A0A096MVL4_PAPAN Loading...

Coiled-coil domain containing 59

AlphaFold DB , UniProt , Accession A0A096MVL4, Species PAPAN (Papio anubis, Olive baboon), Gene CCDC59, Length 241 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M42.4Very low45.4Very low247 Ų247172.5 Ų172.5100%1.21788%0.884SS**  0113.70-78.8-66.5149.600108.3
2A45.1Very low45.4Very low92 Ų92167.8 Ų167.876%0.7687%0.873SS**  trans-108.8142.6-179.700000109.7
3P60.5Low44.8Very low128 Ų128168.3 Ų168.383%0.83188%0.878SS**PPolyproline II helixtrans-83.1132.8-176.931.7-30.8000111.7
4V51.6Low44.3Very low138 Ų138161.1 Ų161.184%0.83687%0.865SS**PPolyproline II helixtrans-79.1128.4175.6177.90000109.4
5R47.3Very low43.9Very low240 Ų240164.9 Ų164.991%0.90687%0.871SS**PPolyproline II helixtrans-76.2130.8174-65.4-172.9-176.6-138.51.5110.1
6R48.3Very low43.5Very low250 Ų250167.4 Ų167.494%0.94388%0.876SS**PPolyproline II helixtrans-79.4131.7172.2-71.3-175174.4179.1-1.4110.5
7A43.7Very low43.3Very low94 Ų94162.9 Ų162.978%0.77787%0.869SS**PPolyproline II helixtrans-78.7135.6173.300000110.8
8A44.8Very low43.1Very low92 Ų92168.1 Ų168.176%0.7688%0.875SS**PPolyproline II helixtrans-77.6127.417400000110.2
9K41.8Very low42.6Very low206 Ų206163.5 Ų163.590%0.89687%0.873SS**PPolyproline II helixtrans-85.7129.5173.3-62178.2179-1760108.5
10W38.3Very low42.5Very low243 Ų243165.7 Ų165.792%0.9288%0.877SS**PPolyproline II helixtrans-95.6131.3164.7-71.588.8000108.4
11L35.5Very low42.4Very low168 Ų168161.1 Ų161.188%0.8887%0.87SS**PPolyproline II helixtrans-100.9140.2166.2-86.9157.8000108.5
12P46Very low42Very low116 Ų116155.9 Ų155.975%0.75385%0.852SS**PPolyproline II helixtrans-100.6133.1167.535.3-24.4000110.3
13D37.1Very low41.9Very low174 Ų174156.6 Ų156.693%0.9385%0.851SS**  trans-154.1136.8166.9-129.55.3000105.2
14G38.4Very low40.9Very low68 Ų68154.8 Ų154.870%0.70185%0.847SS**  cis-176.2145.41.200000105.2
15F37.2Very low40.7Very low218 Ų218155 Ų15596%0.95685%0.848SS**  trans-80.4127.4174.5-110.1-101.1000109.1
16E38.4Very low40.3Very low204 Ų204152.1 Ų152.195%0.95385%0.845SS**  trans-144.7149.2155.5-80.8-160.716000112.1
17A40.4Very low40.2Very low92 Ų92144.9 Ų144.976%0.7683%0.833SS**  trans-112152.8-159.900000113.6
18R39.4Very low40.3Very low256 Ų256151.5 Ų151.597%0.96684%0.838SS**  trans47.1118.9142.1-70.4-93.3-131.1-111.8-3.6120.2
19G33.9Very low40.6Very low81 Ų81154.5 Ų154.584%0.83584%0.841SS**  trans-154.5138152.100000110.9
20E40.8Very low41.4Very low207 Ų207153.8 Ų153.897%0.96784%0.838SS**  trans-73.9163-169.4-65.7169.5129.400115.8
21G38.8Very low42.5Very low70 Ų70149.2 Ų149.272%0.72283%0.831SS**  trans126.887.5140.700000120.5
22V35.1Very low43.5Very low137 Ų137147 Ų14783%0.8382%0.824SS**  trans56129.3134.5-162.30000123.4
23S41.9Very low44.3Very low107 Ų107150.9 Ų150.975%0.74883%0.83SS**  trans61.1119.5151.470.40000121.2
24A39.7Very low45.5Very low90 Ų90150.6 Ų150.674%0.74482%0.822SS**  170.3128.38600000108.9E26A24-E26 PolarHBondContact O-N 3.43Å
25V48.4Very low46.7Very low143 Ų143156.4 Ų156.487%0.86783%0.828SS**  trans-70.3115.1167.5167.60000107.4
26E38.8Very low48.1Very low179 Ų179151.8 Ų151.884%0.83682%0.819SS**  trans165.6138.8154.1-94.1166.4-155.100105.3A24A24-E26 PolarHBondContact O-N 3.43Å
27S45.2Very low49.2Very low98 Ų98153.8 Ų153.869%0.68582%0.818SS**  cis-169132.98.838.20000107.4
28R45.9Very low50.3Low233 Ų233159 Ų15988%0.87982%0.817SS**  trans38.995.1154.1-59.2-179.9-178.4-1800.5118.1K30R28-K30 PolarHBondContact O-N 3.48Å
29N52.6Low51.2Low155 Ų155152.5 Ų152.583%0.82981%0.808SS**  trans-64.296.1161.6-66.6-35.4000111.5N31N29-N31 PolarHBondContact O-N 3.14Å; N29-N31 VanDerWaalsContact O-N 3.14Å
30K58.6Low52.6Low190 Ų190155.2 Ų155.283%0.82680%0.804SS**  trans-81.868.1163.5-64.4179.9-175.4174.50109.7R28R28-K30 PolarHBondContact O-N 3.48Å
