolarHBondContact O-N 3.05Å
61K98.1Very high96.8Very high128 Ų12899 Ų9956%0.55748%0.48SS*.Hα-helixtrans-71.6-23.4173.8177.6-172171.5-165.40113.3M57 L58 A59 R65M57-K61 VanDerWaalsContact O-CB 3.28Å; M57-K61 WeakPolarHBondContact O-CB 3.36Å; M57-K61 PolarHBondContact O-N 3.18Å; L58-K61 WeakPolarHBondContact O-CB 3.29Å; L58-K61 PolarHBondContact O-N 3.14Å; A59-K61 PolarHBondContact O-N 2.95Å; A59-K61 VanDerWaalsContact O-N 3.17Å; K61-R65 WeakPolarHBondContact O-CG 3.36Å; K61-R65 PolarHBondContact O-NE 3.18Å; K61-R65 VanDerWaalsContact O-NE 3.11Å
62Q97.5Very high96.6Very high97 Ų97100.5 Ų100.545%0.45349%0.485SS..Hα-helixtrans-76.4-53.9168.7-71.2160.5-34.900109.8L58 A59 L60 L64 R65 E66L58-Q62 PolarHBondContact O-N 3.4Å; L58-Q62 VanDerWaalsContact O-N 3.14Å; A59-Q62 WeakPolarHBondContact O-CA 3.28Å; A59-Q62 WeakPolarHBondContact O-CB 3.38Å; A59-Q62 PolarHBondContact O-N 3.42Å; L60-Q62 VanDerWaalsContact C-N 3.35Å; Q62-L64 VanDerWaalsContact C-N 3.32Å; Q62-L64 PolarHBondContact O-N 2.93Å; Q62-R65 VanDerWaalsContact CG-NH2 3.34Å; Q62-R65 WeakPolarHBondContact O-CB 3.19Å; Q62-R65 PolarHBondContact O-N 2.92Å; Q62-E66 PolarHBondContact O-N 3.46Å
63E98Very high96.4Very high111 Ų11199 Ų9952%0.51947%0.472SS..Hα-helixtrans-53.3-44.2178.7-67.1175.9176.500113A59 R65 E66 T67A59-E63 PolarHBondContact O-N 3.11Å; E63-R65 PolarHBondContact O-N 3.01Å; E63-E66 PolarHBondContact O-N 3.43Å; E63-T67 VanDerWaalsContact O-CB 3.31Å; E63-T67 WeakPolarHBondContact O-CB 3.39Å; E63-T67 PolarHBondContact O-N 3.42Å; E63-T67 PolarHBondContact O-OG1 2.93Å
64L97.9Very high96.3Very high90 Ų90101.6 Ų101.647%0.47147%0.472SS..Hα-helixtrans-63.2-38.4176.8-76.2170000112.3L60 Q62 E66 T67 M68L60-L64 HydrophobicContact CD1-CD1 4.44Å; L60-L64 HydrophobicContact CD1-CG 4.34Å; L60-L64 HydrophobicContact CG-CD1 4.07Å; L60-L64 HydrophobicContact CG-CG 4.44Å; L60-L64 VanDerWaalsContact O-CB 3.28Å; L60-L64 WeakPolarHBondContact O-CB 3.42Å; L60-L64 WeakPolarHBondContact O-CD1 3.5Å; L60-L64 WeakPolarHBondContact O-CG 3.27Å; L60-L64 PolarHBondContact O-N 3.05Å; Q62-L64 VanDerWaalsContact C-N 3.32Å; Q62-L64 PolarHBondContact O-N 2.93Å; L64-E66 VanDerWaalsContact C-N 3.33Å; L64-E66 PolarHBondContact O-N 2.96Å; L64-T67 PolarHBondContact O-N 3.1Å; L64-M68 VanDerWaalsContact O-CB 3.27Å; L64-M68 WeakPolarHBondContact O-CB 3.21Å; L64-M68 WeakPolarHBondContact O-CG 3.42Å; L64-M68 PolarHBondContact O-N 3.47Å
65R96.7Very high96.1Very high113 Ų113105.4 Ų105.443%0.42649%0.494SS..Hα-helixtrans-65-36.6177.5-80.1-175.4-71.1155.1-1.5111.9K61 Q62 E63 K69K61-R65 WeakPolarHBondContact O-CG 3.36Å; K61-R65 PolarHBondContact O-NE 3.18Å; K61-R65 VanDerWaalsContact O-NE 3.11Å; Q62-R65 VanDerWaalsContact CG-NH2 3.34Å; Q62-R65 WeakPolarHBondContact O-CB 3.19Å; Q62-R65 PolarHBondContact O-N 2.92Å; E63-R65 PolarHBondContact O-N 3.01Å; R65-K69 WeakPolarHBondContact O-CG 3.28Å
66E95.8Very high95.9Very high95 Ų95105 Ų10544%0.44449%0.491SS..Hα-helixtrans-74-48.3174.3-56.5-175.4-175.200112.3Q62 E63 L64 M68 K69 R70Q62-E66 PolarHBondContact O-N 3.46Å; E63-E66 PolarHBondContact O-N 3.43Å; L64-E66 VanDerWaalsContact C-N 3.33Å; L64-E66 PolarHBondContact O-N 2.96Å; E66-M68 VanDerWaalsContact C-N 3.3Å; E66-M68 PolarHBondContact O-N 3.26Å; E66-K69 WeakPolarHBondContact O-CB 3.4Å; E66-K69 PolarHBondContact O-N 3.14Å; E66-R70 PolarHBondContact O-N 3.11Å; E66-R70 VanDerWaalsContact O-N 3.11Å; E66-R70 IonicContact OE2-CZ 3.24Å; E66-R70 VanDerWaalsContact OE2-CZ 3.24Å; E66-R70 IonicContact OE2-NH1 2.86Å; E66-R70 PolarHBondContact OE2-NH1 3.17Å; E66-R70 IonicContact OE2-NH2 2.7Å; E66-R70 PolarHBondContact OE2-NH2 3.09Å
67T97.2Very high95.6Very high59 Ų59104.1 Ų104.136%0.36250%0.502SS..Hα-helixtrans-60.2-43-176.3-55.60000110.4E63 L64 K69 R70 M71E63-T67 VanDerWaalsContact O-CB 3.31Å; E63-T67 WeakPolarHBondContact O-CB 3.39Å; E63-T67 PolarHBondContact O-N 3.42Å; E63-T67 PolarHBondContact O-OG1 2.93Å; L64-T67 PolarHBondContact O-N 3.1Å; T67-K69 VanDerWaalsContact C-N 3.33Å; T67-K69 PolarHBondContact O-N 2.86Å; T67-R70 PolarHBondContact O-N 3.26Å; T67-R70 VanDerWaalsContact O-N 3.15Å; T67-M71 HydrophobicContact CG2-CE 3.96Å; T67-M71 WeakPolarHBondContact O-CG 3.33Å; T67-M71 PolarHBondContact O-N 3.37Å
68M95.9Very high95.2Very high121 Ų121104.3 Ų104.360%0.59651%0.512SS*.Hα-helixtrans-64-32.6176.3-70.7-179.873.400113.4L64 E66 F74L64-M68 VanDerWaalsContact O-CB 3.27Å; L64-M68 WeakPolarHBondContact O-CB 3.21Å; L64-M68 WeakPolarHBondContact O-CG 3.42Å; L64-M68 PolarHBondContact O-N 3.47Å; E66-M68 VanDerWaalsContact C-N 3.3Å; E66-M68 PolarHBondContact O-N 3.26Å; M68-F74 WeakPolarHBondContact O-CB 3.43Å
69K94.6Very high94.6Very high132 Ų132105.8 Ų105.857%0.57452%0.517SS*.Hα-helixtrans-67.3-36.9172.7-71.1169.6-179.5-179.30112.1R65 E66 T67 F74R65-K69 WeakPolarHBondContact O-CG 3.28Å; E66-K69 WeakPolarHBondContact O-CB 3.4Å; E66-K69 PolarHBondContact O-N 3.14Å; T67-K69 VanDerWaalsContact C-N 3.33Å; T67-K69 PolarHBondContact O-N 2.86Å; K69-F74 HydrophobicContact CG-CE2 4.41Å; K69-F74 HydrophobicContact CG-CZ 4.49Å; K69-F74 WeakPolarHBondContact O-CB 3.42Å; K69-F74 WeakPolarHBondContact O-CD1 3.38Å