31N60.7Low53.6Low148 Ų148153.2 Ų153.279%0.79179%0.794SS**  trans-141.146.3172.2-75.6-49.8000111N29 K33N29-N31 PolarHBondContact O-N 3.14Å; N29-N31 VanDerWaalsContact O-N 3.14Å; N31-K33 PolarHBondContact O-N 3.44Å
32V55.6Low54.7Low121 Ų121155.4 Ų155.473%0.73380%0.796SS**  trans-85.995.6159.9-176.10000105.9Q34V32-Q34 PolarHBondContact O-N 3.08Å
33K64Low56Low198 Ų198155.9 Ų155.986%0.86179%0.789SS**  trans-52.7107.3162.5-68.3-177.2179.5-1790106.2N31 K35N31-K33 PolarHBondContact O-N 3.44Å; K33-K35 PolarHBondContact O-N 3.18Å
34Q62.8Low57.1Low167 Ų167156.3 Ų156.378%0.7880%0.799SS**  trans-55.3112.9174.3-74.8-76.3-800106.8V32 T36V32-Q34 PolarHBondContact O-N 3.08Å; Q34-T36 PolarHBondContact O-N 3.27Å
35K63.2Low58Low190 Ų190156.3 Ų156.383%0.82678%0.783SS**  trans-63.9102.7178.1-170.5170.3-176.4175.60106.3K33 W37K33-K35 PolarHBondContact O-N 3.18Å; K35-W37 PolarHBondContact O-N 3.5Å
36T65.4Low58.7Low122 Ų122154 Ų15475%0.74877%0.768SS**  trans-57.5112.3178.6-25.60000107Q34 R38Q34-T36 PolarHBondContact O-N 3.27Å; T36-R38 VanDerWaalsContact C-N 3.26Å; T36-R38 PolarHBondContact O-N 3.08Å
37W61.3Low60Low246 Ų246146.8 Ų146.893%0.93274%0.742SS**  trans-64.993172.3-94.493000107.2K35 P39K35-W37 PolarHBondContact O-N 3.5Å; W37-P39 WeakPolarHBondContact O-CD 3.42Å
38R64.4Low61.2Low200 Ų200144.1 Ų144.176%0.75572%0.723SS**  trans-69.9125.5162.3-66.9-166.9180-111.60.8105.9T36 N40T36-R38 VanDerWaalsContact C-N 3.26Å; T36-R38 PolarHBondContact O-N 3.08Å; R38-N40 PolarHBondContact O-N 2.82Å
39P59.2Low62Low120 Ų120138.6 Ų138.678%0.77972%0.716SS**  trans-64.297.1162.412.2-3.4000105.6W37 H41W37-P39 WeakPolarHBondContact O-CD 3.42Å; P39-H41 PolarHBondContact O-N 3.01Å
40N61.4Low62.7Low138 Ų138142.9 Ų142.974%0.73872%0.72SS**  trans-6290.7157.3-74.1-30.6000104R38 P42R38-N40 PolarHBondContact O-N 2.82Å; N40-P42 VanDerWaalsContact C-N 3.27Å; N40-P42 WeakPolarHBondContact O-CD 3.33Å
41H62.5Low63.1Low165 Ų165140 Ų14076%0.76471%0.709SS**  trans-45.599.1156.650.5-30.9000106.9P39 Q43P39-H41 PolarHBondContact O-N 3.01Å; H41-Q43 PolarHBondContact O-N 2.86Å
42P63Low63.4Low117 Ų117135.5 Ų135.576%0.7670%0.698SS**  trans-75.298.6171.726.1-13.2000101.6N40 A44N40-P42 VanDerWaalsContact C-N 3.27Å; N40-P42 WeakPolarHBondContact O-CD 3.33Å; P42-A44 WeakPolarHBondContact O-CA 3.47Å; P42-A44 PolarHBondContact O-N 3.07Å
43Q61.5Low64.1Low146 Ų146134.6 Ų134.668%0.68269%0.686SS**  trans-2.698173.5-168.3168.4-1.900111H41 F45H41-Q43 PolarHBondContact O-N 2.86Å; Q43-F45 CarbonylContact O-C 3.43Å; Q43-F45 VanDerWaalsContact O-C 3.29Å; Q43-F45 PolarHBondContact O-N 3.18Å
44A64.2Low64.9Low117 Ų117125.6 Ų125.697%0.96765%0.649SS**SBendtrans-53.1-14.8-165.500000113.4P42P42-A44 WeakPolarHBondContact O-CA 3.47Å; P42-A44 PolarHBondContact O-N 3.07Å
45F59.8Low65.8Low90 Ų90123.9 Ų123.940%0.39564%0.639SS.*SBendtrans-113.4112.2172.6-171.4-105.3000111.1Q43 G47 V49Q43-F45 CarbonylContact O-C 3.43Å; Q43-F45 VanDerWaalsContact O-C 3.29Å; Q43-F45 PolarHBondContact O-N 3.18Å; F45-G47 WeakPolarHBondContact CD1-O 3.45Å; F45-G47 WeakPolarHBondContact CE1-O 3.38Å; F45-G47 PolarHBondContact O-N 2.84Å; F45-V49 HydrophobicContact CD1-CG2 3.87Å; F45-V49 HydrophobicContact CE1-CB 4.47Å; F45-V49 HydrophobicContact CE1-CG2 3.44Å; F45-V49 VanDerWaalsContact CE1-CG2 3.44Å; F45-V49 HydrophobicContact CZ-CG2 3.93Å
46V62.6Low66.7Low94 Ų94118.6 Ų118.657%0.5763%0.631SS**SBendtrans-74.490.5171.4179.90000108.7G54V46-G54 VanDerWaalsContact O-CA 3.32Å; V46-G54 WeakPolarHBondContact O-CA 3.49Å
47G67.4Low67.7Low28 Ų28117.7 Ų117.729%0.28962%0.617SS.*SBendtrans142.1172.7169.900000115F45 Q53F45-G47 WeakPolarHBondContact CD1-O 3.45Å; F45-G47 WeakPolarHBondContact CE1-O 3.38Å; F45-G47 PolarHBondContact O-N 2.84Å; G47-Q53 CarbonylContact C-O 3.52Å; G47-Q53 WeakPolarHBondContact CA-O 3.28Å
48S69.7Low68.8Low41 Ų41112 Ų11229%0.28760%0.595SS.*  trans-96.5113.8173.9177.20000109.5R50 E51 G52 Q53S48-R50 PolarHBondContact O-N 2.73Å; S48-E51 PolarHBondContact O-N 3.46Å; S48-E51 VanDerWaalsContact O-N 3.07Å; S48-G52 PolarHBondContact O-N 2.95Å; S48-Q53 CarbonylContact C-O 3.6Å; S48-Q53 PolarHBondContact N-O 3.2Å; S48-Q53 PolarHBondContact O-N 3.43Å
49V63Low69.9Low118 Ų118109.8 Ų109.872%0.71559%0.587SS**G310 helixtrans-54.8-35.1175.8178.60000110.9F45 E51 G52F45-V49 HydrophobicContact CD1-CG2 3.87Å; F45-V49 HydrophobicContact CE1-CB 4.47Å; F45-V49 HydrophobicContact CE1-CG2 3.44Å; F45-V49 VanDerWaalsContact CE1-CG2 3.44Å; F45-V49 HydrophobicContact CZ-CG2 3.93Å; V49-E51 VanDerWaalsContact C-N 3.33Å; V49-E51 PolarHBondContact O-N 2.92Å; V49-G52 PolarHBondContact O-N 3.3Å
50R66.5Low71.4Confident245 Ų245110.2 Ų110.293%0.92558%0.576SS**G310 helixtrans-68.7-28.5-179.7-64.2-173.6178-157.6-0.6113.5S48S48-R50 PolarHBondContact O-N 2.73Å
51E67.6Low72.9Confident129 Ų129107 Ų10760%0.60356%0.559SS**G310 helixtrans-98.5-0-177-63177.3-177.300112.7S48 V49 Q53S48-E51 PolarHBondContact O-N 3.46Å; S48-E51 VanDerWaalsContact O-N 3.07Å; V49-E51 VanDerWaalsContact C-N 3.33Å; V49-E51 PolarHBondContact O-N 2.92Å; E51-Q53 HydrophobicContact CB-CB 4.39Å; E51-Q53 HydrophobicContact CB-CG 4.01Å; E51-Q53 PolarHBondContact O-N 3.11Å; E51-Q53 VanDerWaalsContact O-N 3.11Å
52G67Low74.5Confident53 Ų53107.3 Ų107.355%0.54655%0.553SS.*THydrogen-bonded Turntrans64.99.2-172.400000113.6S48 V49S48-G52 PolarHBondContact O-N 2.95Å; V49-G52 PolarHBondContact O-N 3.3Å
53Q68.9Low75.9Confident102 Ų102106.5 Ų106.548%0.47754%0.542SS..  trans-88112.7176.6-62.5-175.516.800107.2G47 S48 E51G47-Q53 CarbonylContact C-O 3.52Å; G47-Q53 WeakPolarHBondContact CA-O 3.28Å; S48-Q53 CarbonylContact C-O 3.6Å; S48-Q53 PolarHBondContact N-O 3.2Å; S48-Q53 PolarHBondContact O-N 3.43Å; E51-Q53 HydrophobicContact CB-CB 4.39Å; E51-Q53 HydrophobicContact CB-CG 4.01Å; E51-Q53 PolarHBondContact O-N 3.11Å; E51-Q53 VanDerWaalsContact O-N 3.11Å
54G80.9Confident77.6Confident9 Ų9103.5 Ų103.59%0.09353%0.528CS..SBendtrans-171.1-166.5-172.400000112.9V46 A56 F57 R58V46-G54 VanDerWaalsContact O-CA 3.32Å; V46-G54 WeakPolarHBondContact O-CA 3.49Å; G54-A56 VanDerWaalsContact C-N 3.27Å; G54-A56 PolarHBondContact O-N 3.31Å; G54-F57 PolarHBondContact O-N 3.23Å; G54-F57 VanDerWaalsContact O-N 3.14Å; G54-R58 PolarHBondContact O-N 3.33Å
55F82.3Confident79.1Confident132 Ų132103.4 Ų103.458%0.57951%0.507SS*.Hα-helixtrans-55.3-41.1174.8-179.3-99.9000112.7F57 R58 R59F55-F57 PolarHBondContact O-N 3.42Å; F55-R58 PolarHBondContact O-N 3.47Å; F55-R59 WeakPolarHBondContact O-CB 3.38Å; F55-R59 PolarHBondContact O-N 3.06Å
56A83.1Confident80.8Confident78 Ų78102 Ų10265%0.64551%0.509SS*.Hα-helixtrans-60.9-42.9176.900000112.3G54 R59 K60G54-A56 VanDerWaalsContact C-N 3.27Å; G54-A56 PolarHBondContact O-N 3.31Å; A56-R59 PolarHBondContact O-N 3.23Å; A56-K60 WeakPolarHBondContact O-CB 3.47Å; A56-K60 PolarHBondContact O-N 2.94Å
57F85.7Confident82.5Confident104 Ų104104.2 Ų104.246%0.45651%0.508SS..Hα-helixtrans-65.7-43.1175.7-177.1-100.2000112.1G54 F55 R59 K60 L61G54-F57 PolarHBondContact O-N 3.23Å; G54-F57 VanDerWaalsContact O-N 3.14Å; F55-F57 PolarHBondContact O-N 3.42Å; F57-R59 VanDerWaalsContact C-N 3.33Å; F57-R59 PolarHBondContact O-N 3.35Å; F57-K60 PolarHBondContact O-N 3.05Å; F57-L61 WeakPolarHBondContact O-CB 3.48Å; F57-L61 PolarHBondContact O-N 2.89Å
58R85.3Confident83.8Confident125 Ų125108.9 Ų108.947%0.47252%0.52SS..Hα-helixtrans-62.1-40.3175-67.9175.972.7-168.54.1111.7G54 F55 L61 R62G54-R58 PolarHBondContact O-N 3.33Å; F55-R58 PolarHBondContact O-N 3.47Å; R58-L61 PolarHBondContact O-N 3.31Å; R58-R62 WeakPolarHBondContact O-CB 3.28Å; R58-R62 WeakPolarHBondContact O-CG 3.41Å; R58-R62 PolarHBondContact O-N 3.47Å