70R92.9Very high93.8Very high164 Ų164112.6 Ų112.662%0.61954%0.542SS*.Hα-helixtrans-72.3-31.5178.7-64.4174.4-174.5119.16.3112.4E66 T67E66-R70 PolarHBondContact O-N 3.11Å; E66-R70 VanDerWaalsContact O-N 3.11Å; E66-R70 IonicContact OE2-CZ 3.24Å; E66-R70 VanDerWaalsContact OE2-CZ 3.24Å; E66-R70 IonicContact OE2-NH1 2.86Å; E66-R70 PolarHBondContact OE2-NH1 3.17Å; E66-R70 IonicContact OE2-NH2 2.7Å; E66-R70 PolarHBondContact OE2-NH2 3.09Å; T67-R70 PolarHBondContact O-N 3.26Å; T67-R70 VanDerWaalsContact O-N 3.15Å
71M93.4Very high92.8Very high79 Ų79121.2 Ų121.239%0.38957%0.571SS.*SBendtrans-60149.9-179.4-75.1-174.1-177.600113.5T67 Y73 F74T67-M71 HydrophobicContact CG2-CE 3.96Å; T67-M71 WeakPolarHBondContact O-CG 3.33Å; T67-M71 PolarHBondContact O-N 3.37Å; M71-Y73 HydrophobicContact CB-CD2 3.95Å; M71-Y73 HydrophobicContact CG-CD2 4.44Å; M71-Y73 PolarHBondContact O-N 3.16Å; M71-Y73 VanDerWaalsContact O-N 3.09Å; M71-Y73 HydrophobicContact SD-CD2 3.85Å; M71-Y73 HydrophobicContact SD-CE2 4.15Å; M71-F74 PolarHBondContact O-N 3.06Å
72P93.9Very high92Very high56 Ų56120.4 Ų120.436%0.36457%0.569SS.*THydrogen-bonded Turntrans-58-21173.7-27.536.4000115.1F74 W99P72-F74 PolarHBondContact O-N 3.04Å; P72-W99 HydrophobicContact CB-CB 3.82Å
73Y92.6Very high91.3Very high144 Ų144123.7 Ų123.757%0.56559%0.59SS**THydrogen-bonded Turntrans-70.1-16.1176.2-48.8-65000113.5M71 I75 W99M71-Y73 HydrophobicContact CB-CD2 3.95Å; M71-Y73 HydrophobicContact CG-CD2 4.44Å; M71-Y73 PolarHBondContact O-N 3.16Å; M71-Y73 VanDerWaalsContact O-N 3.09Å; M71-Y73 HydrophobicContact SD-CD2 3.85Å; M71-Y73 HydrophobicContact SD-CE2 4.15Å; Y73-I75 PolarHBondContact O-N 3.39Å; Y73-I75 VanDerWaalsContact O-N 3.16Å; Y73-W99 HydrophobicContact CD1-CD2 4.25Å; Y73-W99 HydrophobicContact CD1-CE3 4.05Å; Y73-W99 HydrophobicContact CD1-CZ3 4.35Å; Y73-W99 AromaticContact CE1-CD2 3.59Å; Y73-W99 HydrophobicContact CE1-CD2 3.59Å; Y73-W99 AromaticContact CE1-CE2 3.76Å; Y73-W99 AromaticContact CE1-CE3 3.82Å; Y73-W99 HydrophobicContact CE1-CE3 3.82Å; Y73-W99 AromaticContact CE1-CG 3.98Å; Y73-W99 HydrophobicContact CE1-CG 3.98Å; Y73-W99 HydrophobicContact CE1-CH2 4.32Å; Y73-W99 HydrophobicContact CE1-CZ2 4.14Å; Y73-W99 HydrophobicContact CE1-CZ3 4.16Å
74F94.8Very high90.8Very high97 Ų97123.4 Ų123.443%0.42559%0.591SS.*  trans-80.493.5171.3-171.3-106.6000109.8M68 K69 M71 P72 E76 K96M68-F74 WeakPolarHBondContact O-CB 3.43Å; K69-F74 HydrophobicContact CG-CE2 4.41Å; K69-F74 HydrophobicContact CG-CZ 4.49Å; K69-F74 WeakPolarHBondContact O-CB 3.42Å; K69-F74 WeakPolarHBondContact O-CD1 3.38Å; M71-F74 PolarHBondContact O-N 3.06Å; P72-F74 PolarHBondContact O-N 3.04Å; F74-E76 HydrophobicContact CD1-CG 3.79Å; F74-E76 HydrophobicContact CE1-CG 3.72Å; F74-E76 PolarHBondContact O-N 3.35Å; F74-K96 PolarHBondContact O-NZ 2.97Å; F74-K96 VanDerWaalsContact O-NZ 3.11Å
75I92.6Very high90.2Very high156 Ų156128.5 Ų128.580%0.861%0.612SS**  trans-75.7103.6175.4-56.2175.1000108.2Y73Y73-I75 PolarHBondContact O-N 3.39Å; Y73-I75 VanDerWaalsContact O-N 3.16Å
76E91.8Very high89.9Confident106 Ų106131.1 Ų131.150%0.49562%0.622SS.*PPolyproline II helixtrans-69.5151.7174.1-72.8154.9-133.500111.6F74 K96F74-E76 HydrophobicContact CD1-CG 3.79Å; F74-E76 HydrophobicContact CE1-CG 3.72Å; F74-E76 PolarHBondContact O-N 3.35Å; E76-K96 IonicContact OE1-NZ 2.67Å; E76-K96 PolarHBondContact OE1-NZ 3.04Å
77T92.9Very high89.7Confident135 Ų135133.9 Ų133.983%0.82863%0.629SS**PPolyproline II helixtrans-65.1125.5170.446.70000109.6
78P88.4Confident89.2Confident120 Ų120133.5 Ų133.578%0.77963%0.629SS**PPolyproline II helixtrans-64.2141.8-177.226.8-34.8000111.3E80P78-E80 PolarHBondContact O-N 3.11Å
79E84.6Confident88.8Confident123 Ų123131 Ų13158%0.57562%0.615SS**PPolyproline II helixtrans-57135.417659.1166.2-170.300111.3Q82 K89E79-Q82 PolarHBondContact OE2-NE2 2.91Å; E79-K89 IonicContact OE1-NZ 2.7Å; E79-K89 PolarHBondContact OE1-NZ 3.26Å; E79-K89 IonicContact OE2-NZ 2.97Å; E79-K89 PolarHBondContact OE2-NZ 2.86Å
80E82.5Confident88.4Confident179 Ų179132.2 Ų132.284%0.83662%0.616SS**PPolyproline II helixtrans-67.5163.1165.7-63.6-158.9155.700110.2P78 Q82P78-E80 PolarHBondContact O-N 3.11Å; E80-Q82 PolarHBondContact O-N 3.43Å; E80-Q82 VanDerWaalsContact O-N 3.07Å
81R77.6Confident88Confident240 Ų240132.4 Ų132.491%0.90662%0.618SS**  trans-73.8108.2-177.1-66.4-169.4-174.6-174.76.2110.1D83R81-D83 PolarHBondContact O-N 2.81Å
82Q80.6Confident87.7Confident112 Ų112135.9 Ų135.952%0.52364%0.635SS.*  trans-53.9132.6168.1-64.6166-7.500110.3E79 E80 I84 K89E79-Q82 PolarHBondContact OE2-NE2 2.91Å; E80-Q82 PolarHBondContact O-N 3.43Å; E80-Q82 VanDerWaalsContact O-N 3.07Å; Q82-I84 PolarHBondContact O-N 3.15Å; Q82-K89 VanDerWaalsContact CD-NZ 3.26Å
83D81.9Confident87.3Confident166 Ų166138.3 Ų138.389%0.88864%0.64SS**SBendtrans-66.6-22.3-173.5-56.5-58.9000114.2R81R81-D83 PolarHBondContact O-N 2.81Å
84I87.4Confident86.9Confident105 Ų105136.9 Ų136.954%0.53865%0.646SS.*SBendtrans-132.2121.4-173.2-56.3176.4000109.3Q82 R86Q82-I84 PolarHBondContact O-N 3.15Å; I84-R86 HydrophobicContact CG2-CG 4.09Å
85E87.2Confident86.4Confident197 Ų197141.7 Ų141.792%0.92166%0.662SS**  trans-73.3127.4169.8-62.2-171.7172.700110
86R90.2Very high86.1Confident168 Ų168138.5 Ų138.563%0.63464%0.643SS**  trans-126.4143.2-178-61.8-172.5-177.2-149.41.6111.4I84 S88 K89I84-R86 HydrophobicContact CG2-CG 4.09Å; R86-S88 PolarHBondContact O-N 3.05Å; R86-K89 VanDerWaalsContact O-CB 3.25Å; R86-K89 WeakPolarHBondContact O-CB 3.35Å; R86-K89 PolarHBondContact O-N 2.89Å