59R87.3Confident85.1Confident155 Ų155113.4 Ų113.459%0.58554%0.535SS*.Hα-helixtrans-65.5-46175.3-170.6174.2-177.7129.4-1.9111.1F55 A56 F57 L61 R62 I63F55-R59 WeakPolarHBondContact O-CB 3.38Å; F55-R59 PolarHBondContact O-N 3.06Å; A56-R59 PolarHBondContact O-N 3.23Å; F57-R59 VanDerWaalsContact C-N 3.33Å; F57-R59 PolarHBondContact O-N 3.35Å; R59-L61 VanDerWaalsContact C-N 3.33Å; R59-L61 PolarHBondContact O-N 2.93Å; R59-R62 PolarHBondContact O-N 2.99Å; R59-I63 HydrophobicContact CG-CD1 4.08Å; R59-I63 VanDerWaalsContact O-CG1 3.28Å; R59-I63 WeakPolarHBondContact O-CG1 3.39Å; R59-I63 PolarHBondContact O-N 2.89Å
60K90.6Very high86.7Confident128 Ų128112.3 Ų112.356%0.55752%0.524SS*.Hα-helixtrans-56.6-45.7173.3-175.8177.8-178.6176.50111.4A56 F57 I63 Q64A56-K60 WeakPolarHBondContact O-CB 3.47Å; A56-K60 PolarHBondContact O-N 2.94Å; F57-K60 PolarHBondContact O-N 3.05Å; K60-I63 PolarHBondContact O-N 2.89Å; K60-Q64 WeakPolarHBondContact O-CG 3.46Å; K60-Q64 PolarHBondContact O-N 2.98Å
61L92.4Very high88Confident71 Ų71103.3 Ų103.337%0.37249%0.494SS..Hα-helixtrans-65.5-41.4178.3-168.469.7000111.9F57 R58 R59 Q64 Q65F57-L61 WeakPolarHBondContact O-CB 3.48Å; F57-L61 PolarHBondContact O-N 2.89Å; R58-L61 PolarHBondContact O-N 3.31Å; R59-L61 VanDerWaalsContact C-N 3.33Å; R59-L61 PolarHBondContact O-N 2.93Å; L61-Q64 PolarHBondContact O-N 2.76Å; L61-Q65 WeakPolarHBondContact O-CB 3.4Å; L61-Q65 VanDerWaalsContact O-CG 3.27Å; L61-Q65 WeakPolarHBondContact O-CG 3.41Å; L61-Q65 PolarHBondContact O-N 2.99Å
62R95.1Very high89Confident172 Ų172105.8 Ų105.865%0.64950%0.498SS*.Hα-helixtrans-59.6-44.9173.3-81.5-177.6174.1-175.6-1.4111.9R58 R59 Q65 S66R58-R62 WeakPolarHBondContact O-CB 3.28Å; R58-R62 WeakPolarHBondContact O-CG 3.41Å; R58-R62 PolarHBondContact O-N 3.47Å; R59-R62 PolarHBondContact O-N 2.99Å; R62-Q65 PolarHBondContact O-N 3.45Å; R62-S66 PolarHBondContact O-N 2.99Å; R62-S66 PolarHBondContact O-OG 3.16Å
63I94.2Very high90.2Very high100 Ų100109 Ų10951%0.51350%0.497SS..Hα-helixtrans-63.3-42.8176.5-67.2165.2000110.8R59 K60 Q65 S66 Y67R59-I63 HydrophobicContact CG-CD1 4.08Å; R59-I63 VanDerWaalsContact O-CG1 3.28Å; R59-I63 WeakPolarHBondContact O-CG1 3.39Å; R59-I63 PolarHBondContact O-N 2.89Å; K60-I63 PolarHBondContact O-N 2.89Å; I63-Q65 VanDerWaalsContact C-N 3.33Å; I63-Q65 PolarHBondContact O-N 3.15Å; I63-S66 WeakPolarHBondContact CA-OG 3.44Å; I63-S66 PolarHBondContact O-N 3.42Å; I63-S66 PolarHBondContact O-OG 3.4Å; I63-Y67 WeakPolarHBondContact O-CB 3.41Å; I63-Y67 PolarHBondContact O-N 3.46Å
64Q95.8Very high91.2Very high83 Ų83108.9 Ų108.939%0.38850%0.496SS..Hα-helixtrans-62.5-40.5175.7-74.9-179.9-8.800112.2K60 L61 K68K60-Q64 WeakPolarHBondContact O-CG 3.46Å; K60-Q64 PolarHBondContact O-N 2.98Å; L61-Q64 PolarHBondContact O-N 2.76Å; Q64-K68 WeakPolarHBondContact O-CB 3.18Å; Q64-K68 VanDerWaalsContact O-CG 3.3Å; Q64-K68 WeakPolarHBondContact O-CG 3.41Å; Q64-K68 PolarHBondContact O-N 3Å
65Q96.2Very high91.4Very high114 Ų114115.6 Ų115.653%0.53352%0.523SS..Hα-helixtrans-67.4-42.7177.5-73.6173.4-300111.8L61 R62 I63 K68 K69L61-Q65 WeakPolarHBondContact O-CB 3.4Å; L61-Q65 VanDerWaalsContact O-CG 3.27Å; L61-Q65 WeakPolarHBondContact O-CG 3.41Å; L61-Q65 PolarHBondContact O-N 2.99Å; R62-Q65 PolarHBondContact O-N 3.45Å; I63-Q65 VanDerWaalsContact C-N 3.33Å; I63-Q65 PolarHBondContact O-N 3.15Å; Q65-K68 PolarHBondContact O-N 3Å; Q65-K69 WeakPolarHBondContact O-CB 3.43Å; Q65-K69 PolarHBondContact O-N 3.32Å