87Y90.3Very high85.9Confident152 Ų152141.5 Ų141.560%0.59666%0.657SS**G310 helixtrans-56-35.4178.2-177.3-99.7000113.3K89 R90 Y91Y87-K89 PolarHBondContact O-N 2.75Å; Y87-K89 VanDerWaalsContact O-N 3.12Å; Y87-R90 VanDerWaalsContact CZ-NH2 3.34Å; Y87-R90 WeakPolarHBondContact O-CG 3.39Å; Y87-R90 PolarHBondContact O-N 3.32Å; Y87-R90 VanDerWaalsContact O-N 3.14Å; Y87-R90 PolarHBondContact OH-NH2 2.86Å; Y87-Y91 HydrophobicContact CD1-CE2 4.23Å; Y87-Y91 AromaticContact CE1-CE2 3.71Å; Y87-Y91 HydrophobicContact CE1-CE2 3.71Å; Y87-Y91 PolarHBondContact OH-OH 3.03Å
88S87.6Confident85.8Confident51 Ų51143 Ų14336%0.35765%0.654SS.*G310 helixtrans-57.9-23175.754.60000114.2R86 R90 Y91 M92R86-S88 PolarHBondContact O-N 3.05Å; S88-R90 PolarHBondContact O-N 3.47Å; S88-R90 VanDerWaalsContact O-N 3.1Å; S88-Y91 PolarHBondContact O-N 2.95Å; S88-M92 PolarHBondContact O-N 3.15Å
89K87.4Confident86Confident69 Ų69143.8 Ų143.830%0.364%0.642SS.*G310 helixtrans-62.9-15.6176.7-171.8153.6-177.91460113.5E79 Q82 R86 Y87E79-K89 IonicContact OE1-NZ 2.7Å; E79-K89 PolarHBondContact OE1-NZ 3.26Å; E79-K89 IonicContact OE2-NZ 2.97Å; E79-K89 PolarHBondContact OE2-NZ 2.86Å; Q82-K89 VanDerWaalsContact CD-NZ 3.26Å; R86-K89 VanDerWaalsContact O-CB 3.25Å; R86-K89 WeakPolarHBondContact O-CB 3.35Å; R86-K89 PolarHBondContact O-N 2.89Å; Y87-K89 PolarHBondContact O-N 2.75Å; Y87-K89 VanDerWaalsContact O-N 3.12Å
90R85.3Confident86.4Confident158 Ų158144.1 Ų144.160%0.59665%0.646SS**G310 helixtrans-69.9-34.1171.1-57.6-152.7-61.2177.25.7112.7Y87 S88Y87-R90 VanDerWaalsContact CZ-NH2 3.34Å; Y87-R90 WeakPolarHBondContact O-CG 3.39Å; Y87-R90 PolarHBondContact O-N 3.32Å; Y87-R90 VanDerWaalsContact O-N 3.14Å; Y87-R90 PolarHBondContact OH-NH2 2.86Å; S88-R90 PolarHBondContact O-N 3.47Å; S88-R90 VanDerWaalsContact O-N 3.1Å
91Y86.1Confident87Confident167 Ų167136.8 Ų136.866%0.65561%0.614SS**THydrogen-bonded Turntrans-93.8-35-179.1-54.1-77.9000112.2Y87 S88 K93Y87-Y91 HydrophobicContact CD1-CE2 4.23Å; Y87-Y91 AromaticContact CE1-CE2 3.71Å; Y87-Y91 HydrophobicContact CE1-CE2 3.71Å; Y87-Y91 PolarHBondContact OH-OH 3.03Å; S88-Y91 PolarHBondContact O-N 2.95Å; Y91-K93 PolarHBondContact O-N 3.11Å
92M85.4Confident87.8Confident152 Ų152128.7 Ų128.775%0.74959%0.589SS**SBendtrans-75.118174.7-66.5177.1165.100113.7S88 V94S88-M92 PolarHBondContact O-N 3.15Å; M92-V94 PolarHBondContact O-N 3.2Å
93K85.5Confident88.4Confident108 Ų108127.4 Ų127.447%0.4758%0.579SS.*  trans-84.1103.1-178.6-174.457.5-178.81650110Y91 Y95Y91-K93 PolarHBondContact O-N 3.11Å; K93-Y95 HydrophobicContact CB-CE2 4.16Å; K93-Y95 HydrophobicContact CG-CE1 4.18Å; K93-Y95 HydrophobicContact CG-CE2 4.26Å; K93-Y95 WeakPolarHBondContact O-CD2 3.31Å; K93-Y95 WeakPolarHBondContact O-CE2 3.34Å; K93-Y95 PolarHBondContact O-N 2.67Å
94V85.8Confident89.1Confident113 Ų113130.9 Ų130.969%0.68558%0.58SS**  trans-62.2122.6169.8-176.70000109.4M92M92-V94 PolarHBondContact O-N 3.2Å
95Y83.2Confident89.5Confident199 Ų199136 Ų13678%0.7859%0.592SS**  trans-100.6121.7171.4-62.8-83.8000108.7K93K93-Y95 HydrophobicContact CB-CE2 4.16Å; K93-Y95 HydrophobicContact CG-CE1 4.18Å; K93-Y95 HydrophobicContact CG-CE2 4.26Å; K93-Y95 WeakPolarHBondContact O-CD2 3.31Å; K93-Y95 WeakPolarHBondContact O-CE2 3.34Å; K93-Y95 PolarHBondContact O-N 2.67Å
96K87.1Confident89.9Confident88 Ų88129.2 Ų129.238%0.38356%0.562SS.*  trans-130.6135.3175.9-163.6176.6-170.8179.70107.7F74 E76F74-K96 PolarHBondContact O-NZ 2.97Å; F74-K96 VanDerWaalsContact O-NZ 3.11Å; E76-K96 IonicContact OE1-NZ 2.67Å; E76-K96 PolarHBondContact OE1-NZ 3.04Å
97E87.6Confident90.2Very high169 Ų169124.7 Ų124.779%0.7956%0.555SS**  trans-72.1131.8-179.4-171.5175.1-163.400110.8
98E89.6Confident90.3Very high166 Ų166127 Ų12778%0.77656%0.562SS**  trans-92.2114.1-177.7-171.6173.9-172.300110.9
99W93.3Very high90.6Very high137 Ų137133.5 Ų133.552%0.51959%0.587SS.*PPolyproline II helixtrans-74.4127.6177.7170.176.8000111.9P72 Y73 P101P72-W99 HydrophobicContact CB-CB 3.82Å; Y73-W99 HydrophobicContact CD1-CD2 4.25Å; Y73-W99 HydrophobicContact CD1-CE3 4.05Å; Y73-W99 HydrophobicContact CD1-CZ3 4.35Å; Y73-W99 AromaticContact CE1-CD2 3.59Å; Y73-W99 HydrophobicContact CE1-CD2 3.59Å; Y73-W99 AromaticContact CE1-CE2 3.76Å; Y73-W99 AromaticContact CE1-CE3 3.82Å; Y73-W99 HydrophobicContact CE1-CE3 3.82Å; Y73-W99 AromaticContact CE1-CG 3.98Å; Y73-W99 HydrophobicContact CE1-CG 3.98Å; Y73-W99 HydrophobicContact CE1-CH2 4.32Å; Y73-W99 HydrophobicContact CE1-CZ2 4.14Å; Y73-W99 HydrophobicContact CE1-CZ3 4.16Å; W99-P101 HydrophobicContact CE3-CG 4.18Å; W99-P101 HydrophobicContact CH2-CB 3.99Å; W99-P101 HydrophobicContact CH2-CG 3.94Å; W99-P101 HydrophobicContact CZ2-CB 4.43Å; W99-P101 HydrophobicContact CZ3-CB 4.29Å; W99-P101 HydrophobicContact CZ3-CG 3.71Å
100I93.1Very high90.8Very high130 Ų130136 Ų13667%0.66760%0.601SS**PPolyproline II helixtrans-101.2119.4-177.4-53.3179.4000110.7
101P94.5Very high91Very high25 Ų25132 Ų13216%0.16259%0.59CS.*PPolyproline II helixtrans-68.7157.8177.2-18.930.3000114.8W99 W103 L106W99-P101 HydrophobicContact CE3-CG 4.18Å; W99-P101 HydrophobicContact CH2-CB 3.99Å; W99-P101 HydrophobicContact CH2-CG 3.94Å; W99-P101 HydrophobicContact CZ2-CB 4.43Å; W99-P101 HydrophobicContact CZ3-CB 4.29Å; W99-P101 HydrophobicContact CZ3-CG 3.71Å; P101-W103 HydrophobicContact CB-CH2 4.5Å; P101-W103 HydrophobicContact CB-CZ2 4.28Å; P101-W103 HydrophobicContact CG-CH2 4.09Å; P101-W103 HydrophobicContact CG-CZ2 3.84Å; P101-W103 VanDerWaalsContact O-CD1 3.29Å; P101-W103 PolarHBondContact O-N 3.47Å; P101-W103 PolarHBondContact O-NE1 3.34Å; P101-L106 HydrophobicContact CB-CD1 4.11Å; P101-L106 HydrophobicContact CB-CD2 3.82Å; P101-L106 HydrophobicContact CG-CD2 4.23Å
102D94.9Very high91.2Very high70 Ų70128.7 Ų128.737%0.37459%0.589SS.*  trans-72.592.8166.5179.68.6000111.1R104 R105 L106D102-R104 PolarHBondContact O-N 2.97Å; D102-R104 WeakPolarHBondContact OD1-CB 3.43Å; D102-R104 WeakPolarHBondContact OD1-CG 3.39Å; D102-R104 PolarHBondContact OD1-N 3.07Å; D102-R105 HydrophobicContact CB-CG 4.45Å; D102-R105 PolarHBondContact O-N 3.02Å; D102-R105 WeakPolarHBondContact OD2-CD 3.06Å; D102-R105 WeakPolarHBondContact OD2-CG 3.19Å; D102-R105 IonicContact OD2-CZ 3.99Å; D102-R105 IonicContact OD2-NE 2.92Å; D102-R105 PolarHBondContact OD2-NE 2.86Å; D102-L106 PolarHBondContact O-N 2.7Å
103W94.2Very high91.2Very high85 Ų85131.3 Ų131.332%0.32259%0.591SS.*THydrogen-bonded Turntrans-64-0.5176.8-60.1112000115.2P101 L106 M110 M111 P112P101-W103 HydrophobicContact CB-CH2 4.5Å; P101-W103 HydrophobicContact CB-CZ2 4.28Å; P101-W103 HydrophobicContact CG-CH2 4.09Å; P101-W103 HydrophobicContact CG-CZ2 3.84Å; P101-W103 VanDerWaalsContact O-CD1 3.29Å; P101-W103 PolarHBondContact O-N 3.47Å; P101-W103 PolarHBondContact O-NE1 3.34Å; W103-L106 HydrophobicContact CE3-CB 3.81Å; W103-L106 HydrophobicContact CE3-CD2 4.21Å; W103-L106 HydrophobicContact CH2-CD2 4.21Å; W103-L106 HydrophobicContact CZ3-CB 3.97Å; W103-L106 HydrophobicContact CZ3-CD2 3.7Å; W103-L106 HydrophobicContact CZ3-CG 4.5Å; W103-M110 HydrophobicContact CZ3-CB 4.11Å; W103-M111 HydrophobicContact CD2-CG 3.61Å; W103-M111 HydrophobicContact CD2-SD 4.37Å; W103-M111 HydrophobicContact CE3-CB 4.45Å; W103-M111 HydrophobicContact CE3-CG 3.4Å; W103-M111 VanDerWaalsContact CE3-CG 3.4Å; W103-M111 HydrophobicContact CG-CG 4.18Å; W103-M111 HydrophobicContact CG-SD 4.33Å; W103-M111 HydrophobicContact CH2-CG 4.34Å; W103-M111 HydrophobicContact CZ2-CG 4.48Å; W103-M111 HydrophobicContact CZ3-CB 4.4Å; W103-M111 HydrophobicContact CZ3-CG 3.81Å; W103-P112 HydrophobicContact CZ2-CG 4.39Å
104R95.4Very high90.6Very high240 Ų240133.4 Ų133.491%0.90661%0.607SS**THydrogen-bonded Turntrans-81.1-20.9166.7-55.7-179.6176.5-152.6-0.4112.4D102D102-R104 PolarHBondContact O-N 2.97Å; D102-R104 WeakPolarHBondContact OD1-CB 3.43Å; D102-R104 WeakPolarHBondContact OD1-CG 3.39Å; D102-R104 PolarHBondContact OD1-N 3.07Å
105R95.9Very high89.4Confident211 Ų211137.1 Ų137.180%0.79661%0.614SS**THydrogen-bonded Turntrans-99.4-35.2178.8-62.2174.9-169-131.6-1.8112.6D102D102-R105 HydrophobicContact CB-CG 4.45Å; D102-R105 PolarHBondContact O-N 3.02Å; D102-R105 WeakPolarHBondContact OD2-CD 3.06Å; D102-R105 WeakPolarHBondContact OD2-CG 3.19Å; D102-R105 IonicContact OD2-CZ 3.99Å; D102-R105 IonicContact OD2-NE 2.92Å; D102-R105 PolarHBondContact OD2-NE 2.86Å
106L95.4Very high87.8Confident56 Ų56133.1 Ų133.129%0.29361%0.613SS.*SBendtrans-82.3146.8179.9-81.773.1000111.5P101 D102 W103 M110P101-L106 HydrophobicContact CB-CD1 4.11Å; P101-L106 HydrophobicContact CB-CD2 3.82Å; P101-L106 HydrophobicContact CG-CD2 4.23Å; D102-L106 PolarHBondContact O-N 2.7Å; W103-L106 HydrophobicContact CE3-CB 3.81Å; W103-L106 HydrophobicContact CE3-CD2 4.21Å; W103-L106 HydrophobicContact CH2-CD2 4.21Å; W103-L106 HydrophobicContact CZ3-CB 3.97Å; W103-L106 HydrophobicContact CZ3-CD2 3.7Å; W103-L106 HydrophobicContact CZ3-CG 4.5Å; L106-M110 HydrophobicContact CD2-CE 4.32Å
107P96.4Very high86.3Confident73 Ų73138.6 Ų138.647%0.47464%0.637SS.*  trans-67143.8176.828.4-34.7000111.6E109 M110P107-E109 PolarHBondContact O-N 2.7Å; P107-M110 HydrophobicContact CG-CG 3.96Å; P107-M110 HydrophobicContact CG-SD 3.76Å; P107-M110 PolarHBondContact O-N 3.27Å
108R92.8Very high84.5Confident201 Ų201140.1 Ų140.176%0.75864%0.641SS**G310 helixtrans-55.6-19.5-178.4177.3157.8-161.3-158.74.9114.8M111R108-M111 HydrophobicContact CB-CE 4.28Å; R108-M111 HydrophobicContact CG-CE 3.64Å
109E93.1Very high82.7Confident187 Ų187136.5 Ų136.587%0.87464%0.64SS**G310 helixtrans-74.5-27.1179-64.3175.8-171.800113.1P107P107-E109 PolarHBondContact O-N 2.7Å
110M91.8Very high80.9Confident122 Ų122132.6 Ų132.660%0.60164%0.642SS**G310 helixtrans-82.2-9179.7-70.6179.572.100114.1W103 L106 P107 P112W103-M110 HydrophobicContact CZ3-CB 4.11Å; L106-M110 HydrophobicContact CD2-CE 4.32Å; P107-M110 HydrophobicContact CG-CG 3.96Å; P107-M110 HydrophobicContact CG-SD 3.76Å; P107-M110 PolarHBondContact O-N 3.27Å; M110-P112 WeakPolarHBondContact O-CD 3.25Å
111M90.8Very high79.1Confident74 Ų74132.6 Ų132.637%0.36565%0.651SS.*SBendtrans-62.6126.1-179.4-83.4-164.2-74.900111.5W103 R108 R113W103-M111 HydrophobicContact CD2-CG 3.61Å; W103-M111 HydrophobicContact CD2-SD 4.37Å; W103-M111 HydrophobicContact CE3-CB 4.45Å; W103-M111 HydrophobicContact CE3-CG 3.4Å; W103-M111 VanDerWaalsContact CE3-CG 3.4Å; W103-M111 HydrophobicContact CG-CG 4.18Å; W103-M111 HydrophobicContact CG-SD 4.33Å; W103-M111 HydrophobicContact CH2-CG 4.34Å; W103-M111 HydrophobicContact CZ2-CG 4.48Å; W103-M111 HydrophobicContact CZ3-CB 4.4Å; W103-M111 HydrophobicContact CZ3-CG 3.81Å; R108-M111 HydrophobicContact CB-CE 4.28Å; R108-M111 HydrophobicContact CG-CE 3.64Å; M111-R113 PolarHBondContact O-N 2.97Å