66S95.7Very high91.3Very high62 Ų62116.5 Ų116.543%0.43453%0.526SS..Hα-helixtrans-63.8-42.7175.764.80000111.4R62 I63 K69 L70R62-S66 PolarHBondContact O-N 2.99Å; R62-S66 PolarHBondContact O-OG 3.16Å; I63-S66 WeakPolarHBondContact CA-OG 3.44Å; I63-S66 PolarHBondContact O-N 3.42Å; I63-S66 PolarHBondContact O-OG 3.4Å; S66-K69 WeakPolarHBondContact O-CA 3.41Å; S66-K69 VanDerWaalsContact O-CB 3.3Å; S66-K69 WeakPolarHBondContact O-CB 3.4Å; S66-K69 PolarHBondContact O-N 3.13Å; S66-K69 VanDerWaalsContact O-N 3.11Å; S66-L70 PolarHBondContact O-N 2.93Å
67Y97.1Very high91.1Very high139 Ų139117 Ų11755%0.54552%0.521SS..Hα-helixtrans-60.3-48.3174.8176.5-115.1000112.4I63 K69 L70 L71I63-Y67 WeakPolarHBondContact O-CB 3.41Å; I63-Y67 PolarHBondContact O-N 3.46Å; Y67-K69 PolarHBondContact O-N 3.39Å; Y67-L70 WeakPolarHBondContact O-CB 3.48Å; Y67-L70 PolarHBondContact O-N 3.2Å; Y67-L71 HydrophobicContact CD1-CD1 4.03Å; Y67-L71 HydrophobicContact CE1-CD1 3.46Å; Y67-L71 VanDerWaalsContact CE1-CD1 3.46Å; Y67-L71 HydrophobicContact CE1-CG 4.12Å; Y67-L71 HydrophobicContact CE2-CD1 4.34Å; Y67-L71 HydrophobicContact CE2-CD2 4.23Å; Y67-L71 HydrophobicContact CE2-CG 4.12Å; Y67-L71 PolarHBondContact O-N 2.61Å
68K96.3Very high90.4Very high126 Ų126118.2 Ų118.255%0.54853%0.526SS..Hα-helixtrans-59.4-33174.5-73.9175.3-178.6179.70112.1Q64 Q65 R72Q64-K68 WeakPolarHBondContact O-CB 3.18Å; Q64-K68 VanDerWaalsContact O-CG 3.3Å; Q64-K68 WeakPolarHBondContact O-CG 3.41Å; Q64-K68 PolarHBondContact O-N 3Å; Q65-K68 PolarHBondContact O-N 3Å; K68-R72 VanDerWaalsContact O-CG 3.27Å; K68-R72 WeakPolarHBondContact O-CG 3.47Å; K68-R72 PolarHBondContact O-N 2.68Å
69K96.1Very high89.3Confident137 Ų137116.6 Ų116.660%0.59653%0.531SS*.Hα-helixtrans-67.7-40174.6-169.5-180-178.4-179.90111.5Q65 S66 Y67 R72 K73Q65-K69 WeakPolarHBondContact O-CB 3.43Å; Q65-K69 PolarHBondContact O-N 3.32Å; S66-K69 WeakPolarHBondContact O-CA 3.41Å; S66-K69 VanDerWaalsContact O-CB 3.3Å; S66-K69 WeakPolarHBondContact O-CB 3.4Å; S66-K69 PolarHBondContact O-N 3.13Å; S66-K69 VanDerWaalsContact O-N 3.11Å; Y67-K69 PolarHBondContact O-N 3.39Å; K69-R72 PolarHBondContact O-N 2.69Å; K69-K73 WeakPolarHBondContact O-CG 3.47Å; K69-K73 PolarHBondContact O-N 3.27Å
70L95.9Very high88.1Confident95 Ų95112 Ų11250%0.49752%0.522SS..Hα-helixtrans-62.9-49.2173.6-67.6174.8000111.4S66 Y67 R72 K73 E74S66-L70 PolarHBondContact O-N 2.93Å; Y67-L70 WeakPolarHBondContact O-CB 3.48Å; Y67-L70 PolarHBondContact O-N 3.2Å; L70-R72 PolarHBondContact O-N 2.62Å; L70-K73 WeakPolarHBondContact O-CA 3.36Å; L70-K73 WeakPolarHBondContact O-CB 3.27Å; L70-K73 PolarHBondContact O-N 3.42Å; L70-E74 PolarHBondContact O-N 3.42Å
71L93.9Very high86.8Confident55 Ų55112 Ų11229%0.28853%0.528SS..Hα-helixtrans-57-37175.5-69.6178.6000112.8Y67 K75Y67-L71 HydrophobicContact CD1-CD1 4.03Å; Y67-L71 HydrophobicContact CE1-CD1 3.46Å; Y67-L71 VanDerWaalsContact CE1-CD1 3.46Å; Y67-L71 HydrophobicContact CE1-CG 4.12Å; Y67-L71 HydrophobicContact CE2-CD1 4.34Å; Y67-L71 HydrophobicContact CE2-CD2 4.23Å; Y67-L71 HydrophobicContact CE2-CG 4.12Å; Y67-L71 PolarHBondContact O-N 2.61Å; L71-K75 WeakPolarHBondContact O-CB 3.29Å; L71-K75 VanDerWaalsContact O-CG 3.28Å; L71-K75 WeakPolarHBondContact O-CG 3.16Å; L71-K75 PolarHBondContact O-N 2.83Å
72R89.9Confident85.3Confident182 Ų182113 Ų11369%0.68753%0.531SS*.Hα-helixtrans-66.4-38.6174-75.7173.7-178.1-169.20.3112.1K68 K69 L70 K76K68-R72 VanDerWaalsContact O-CG 3.27Å; K68-R72 WeakPolarHBondContact O-CG 3.47Å; K68-R72 PolarHBondContact O-N 2.68Å; K69-R72 PolarHBondContact O-N 2.69Å; L70-R72 PolarHBondContact O-N 2.62Å; R72-K76 VanDerWaalsContact O-CG 3.26Å; R72-K76 WeakPolarHBondContact O-CG 2.92Å; R72-K76 PolarHBondContact O-N 3.24Å
73K92.3Very high83.6Confident121 Ų121109 Ų10953%0.52653%0.528SS..Hα-helixtrans-66.4-46.1175.9-72.8-177.7171.8-1660110.9K69 L70 K75 K76 V77K69-K73 WeakPolarHBondContact O-CG 3.47Å; K69-K73 PolarHBondContact O-N 3.27Å; L70-K73 WeakPolarHBondContact O-CA 3.36Å; L70-K73 WeakPolarHBondContact O-CB 3.27Å; L70-K73 PolarHBondContact O-N 3.42Å; K73-K75 PolarHBondContact O-N 3.34Å; K73-K76 WeakPolarHBondContact O-CB 3.34Å; K73-K76 PolarHBondContact O-N 3.32Å; K73-K76 VanDerWaalsContact O-N 3.16Å; K73-V77 WeakPolarHBondContact O-CG2 3.49Å; K73-V77 PolarHBondContact O-N 2.92Å