112P90.4Very high77.5Confident97 Ų97140.2 Ų140.263%0.6368%0.681SS**  trans-54.5101.2172.8-28.136.2000111.4W103 M110 N114W103-P112 HydrophobicContact CZ2-CG 4.39Å; M110-P112 WeakPolarHBondContact O-CD 3.25Å; P112-N114 PolarHBondContact O-N 3.17Å
113R85.6Confident75.7Confident207 Ų207142.6 Ų142.678%0.78170%0.7SS**  trans-77.4106.6172-73.2-172.4176.8-164.50.7108M111 K115M111-R113 PolarHBondContact O-N 2.97Å; R113-K115 PolarHBondContact O-N 3.43Å
114N71.2Confident73.8Confident151 Ų151148.4 Ų148.481%0.80773%0.728SS**  trans-51.995158.4-78.3-16.1000108.4P112 C116P112-N114 PolarHBondContact O-N 3.17Å; N114-C116 PolarHBondContact O-N 3.24Å
115K61.3Low71.5Confident192 Ų192146.7 Ų146.784%0.83573%0.727SS**  trans-66.288.9167.9-72.2176.7-177171.20105.2R113 K117R113-K115 PolarHBondContact O-N 3.43Å; K115-K117 PolarHBondContact O-N 3.02Å
116C49Very low69.3Low114 Ų114141 Ų14177%0.7773%0.725SS**  trans-46.5111.7164.7-63.50000105.9N114 K118N114-C116 PolarHBondContact O-N 3.24Å; C116-K118 VanDerWaalsContact C-N 3.33Å; C116-K118 PolarHBondContact O-N 3.28Å
117K56Low67Low204 Ų204148 Ų14889%0.88775%0.753SS**  trans-53.5107.1172.4-66.3177-177.51750104K115 A119K115-K117 PolarHBondContact O-N 3.02Å; K117-A119 PolarHBondContact O-N 3.14Å
118K50.6Low64.5Low201 Ų201152.1 Ų152.187%0.87477%0.772SS**PPolyproline II helixtrans-53.9116.6179.8-81.1-172.1176.1-1780104.7C116 G120C116-K118 VanDerWaalsContact C-N 3.33Å; C116-K118 PolarHBondContact O-N 3.28Å; K118-G120 PolarHBondContact O-N 3.1Å; K118-G120 VanDerWaalsContact O-N 3.15Å
119A52Low62.2Low90 Ų90147.5 Ų147.574%0.74478%0.776SS**PPolyproline II helixtrans-48.8129.1-176.700000107.5K117K117-A119 PolarHBondContact O-N 3.14Å
120G54.2Low59.7Low54 Ų54142 Ų14256%0.55777%0.77SS**PPolyproline II helixtrans-48.6145.3-175.400000110K118 K122K118-G120 PolarHBondContact O-N 3.1Å; K118-G120 VanDerWaalsContact O-N 3.15Å; G120-K122 PolarHBondContact O-N 3.02Å
121P55.2Low57.8Low131 Ų131145.5 Ų145.585%0.85178%0.782SS**SBendtrans-47.2112.4-169.520.1-33.3000109.4
122K62.1Low55.6Low185 Ų185145.6 Ų145.680%0.80480%0.801SS**  trans-45.6126.5-165.9-72.1-175.4176.8-176.80108.8G120 K124G120-K122 PolarHBondContact O-N 3.02Å; K122-K124 PolarHBondContact O-N 3.01Å
123P55.5Low53.8Low120 Ų120145.5 Ų145.578%0.77980%0.799SS**PPolyproline II helixtrans-52.9123.9-177.721.1-32.2000107.9K125P123-K125 PolarHBondContact O-N 3.12Å
124K54.7Low52.2Low206 Ų206140.1 Ų140.190%0.89679%0.793SS**PPolyproline II helixtrans-55.9117.7-180-69.8177.6179.9174.70106.2K122 A126K122-K124 PolarHBondContact O-N 3.01Å; K124-A126 PolarHBondContact O-N 3.22Å
125K48.5Very low51.7Low204 Ų204136.4 Ų136.489%0.88777%0.773SS**PPolyproline II helixtrans-53.6116.3173.7-76.8-164.6171.8-164.20107.5P123P123-K125 PolarHBondContact O-N 3.12Å
126A49.3Very low51.7Low93 Ų93132.6 Ų132.677%0.76977%0.766SS**PPolyproline II helixtrans-56.1140.7162.700000107.4K124K124-A126 PolarHBondContact O-N 3.22Å
127K46.2Very low52.8Low202 Ų202131.4 Ų131.488%0.87875%0.752SS**PPolyproline II helixtrans-69.2148.9176-69-174.7177-177.10109.4A129K127-A129 PolarHBondContact O-N 3.11Å
128D43.5Very low53.5Low160 Ų160127.2 Ų127.286%0.85674%0.744SS**PPolyproline II helixtrans-54.7127.4-168.5-58.1-106000114.4
129A45.3Very low54.8Low104 Ų104120.2 Ų120.286%0.8672%0.723SS**SBendtrans-146.9110.415200000107.2K127K127-A129 PolarHBondContact O-N 3.11Å
130G40.5Very low56Low71 Ų71118.9 Ų118.973%0.73270%0.703SS**SBendtrans102.8112.1-173.100000113G132G130-G132 VanDerWaalsContact C-N 3.26Å; G130-G132 PolarHBondContact O-N 2.91Å
131K51.5Low57.3Low196 Ų196119.1 Ų119.185%0.85269%0.694SS**  trans-79.168.7-176.8-169.9-173.8176.3-175.50111.4T133K131-T133 PolarHBondContact O-N 3Å
132G44.3Very low58.7Low75 Ų75118.4 Ų118.477%0.77368%0.682SS**  trans-7185.517300000111.7G130 S134G130-G132 VanDerWaalsContact C-N 3.26Å; G130-G132 PolarHBondContact O-N 2.91Å; G132-S134 PolarHBondContact O-N 2.74Å; G132-S134 VanDerWaalsContact O-N 3.11Å
133T52.9Low59.8Low96 Ų96116.3 Ų116.359%0.58967%0.673SS**  trans-64108.7166.843.50000108.9K131 L135K131-T133 PolarHBondContact O-N 3Å; T133-L135 PolarHBondContact O-N 2.84Å; T133-L135 VanDerWaalsContact O-N 3.13Å
134S53.4Low61.3Low94 Ų94115.9 Ų115.966%0.65766%0.659SS**  trans-59114.8170.351.90000109G132 T136G132-S134 PolarHBondContact O-N 2.74Å; G132-S134 VanDerWaalsContact O-N 3.11Å; S134-T136 PolarHBondContact O-N 3.13Å
135L60.3Low62.7Low72 Ų72109.8 Ų109.838%0.37764%0.636SS.*  trans-73.380-179.3-53.4175.1000109T133 N137 D140 V141 K144T133-L135 PolarHBondContact O-N 2.84Å; T133-L135 VanDerWaalsContact O-N 3.13Å; L135-N137 VanDerWaalsContact C-N 3.32Å; L135-D140 HydrophobicContact CB-CB 4.48Å; L135-D140 HydrophobicContact CD2-CB 3.77Å; L135-V141 HydrophobicContact CB-CG2 3.75Å; L135-V141 HydrophobicContact CD1-CG2 4.29Å; L135-K144 HydrophobicContact CD1-CB 4.41Å; L135-K144 HydrophobicContact CD1-CD 3.88Å
136T61.6Low64.3Low112 Ų112104.6 Ų104.669%0.68762%0.615SS**  trans-84.2-8.6-18052.10000113S134S134-T136 PolarHBondContact O-N 3.13Å
137N70.4Confident65.9Low90 Ų90105.1 Ų105.148%0.48160%0.601SS.*SBendtrans-113.9135.6-180-42.8-58.7000109.3L135 A139 D140 V141L135-N137 VanDerWaalsContact C-N 3.32Å; N137-A139 PolarHBondContact O-N 3.05Å; N137-D140 WeakPolarHBondContact CB-OD2 3.49Å; N137-D140 PolarHBondContact ND2-OD2 2.86Å; N137-D140 PolarHBondContact O-N 2.92Å; N137-V141 PolarHBondContact O-N 2.96Å