74E89Confident81.8Confident98 Ų98112 Ų11246%0.45854%0.541SS..Hα-helixtrans-58.8-46.6175.6-72.3173.2-163.100112L70 K76 V77 K78L70-E74 PolarHBondContact O-N 3.42Å; E74-K76 VanDerWaalsContact C-N 3.29Å; E74-K76 PolarHBondContact O-N 2.92Å; E74-V77 PolarHBondContact O-N 3.47Å; E74-K78 WeakPolarHBondContact O-CB 3.37Å; E74-K78 WeakPolarHBondContact O-CG 3.29Å; E74-K78 PolarHBondContact O-N 3.13Å
75K85.3Confident79.5Confident150 Ų150117.6 Ų117.665%0.65256%0.564SS**Hα-helixtrans-59.8-39.8176.1-74.2-178.1-179.7-164.40112.1L71 K73 K78 T79L71-K75 WeakPolarHBondContact O-CB 3.29Å; L71-K75 VanDerWaalsContact O-CG 3.28Å; L71-K75 WeakPolarHBondContact O-CG 3.16Å; L71-K75 PolarHBondContact O-N 2.83Å; K73-K75 PolarHBondContact O-N 3.34Å; K75-K78 PolarHBondContact O-N 3.26Å; K75-T79 WeakPolarHBondContact O-CG2 3.32Å; K75-T79 PolarHBondContact O-N 3.31Å; K75-T79 PolarHBondContact O-OG1 3.41Å
76K79.8Confident77.2Confident151 Ų151114.9 Ų114.966%0.65756%0.555SS**Hα-helixtrans-65-40.1175.8-76178.4176.6-158.60112.8R72 K73 E74 T79 S80R72-K76 VanDerWaalsContact O-CG 3.26Å; R72-K76 WeakPolarHBondContact O-CG 2.92Å; R72-K76 PolarHBondContact O-N 3.24Å; K73-K76 WeakPolarHBondContact O-CB 3.34Å; K73-K76 PolarHBondContact O-N 3.32Å; K73-K76 VanDerWaalsContact O-N 3.16Å; E74-K76 VanDerWaalsContact C-N 3.29Å; E74-K76 PolarHBondContact O-N 2.92Å; K76-T79 VanDerWaalsContact C-OG1 3.29Å; K76-T79 VanDerWaalsContact CA-OG1 3.28Å; K76-T79 WeakPolarHBondContact CA-OG1 3.46Å; K76-T79 PolarHBondContact O-N 3.1Å; K76-T79 PolarHBondContact O-OG1 2.71Å; K76-S80 PolarHBondContact O-N 2.84Å; K76-S80 PolarHBondContact O-OG 3.38Å
77V78.6Confident75.7Confident88 Ų88118.9 Ų118.953%0.53357%0.571SS.*Hα-helixtrans-68.6-41.3176.6174.40000110.8K73 E74 T79 S80 L81K73-V77 WeakPolarHBondContact O-CG2 3.49Å; K73-V77 PolarHBondContact O-N 2.92Å; E74-V77 PolarHBondContact O-N 3.47Å; V77-T79 PolarHBondContact O-N 2.96Å; V77-S80 WeakPolarHBondContact CA-OG 3.45Å; V77-S80 PolarHBondContact O-N 3.49Å; V77-S80 PolarHBondContact O-OG 2.87Å; V77-L81 WeakPolarHBondContact O-CB 3.43Å; V77-L81 PolarHBondContact O-N 3.21Å
78K71.9Confident74.1Confident130 Ų130120.1 Ų120.157%0.56558%0.575SS**Hα-helixtrans-60.2-45.6173.3-71.4175.9-178.2-175.30111E74 K75 S80 L81 E82E74-K78 WeakPolarHBondContact O-CB 3.37Å; E74-K78 WeakPolarHBondContact O-CG 3.29Å; E74-K78 PolarHBondContact O-N 3.13Å; K75-K78 PolarHBondContact O-N 3.26Å; K78-S80 VanDerWaalsContact C-N 3.32Å; K78-S80 PolarHBondContact O-N 3.08Å; K78-L81 PolarHBondContact O-N 2.9Å; K78-E82 WeakPolarHBondContact O-CB 3.48Å; K78-E82 PolarHBondContact O-N 3.4Å
79T63Low72.6Confident92 Ų92119.2 Ų119.256%0.56457%0.569SS**Hα-helixtrans-63-35.9174.451.80000112.7K75 K76 V77 S83K75-T79 WeakPolarHBondContact O-CG2 3.32Å; K75-T79 PolarHBondContact O-N 3.31Å; K75-T79 PolarHBondContact O-OG1 3.41Å; K76-T79 VanDerWaalsContact C-OG1 3.29Å; K76-T79 VanDerWaalsContact CA-OG1 3.28Å; K76-T79 WeakPolarHBondContact CA-OG1 3.46Å; K76-T79 PolarHBondContact O-N 3.1Å; K76-T79 PolarHBondContact O-OG1 2.71Å; V77-T79 PolarHBondContact O-N 2.96Å; T79-S83 WeakPolarHBondContact O-CB 3.26Å; T79-S83 PolarHBondContact O-N 3.24Å
80S61.7Low71.9Confident58 Ų58116 Ų11641%0.40656%0.563SS.*Hα-helixtrans-73.3-36.9176.760.70000112.9K76 V77 K78 S83 Q84K76-S80 PolarHBondContact O-N 2.84Å; K76-S80 PolarHBondContact O-OG 3.38Å; V77-S80 WeakPolarHBondContact CA-OG 3.45Å; V77-S80 PolarHBondContact O-N 3.49Å; V77-S80 PolarHBondContact O-OG 2.87Å; K78-S80 VanDerWaalsContact C-N 3.32Å; K78-S80 PolarHBondContact O-N 3.08Å; S80-S83 PolarHBondContact O-N 2.89Å; S80-Q84 WeakPolarHBondContact O-CG 3.25Å; S80-Q84 PolarHBondContact O-N 2.92Å