138T72.1Confident67.4Low116 Ų116100.1 Ų100.171%0.71258%0.583SS**Hα-helixtrans-57.3-37178.848.60000112.6D140 V141 L142T138-D140 VanDerWaalsContact C-N 3.28Å; T138-D140 PolarHBondContact O-N 3.16Å; T138-V141 WeakPolarHBondContact O-CB 3.43Å; T138-V141 PolarHBondContact O-N 3.26Å; T138-V141 VanDerWaalsContact O-N 3.16Å; T138-L142 WeakPolarHBondContact O-CG 3.48Å; T138-L142 PolarHBondContact O-N 3.33Å
139A77.1Confident69Low54 Ų5498.4 Ų98.445%0.44657%0.57SS.*Hα-helixtrans-61.6-31176.700000113.9N137 K143N137-A139 PolarHBondContact O-N 3.05Å; A139-K143 WeakPolarHBondContact O-CG 3.4Å; A139-K143 PolarHBondContact O-N 3.25Å
140D78.2Confident70.6Confident61 Ų61100.3 Ų100.333%0.32656%0.559SS.*Hα-helixtrans-81-25.3178.1-56.1-37.6000111.6L135 N137 T138 K144L135-D140 HydrophobicContact CB-CB 4.48Å; L135-D140 HydrophobicContact CD2-CB 3.77Å; N137-D140 WeakPolarHBondContact CB-OD2 3.49Å; N137-D140 PolarHBondContact ND2-OD2 2.86Å; N137-D140 PolarHBondContact O-N 2.92Å; T138-D140 VanDerWaalsContact C-N 3.28Å; T138-D140 PolarHBondContact O-N 3.16Å; D140-K144 PolarHBondContact O-N 3.37Å
141V81.8Confident72Confident60 Ų60104.6 Ų104.636%0.36455%0.553SS.*Hα-helixtrans-71.6-50169.8179.80000110.3L135 N137 T138 K143 K144 I145L135-V141 HydrophobicContact CB-CG2 3.75Å; L135-V141 HydrophobicContact CD1-CG2 4.29Å; N137-V141 PolarHBondContact O-N 2.96Å; T138-V141 WeakPolarHBondContact O-CB 3.43Å; T138-V141 PolarHBondContact O-N 3.26Å; T138-V141 VanDerWaalsContact O-N 3.16Å; V141-K143 PolarHBondContact O-N 2.97Å; V141-K144 PolarHBondContact O-N 3.24Å; V141-I145 HydrophobicContact CG1-CD1 4.08Å; V141-I145 PolarHBondContact O-N 3.41Å
142L84.4Confident72.2Confident116 Ų116102.4 Ų102.461%0.60755%0.551SS**Hα-helixtrans-57-46.9179.6-72168.5000112T138 K144 I145 E146T138-L142 WeakPolarHBondContact O-CG 3.48Å; T138-L142 PolarHBondContact O-N 3.33Å; L142-K144 PolarHBondContact O-N 3Å; L142-I145 PolarHBondContact O-N 3.42Å; L142-I145 VanDerWaalsContact O-N 3.13Å; L142-E146 PolarHBondContact O-N 3.47Å
143K84.9Confident72.7Confident140 Ų140106.3 Ų106.361%0.60955%0.554SS**Hα-helixtrans-58.9-32.1174.6-79.1179.6175.3-179.80113.8A139 V141 E147A139-K143 WeakPolarHBondContact O-CG 3.4Å; A139-K143 PolarHBondContact O-N 3.25Å; V141-K143 PolarHBondContact O-N 2.97Å; K143-E147 VanDerWaalsContact O-CB 3.29Å; K143-E147 WeakPolarHBondContact O-CB 3.4Å; K143-E147 PolarHBondContact O-N 3.18Å
144K86.4Confident72.8Confident111 Ų111104.1 Ų104.148%0.48355%0.551SS.*Hα-helixtrans-78.8-28.1178.8-168.3171.8-177.7-176.10112.5L135 D140 V141 L142 L148L135-K144 HydrophobicContact CD1-CB 4.41Å; L135-K144 HydrophobicContact CD1-CD 3.88Å; D140-K144 PolarHBondContact O-N 3.37Å; V141-K144 PolarHBondContact O-N 3.24Å; L142-K144 PolarHBondContact O-N 3Å; K144-L148 HydrophobicContact CG-CD1 4.5Å; K144-L148 WeakPolarHBondContact O-CD1 3.3Å; K144-L148 VanDerWaalsContact O-CG 3.25Å; K144-L148 WeakPolarHBondContact O-CG 3.26Å; K144-L148 PolarHBondContact O-N 3Å; K144-L148 VanDerWaalsContact O-N 3.17Å
145I85.1Confident72.3Confident79 Ų79108.8 Ų108.841%0.40556%0.562SS.*Hα-helixtrans-67.7-50.9169.7-64.6165.9000108.9V141 L142 E147 L148 E149V141-I145 HydrophobicContact CG1-CD1 4.08Å; V141-I145 PolarHBondContact O-N 3.41Å; L142-I145 PolarHBondContact O-N 3.42Å; L142-I145 VanDerWaalsContact O-N 3.13Å; I145-E147 PolarHBondContact O-N 3.13Å; I145-E147 VanDerWaalsContact O-N 3.17Å; I145-L148 WeakPolarHBondContact O-CA 3.27Å; I145-L148 PolarHBondContact O-N 2.69Å; I145-E149 HydrophobicContact CG2-CG 4.39Å; I145-E149 WeakPolarHBondContact CG2-OE1 3.47Å; I145-E149 WeakPolarHBondContact O-CG 3.31Å; I145-E149 PolarHBondContact O-N 3.17Å
146E82Confident71.6Confident95 Ų95116 Ų11644%0.44459%0.59SS.*Hα-helixtrans-58.5-29.8176.6-162.7-160158.800113.2L142 K150L142-E146 PolarHBondContact O-N 3.47Å; E146-K150 VanDerWaalsContact O-CD 3.31Å; E146-K150 WeakPolarHBondContact O-CD 3.48Å; E146-K150 VanDerWaalsContact O-CG 3.3Å; E146-K150 WeakPolarHBondContact O-CG 3.29Å; E146-K150 IonicContact OE1-NZ 2.61Å; E146-K150 PolarHBondContact OE1-NZ 2.97Å
147E83Confident70.8Confident104 Ų104115.8 Ų115.849%0.48659%0.594SS.*Hα-helixtrans-81.3-20.9174.7-166.9-177.1-169.500113.4K143 I145 R151K143-E147 VanDerWaalsContact O-CB 3.29Å; K143-E147 WeakPolarHBondContact O-CB 3.4Å; K143-E147 PolarHBondContact O-N 3.18Å; I145-E147 PolarHBondContact O-N 3.13Å; I145-E147 VanDerWaalsContact O-N 3.17Å; E147-R151 VanDerWaalsContact CD-NH2 3.25Å; E147-R151 VanDerWaalsContact O-CD 3.27Å; E147-R151 WeakPolarHBondContact O-CD 3.43Å; E147-R151 VanDerWaalsContact O-CG 3.26Å; E147-R151 WeakPolarHBondContact O-CG 3.25Å; E147-R151 PolarHBondContact O-NE 3.04Å; E147-R151 IonicContact OE1-CZ 3.78Å; E147-R151 IonicContact OE1-NH2 2.69Å; E147-R151 PolarHBondContact OE1-NH2 3.17Å; E147-R151 IonicContact OE2-NH2 3.96Å
148L77.7Confident69.1Low97 Ų97118.5 Ų118.551%0.50861%0.608SS.*Hα-helixtrans-85.9-42.8175.1-75.7168.2000111.7K144 I145 K150 R151 D152K144-L148 HydrophobicContact CG-CD1 4.5Å; K144-L148 WeakPolarHBondContact O-CD1 3.3Å; K144-L148 VanDerWaalsContact O-CG 3.25Å; K144-L148 WeakPolarHBondContact O-CG 3.26Å; K144-L148 PolarHBondContact O-N 3Å; K144-L148 VanDerWaalsContact O-N 3.17Å; I145-L148 WeakPolarHBondContact O-CA 3.27Å; I145-L148 PolarHBondContact O-N 2.69Å; L148-K150 PolarHBondContact O-N 3.17Å; L148-R151 WeakPolarHBondContact O-CA 3.49Å; L148-R151 WeakPolarHBondContact O-CB 3.48Å; L148-R151 PolarHBondContact O-N 2.61Å; L148-D152 PolarHBondContact O-N 3.17Å; L148-D152 VanDerWaalsContact O-N 3.07Å