81L62.3Low70.8Confident128 Ų128118.1 Ų118.167%0.6757%0.574SS**Hα-helixtrans-70.8-42.3177.6-176.6134.6000111V77 K78 S83 Q84V77-L81 WeakPolarHBondContact O-CB 3.43Å; V77-L81 PolarHBondContact O-N 3.21Å; K78-L81 PolarHBondContact O-N 2.9Å; L81-S83 VanDerWaalsContact C-N 3.28Å; L81-S83 PolarHBondContact O-N 3.35Å; L81-Q84 PolarHBondContact O-N 3.34Å
82E61.4Low70.3Confident93 Ų93121.1 Ų121.144%0.43559%0.59SS.*Hα-helixtrans-69.9-28.6174.5-158.6163.2159.100111.5K78 Q84 T86 R88K78-E82 WeakPolarHBondContact O-CB 3.48Å; K78-E82 PolarHBondContact O-N 3.4Å; E82-Q84 VanDerWaalsContact C-N 3.3Å; E82-Q84 PolarHBondContact O-N 2.81Å; E82-T86 HydrophobicContact CG-CG2 4.27Å; E82-T86 PolarHBondContact O-N 2.82Å; E82-T86 PolarHBondContact O-OG1 3.39Å; E82-R88 IonicContact OE1-CZ 2.76Å; E82-R88 IonicContact OE1-NH1 2.61Å; E82-R88 PolarHBondContact OE1-NH1 3.17Å; E82-R88 IonicContact OE1-NH2 3.94Å
83S58.5Low69.8Low86 Ų86115.7 Ų115.760%0.60158%0.575SS**THydrogen-bonded Turntrans-72.7-13.1174.6173.10000114.6T79 S80 L81T79-S83 WeakPolarHBondContact O-CB 3.26Å; T79-S83 PolarHBondContact O-N 3.24Å; S80-S83 PolarHBondContact O-N 2.89Å; L81-S83 VanDerWaalsContact C-N 3.28Å; L81-S83 PolarHBondContact O-N 3.35Å
84Q57.1Low69.4Low165 Ų165115.4 Ų115.477%0.77157%0.573SS**THydrogen-bonded Turntrans-87.1-17.8-179.3-78.8-179.97.500113.7S80 L81 E82S80-Q84 WeakPolarHBondContact O-CG 3.25Å; S80-Q84 PolarHBondContact O-N 2.92Å; L81-Q84 PolarHBondContact O-N 3.34Å; E82-Q84 VanDerWaalsContact C-N 3.3Å; E82-Q84 PolarHBondContact O-N 2.81Å
85F47.7Very low69.1Low200 Ų200116.3 Ų116.388%0.87758%0.578SS**THydrogen-bonded Turntrans-139.56.8-174-145.6-95.6000114.6
86T48.3Very low69.1Low57 Ų57113.9 Ų113.935%0.3557%0.571SS.*SBendtrans-102.4123.2164.455.80000107E82 R88E82-T86 HydrophobicContact CG-CG2 4.27Å; E82-T86 PolarHBondContact O-N 2.82Å; E82-T86 PolarHBondContact O-OG1 3.39Å; T86-R88 PolarHBondContact O-N 3.35Å; T86-R88 VanDerWaalsContact OG1-CB 3.29Å; T86-R88 WeakPolarHBondContact OG1-CB 3.46Å; T86-R88 WeakPolarHBondContact OG1-CD 3.46Å
87D64.3Low68.9Low145 Ų145110.5 Ų110.578%0.77556%0.555SS**  trans-65.967.1166.6-162.218.5000107.8
88R62.8Low69.2Low166 Ų166110.3 Ų110.363%0.62655%0.551SS**  trans-110.797.3-163.9-153.6167.2-160.7173.88.7106E82 T86E82-R88 IonicContact OE1-CZ 2.76Å; E82-R88 IonicContact OE1-NH1 2.61Å; E82-R88 PolarHBondContact OE1-NH1 3.17Å; E82-R88 IonicContact OE1-NH2 3.94Å; T86-R88 PolarHBondContact O-N 3.35Å; T86-R88 VanDerWaalsContact OG1-CB 3.29Å; T86-R88 WeakPolarHBondContact OG1-CB 3.46Å; T86-R88 WeakPolarHBondContact OG1-CD 3.46Å
89Y65.8Low69.6Low107 Ų107107 Ų10742%0.4255%0.547SS..  trans-45140.7175.8-61.5-73.7000111D91 Y97Y89-D91 PolarHBondContact O-N 2.95Å; Y89-Y97 HydrophobicContact CD1-CD2 4.12Å; Y89-Y97 HydrophobicContact CD1-CE1 4.38Å; Y89-Y97 AromaticContact CD1-CE2 3.33Å; Y89-Y97 HydrophobicContact CD1-CE2 3.33Å; Y89-Y97 AromaticContact CD1-CZ 3.52Å; Y89-Y97 HydrophobicContact CD2-CD1 4.08Å; Y89-Y97 HydrophobicContact CD2-CD2 4.13Å; Y89-Y97 AromaticContact CD2-CE1 3.9Å; Y89-Y97 HydrophobicContact CD2-CE1 3.9Å; Y89-Y97 AromaticContact CD2-CE2 3.95Å; Y89-Y97 HydrophobicContact CD2-CE2 3.95Å; Y89-Y97 HydrophobicContact CD2-CG 4.2Å; Y89-Y97 AromaticContact CD2-CZ 3.86Å; Y89-Y97 HydrophobicContact CE1-CE1 4.04Å; Y89-Y97 AromaticContact CE1-CE2 3.61Å; Y89-Y97 HydrophobicContact CE1-CE2 3.61Å; Y89-Y97 AromaticContact CE1-CZ 3.25Å; Y89-Y97 WeakPolarHBondContact CE1-OH 3.39Å; Y89-Y97 HydrophobicContact CE2-CD1 4.04Å; Y89-Y97 AromaticContact CE2-CE1 3.5Å; Y89-Y97 HydrophobicContact CE2-CE1 3.5Å; Y89-Y97 VanDerWaalsContact CE2-CE1 3.5Å; Y89-Y97 HydrophobicContact CE2-CE2 4.18Å; Y89-Y97 AromaticContact CE2-CZ 3.6Å; Y89-Y97 AromaticContact CG-CD2 3.83Å; Y89-Y97 HydrophobicContact CG-CD2 3.83Å; Y89-Y97 HydrophobicContact CG-CE1 4.32Å; Y89-Y97 AromaticContact CG-CE2 3.52Å; Y89-Y97 HydrophobicContact CG-CE2 3.52Å; Y89-Y97 HydrophobicContact CG-CG 4.36Å; Y89-Y97 AromaticContact CG-CZ 3.81Å; Y89-Y97 AromaticContact CZ-CE1 3.56Å; Y89-Y97 AromaticContact CZ-CZ 3.27Å; Y89-Y97 PolarHBondContact OH-OH 2.92Å