149E76.2Confident67.2Low124 Ų124122.3 Ų122.358%0.57962%0.618SS**Hα-helixtrans-53.5-43.4174.7-69165.3166.400111.1I145 R151 D152 D153I145-E149 HydrophobicContact CG2-CG 4.39Å; I145-E149 WeakPolarHBondContact CG2-OE1 3.47Å; I145-E149 WeakPolarHBondContact O-CG 3.31Å; I145-E149 PolarHBondContact O-N 3.17Å; E149-R151 PolarHBondContact O-N 3.24Å; E149-R151 VanDerWaalsContact O-N 3.12Å; E149-D152 PolarHBondContact O-N 2.9Å; E149-D153 PolarHBondContact O-N 3.23Å
150K78.1Confident64.9Low143 Ų143127.8 Ų127.862%0.62263%0.634SS**Hα-helixtrans-73.23.4176.9-64.9172.5-166.8170.30115.2E146 L148E146-K150 VanDerWaalsContact O-CD 3.31Å; E146-K150 WeakPolarHBondContact O-CD 3.48Å; E146-K150 VanDerWaalsContact O-CG 3.3Å; E146-K150 WeakPolarHBondContact O-CG 3.29Å; E146-K150 IonicContact OE1-NZ 2.61Å; E146-K150 PolarHBondContact OE1-NZ 2.97Å; L148-K150 PolarHBondContact O-N 3.17Å
151R70.9Confident62.5Low161 Ų161132.4 Ų132.461%0.60866%0.659SS**Hα-helixtrans-116-19.8173.1-64.3172.4-170.5-157.24112.5E147 L148 E149E147-R151 VanDerWaalsContact CD-NH2 3.25Å; E147-R151 VanDerWaalsContact O-CD 3.27Å; E147-R151 WeakPolarHBondContact O-CD 3.43Å; E147-R151 VanDerWaalsContact O-CG 3.26Å; E147-R151 WeakPolarHBondContact O-CG 3.25Å; E147-R151 PolarHBondContact O-NE 3.04Å; E147-R151 IonicContact OE1-CZ 3.78Å; E147-R151 IonicContact OE1-NH2 2.69Å; E147-R151 PolarHBondContact OE1-NH2 3.17Å; E147-R151 IonicContact OE2-NH2 3.96Å; L148-R151 WeakPolarHBondContact O-CA 3.49Å; L148-R151 WeakPolarHBondContact O-CB 3.48Å; L148-R151 PolarHBondContact O-N 2.61Å; E149-R151 PolarHBondContact O-N 3.24Å; E149-R151 VanDerWaalsContact O-N 3.12Å
152D55.5Low60.1Low150 Ų150137 Ų13780%0.80268%0.676SS**Hα-helixtrans-81-30.7178.8-148.352.3000111.6L148 E149 G154L148-D152 PolarHBondContact O-N 3.17Å; L148-D152 VanDerWaalsContact O-N 3.07Å; E149-D152 PolarHBondContact O-N 2.9Å; D152-G154 PolarHBondContact O-N 2.95Å
153D55Low57.4Low157 Ų157138.5 Ų138.584%0.8469%0.685SS**THydrogen-bonded Turntrans-68.716.3176.9-163.2-139.1000114.5E149E149-D153 PolarHBondContact O-N 3.23Å
154G54.8Low55.1Low51 Ų51141.3 Ų141.353%0.52670%0.697SS.*THydrogen-bonded Turntrans-167.649.1-164.200000119.3D152D152-G154 PolarHBondContact O-N 2.95Å
155E43.4Very low52.3Low192 Ų192145.3 Ų145.390%0.89772%0.718SS**  trans-166.8114.7140.7-109.8157-156.400112.9
156K45.1Very low49.5Very low222 Ų222144.6 Ų144.697%0.96573%0.73SS**  trans-102.9105.1163.6-81.5-177.8177.2174.70109.2
157S43.7Very low46.9Very low109 Ų109145.6 Ų145.676%0.76275%0.747SS**  trans-151.5116.3162.4-157.70000105
158D35.4Very low44.4Very low147 Ų147148.1 Ų148.179%0.78676%0.757SS**  cis64.392.842.2-157.927000112.2
159E32.8Very low42.1Very low195 Ų195150 Ų15091%0.91176%0.763SS**  -162.6150.1129.7-159.3162.9-148.500108.6
160E29.3Very low40Very low169 Ų169153 Ų15379%0.7977%0.774SS**  trans-86.2155.5-169.1-63.3170.5109.500114.6
161N27.3Very low37.8Very low158 Ų158150.7 Ų150.785%0.84578%0.776SS**  -152.3149.5123.1-149.7-18.3000111.5
162E30.6Very low35.9Very low156 Ų156150.9 Ų150.973%0.72978%0.781SS**  trans-91.4146.9-167.3-54.6170.7104.900112.4
163D29Very low34.5Very low149 Ų149151 Ų15180%0.79778%0.776SS**  trans179.584130-115.3-26.9000112.4
164K35.8Very low33.2Very low198 Ų198146.3 Ų146.386%0.86177%0.765SS**  172.3135115.6-94.9161.8-175.6167.20115.8
165E26.7Very low31.9Very low196 Ų196150.9 Ų150.992%0.91678%0.778SS**  trans-59.8155.1161.5-52.7168.3112.800111.5
166G27.5Very low31.3Very low63 Ų63149 Ų14965%0.64977%0.774SS**  cis156.5164.3-3.100000112.1
167S27Very low30.5Very low116 Ų116146.3 Ų146.381%0.81177%0.77SS**  trans63.8151.1-173.6-63.90000114.6
168K30.1Very low29.8Very low158 Ų158148.1 Ų148.169%0.68777%0.771SS**  cis-167.3159.2-6.7-112.5171.2162.7-111.60105.8
169E30.9Very low29.4Very low136 Ų136148 Ų14864%0.63677%0.771SS**  cis-155.3139.8-4-146.8141.6-147.700105.9
170K32.1Very low29.1Very low188 Ų188146 Ų14682%0.81777%0.766SS**  34.2127.493.7-81.8-172.9177.8-176.70114.8
171S31.2Very low29.1Very low94 Ų94144.9 Ų144.966%0.65777%0.766SS**  cis-153.5150.924-41.90000111.7
172K30.8Very low29.2Very low165 Ų165141.1 Ų141.172%0.71776%0.756SS**  68.4147.499.6-66.1-179.1126.2-131.90116
173E27Very low29.5Very low151 Ų151138.5 Ų138.571%0.70676%0.762SS**  cis-165177.20.3-111.216015700107.8
174G27Very low29.7Very low59 Ų59141 Ų14161%0.60877%0.769SS**  cis-106-134.8-1.100000113.2
175D28.3Very low30.1Very low148 Ų148140.4 Ų140.479%0.79177%0.769SS**  cis62.9147.15.8-57.9-16.8000117
176D29Very low30.5Very low153 Ų153140.9 Ų140.982%0.81877%0.771SS**  cis-96.1-139.6-2.7-59.7-82.3000111.1
177D28.3Very low30.8Very low164 Ų164147.1 Ų147.188%0.87778%0.783SS**  cis-158.8-172.11.4-151.6-22.7000109.9
178D29.1Very low31.3Very low147 Ų147152.2 Ų152.279%0.78679%0.786SS**  trans-109.8166.2-167.2-117.2-30.3000118.2
179D27.8Very low32.2Very low146 Ų146150.8 Ų150.878%0.78179%0.786SS**  trans69.6145.9149.1-107.3-22000127.5
180D26.6Very low32.8Very low152 Ų152152.9 Ų152.981%0.81380%0.796SS**  trans67.4161.7149.8-120.9-10.8000126.8
181D28.3Very low33.4Very low146 Ų146152.5 Ų152.578%0.78180%0.797SS**  trans-48.4162.6-163.8-153.5-139000123.3
182A29.9Very low34.1Very low78 Ų78157.7 Ų157.765%0.64581%0.811SS**  trans65.199.9152.100000123.5
183A38.3Very low34.9Very low102 Ų102158.4 Ų158.484%0.84382%0.817SS**  trans31.4121.7130.300000123
184E32.8Very low36Very low202 Ų202159.9 Ų159.994%0.94482%0.824SS**  -154.5-168.6127.2-132.3170.2-177.900112.6
185Q42.7Very low37.1Very low184 Ų184166.7 Ų166.786%0.8684%0.84SS**  trans-117.2137.2-177.6-61.4174.8-36.700110.7
186E35Very low38.1Very low207 Ų207168.7 Ų168.797%0.96784%0.844SS**  trans-138.5156.2156.1-73.9-160.3144.200110.9
187E34.1Very low38.9Very low193 Ų193167 Ų16790%0.90284%0.836SS**  trans-120131.3-170.4-177.2168.4-14700108
188Y37.4Very low40.5Very low223 Ų223165.7 Ų165.788%0.87583%0.828SS**  trans-105.9127.5-174.9-136-87.1000109.7
189D48.9Very low42.1Very low128 Ų128167.1 Ų167.168%0.68482%0.824SS**  trans-87.4133.8-177.8-162-19000110.5E191D189-E191 PolarHBondContact OD1-N 3.45Å
190E44.8Very low43.6Very low180 Ų180166.5 Ų166.584%0.84182%0.819SS**  trans-107.8-3.5-174.3-66.8-170.9145.100113.3E192E190-E192 PolarHBondContact O-N 3.07Å
191E44.7Very low45.1Very low181 Ų181165.4 Ų165.485%0.84681%0.814SS**THydrogen-bonded Turntrans-74.2-11-165.8-66.4-165.9172.700116.5D189D189-E191 PolarHBondContact OD1-N 3.45Å
192E45.3Very low46.6Very low202 Ų202162.8 Ų162.894%0.94481%0.807SS**THydrogen-bonded Turntrans-96.717.1-165.7-146.6-179.2-145.600116.5E190E190-E192 PolarHBondContact O-N 3.07Å
193Q47.2Very low48.2Very low180 Ų180167.1 Ų167.184%0.84181%0.807SS**SBendtrans-126.511.7-169.7-158.4151.311500118
194E50.3Low49.2Very low183 Ų183171.1 Ų171.186%0.85581%0.806SS**  trans-103.7-5-175.7-63.9-153.814800117.3
195E49.7Very low50.6Low202 Ų202169.7 Ų169.794%0.94480%0.8SS**SBendtrans-82.1-17.8-166.4-89.8-163.4153.500118.5
196E49.6Very low50.8Low189 Ų189169.2 Ų169.288%0.88380%0.803SS**  trans-114.976-178-72.1-163.7152.500113.9
197N46.8Very low51.9Low119 Ų119163 Ų16364%0.63679%0.794SS**  trans-132.378.5169.1-82.5-77.8000112.8Y199N197-Y199 PolarHBondContact O-N 2.9Å
198D60.2Low52.7Low136 Ų136160.2 Ų160.273%0.72779%0.786SS**G310 helixtrans-55-11.2174-77.2-32.3000115I200 N201D198-I200 PolarHBondContact O-N 3.27Å; D198-I200 VanDerWaalsContact O-N 3.17Å; D198-N201 PolarHBondContact O-N 3.26Å
199Y64.5Low53.6Low176 Ų176157.5 Ų157.569%0.6979%0.786SS**G310 helixtrans-54.1-32.3-178.3-165.9-102.9000114.1N197 S202N197-Y199 PolarHBondContact O-N 2.9Å; Y199-S202 PolarHBondContact O-OG 2.89Å
200I58.8Low53.7Low133 Ų133160.1 Ų160.168%0.68279%0.792SS**G310 helixtrans-69.1-38.7-179.5-71.2174.3000112D198 S202D198-I200 PolarHBondContact O-N 3.27Å; D198-I200 VanDerWaalsContact O-N 3.17Å; I200-S202 PolarHBondContact O-N 3.44Å
201N57.7Low53.8Low130 Ų130154.1 Ų154.170%0.69578%0.779SS**G310 helixtrans-74.4-11.3-172.1-71.5-19000113.9D198D198-N201 PolarHBondContact O-N 3.26Å
202S60Low54.2Low91 Ų91150.5 Ų150.564%0.63678%0.779SS**G310 helixtrans-109.11.7-176.251.40000114.5Y199 I200Y199-S202 PolarHBondContact O-OG 2.89Å; I200-S202 PolarHBondContact O-N 3.44Å
203Y63.3Low54.6Low168 Ų168148.3 Ų148.366%0.65977%0.774SS**SBendtrans-93-10-176.3-161.1-101000114.6
204F58.5Low54.7Low187 Ų187145.3 Ų145.382%0.8277%0.773SS**SBendtrans-127.7-4.1-175.2-78.8-76.3000115.9
205E62.2Low54.9Low172 Ų172144 Ų14480%0.80477%0.772SS**SBendtrans-111.277.2172.2-70.8-161.8142.200111.7
206D48.2Very low55.3Low173 Ų173140.6 Ų140.693%0.92576%0.76SS**SBendtrans179.4134.5130.7-104.2-21.9000111.9
207G57Low55.6Low76 Ų76138.2 Ų138.278%0.78475%0.754SS**  trans115.333.6145.500000121.7
208D51Low56Low136 Ų136139.3 Ų139.373%0.72777%0.765SS**  trans-143.580.4152.6-141.1-5.7000114.2F210D208-F210 PolarHBondContact O-N 3.12Å
209D57.6Low55.8Low165 Ų165140.3 Ų140.388%0.88277%0.77SS**  trans-73.362.5164.2177.737.2000110.2G211D209-G211 PolarHBondContact O-N 2.9Å
210F49.8Very low55.4Low183 Ų183139.6 Ų139.680%0.80377%0.773SS**  trans-90.882.4177.4-136.9-77.5000111D208D208-F210 PolarHBondContact O-N 3.12Å
211G47.5Very low55.2Low55 Ų55138.1 Ų138.157%0.56778%0.781SS**  trans-69.5146.3-169.200000116.7D209D209-G211 PolarHBondContact O-N 2.9Å
212A52Low54.8Low104 Ų104137.3 Ų137.386%0.8678%0.781SS**  trans72.4131.2147.500000121.6
213D53.6Low54.3Low156 Ų156145.9 Ų145.983%0.83480%0.801SS**  trans80.274141.6-141.252.5000120
214S51Low53.9Low118 Ų118144.8 Ų144.883%0.82581%0.808SS**  trans-170.192.9142.6-75.60000107.2
215D53Low53.6Low154 Ų154142.5 Ų142.582%0.82481%0.808SS**  68.89572.8-158.633.5000112.6
216D58.6Low53.1Low131 Ų131140.9 Ų140.970%0.70181%0.808SS**  trans23.9111.5153.3-161.116.8000119.3
217N55.5Low53.4Low139 Ų139139 Ų13974%0.74380%0.801SS**  trans173.892.8134.6-101.2-83.2000111
218T55.6Low53.2Low142 Ų142142.9 Ų142.987%0.87180%0.802SS**  trans-132.967.916655.50000110.8
219D56.4Low53.4Low158 Ų158143.4 Ų143.485%0.84581%0.807SS**  trans-62.8142.8174.4-120.8-16.9000111.4A221D219-A221 PolarHBondContact O-N 3.26Å
220E56.1Low53Low160 Ų160141.9 Ų141.975%0.74880%0.801SS**  trans-74115.6-165.1-168-169.1138.400113.4T222E220-T222 HydrophobicContact CG-CG2 4.29Å; E220-T222 WeakPolarHBondContact OE1-CG2 3.48Å; E220-T222 PolarHBondContact OE1-OG1 3.27Å
221A55.3Low53.3Low102 Ų102138.7 Ų138.784%0.84380%0.801SS**  trans-105.163.7-17900000113.3D219D219-A221 PolarHBondContact O-N 3.26Å
222T48.1Very low53.8Low114 Ų114145.7 Ų145.770%0.69982%0.821SS**  trans-82146.4170.338.10000112.1E220E220-T222 HydrophobicContact CG-CG2 4.29Å; E220-T222 WeakPolarHBondContact OE1-CG2 3.48Å; E220-T222 PolarHBondContact OE1-OG1 3.27Å
223Y50.3Low53.9Low270 Ų270149.5 Ų149.5100%1.05982%0.817SS**  trans-141.20-169.6-176.1-82.7000115.2

Retrieved 223 of 223 residues in 39.2 ms (Link to these results)