90P80.1Confident70.3Confident70 Ų70107 Ų10746%0.45554%0.541SS..  trans-47.3133.7177.2-28.935.3000111.4N92 L93 K94P90-N92 WeakPolarHBondContact CB-OD1 2.93Å; P90-N92 PolarHBondContact O-N 3.5Å; P90-L93 HydrophobicContact CB-CD1 4.08Å; P90-L93 HydrophobicContact CB-CG 4.39Å; P90-L93 HydrophobicContact CG-CD1 3.97Å; P90-L93 WeakPolarHBondContact O-CA 3.34Å; P90-L93 PolarHBondContact O-N 2.85Å; P90-K94 PolarHBondContact O-N 3.16Å
91D72.4Confident71.2Confident138 Ų138109.6 Ų109.674%0.73855%0.546SS*.THydrogen-bonded Turntrans-59.6-27.7-172.7-149.926.9000112.2Y89 L93 K94Y89-D91 PolarHBondContact O-N 2.95Å; D91-L93 VanDerWaalsContact C-N 3.28Å; D91-L93 PolarHBondContact O-N 3.44Å; D91-K94 VanDerWaalsContact O-CB 3.3Å; D91-K94 WeakPolarHBondContact O-CB 3.5Å; D91-K94 PolarHBondContact O-N 2.97Å
92N83.3Confident72Confident118 Ų118108.6 Ų108.663%0.63154%0.538SS*.THydrogen-bonded Turntrans-70.3-18.1173.564.8-33.1000113.9P90 H95P90-N92 WeakPolarHBondContact CB-OD1 2.93Å; P90-N92 PolarHBondContact O-N 3.5Å; N92-H95 PolarHBondContact O-CE1 2.92Å; N92-H95 PolarHBondContact O-ND1 3.46Å
93L79.9Confident72.7Confident69 Ų69110.7 Ų110.736%0.36154%0.542SS..THydrogen-bonded Turntrans-103.6-6.6177.9-65.7169.2000112.7P90 D91 H95 L96 Y97P90-L93 HydrophobicContact CB-CD1 4.08Å; P90-L93 HydrophobicContact CB-CG 4.39Å; P90-L93 HydrophobicContact CG-CD1 3.97Å; P90-L93 WeakPolarHBondContact O-CA 3.34Å; P90-L93 PolarHBondContact O-N 2.85Å; D91-L93 VanDerWaalsContact C-N 3.28Å; D91-L93 PolarHBondContact O-N 3.44Å; L93-H95 PolarHBondContact O-N 3.21Å; L93-L96 HydrophobicContact CD2-CD1 3.76Å; L93-L96 WeakPolarHBondContact O-CB 3.33Å; L93-L96 PolarHBondContact O-N 3.37Å; L93-Y97 PolarHBondContact O-N 3.33Å
94K83.4Confident73.4Confident114 Ų114111.5 Ų111.550%0.49654%0.539SS..Hα-helixtrans-48.8-35.2176.5-174.9177.3-178.2175.90113.2P90 D91 Y97 L98P90-K94 PolarHBondContact O-N 3.16Å; D91-K94 VanDerWaalsContact O-CB 3.3Å; D91-K94 WeakPolarHBondContact O-CB 3.5Å; D91-K94 PolarHBondContact O-N 2.97Å; K94-Y97 PolarHBondContact O-N 3.26Å; K94-L98 HydrophobicContact CG-CD1 4.06Å; K94-L98 HydrophobicContact CG-CG 4.35Å; K94-L98 VanDerWaalsContact O-CG 3.29Å; K94-L98 WeakPolarHBondContact O-CG 3.47Å; K94-L98 PolarHBondContact O-N 3.03Å
95H83.6Confident74.2Confident118 Ų118113.7 Ų113.755%0.54654%0.54SS..Hα-helixtrans-68.2-32.8179.368.4-81.5000113.7N92 L93 A99N92-H95 PolarHBondContact O-CE1 2.92Å; N92-H95 PolarHBondContact O-ND1 3.46Å; L93-H95 PolarHBondContact O-N 3.21Å; H95-A99 VanDerWaalsContact O-CB 3.32Å; H95-A99 WeakPolarHBondContact O-CB 2.98Å; H95-A99 PolarHBondContact O-N 3.37Å; H95-A99 VanDerWaalsContact O-N 3.1Å
96L84.9Confident75.5Confident99 Ų99111.4 Ų111.452%0.51853%0.53SS..Hα-helixtrans-69.7-42.2175-64.7178000110.5L93 A99 E100L93-L96 HydrophobicContact CD2-CD1 3.76Å; L93-L96 WeakPolarHBondContact O-CB 3.33Å; L93-L96 PolarHBondContact O-N 3.37Å; L96-A99 WeakPolarHBondContact O-CB 3.28Å; L96-A99 PolarHBondContact O-N 3.44Å; L96-E100 PolarHBondContact O-N 2.79Å
97Y76.3Confident76.4Confident79 Ų79113.3 Ų113.331%0.3154%0.535SS..Hα-helixtrans-63.2-48.2176.6-95.5-86.7000112.6Y89 L93 K94 A99 E100 E101Y89-Y97 HydrophobicContact CD1-CD2 4.12Å; Y89-Y97 HydrophobicContact CD1-CE1 4.38Å; Y89-Y97 AromaticContact CD1-CE2 3.33Å; Y89-Y97 HydrophobicContact CD1-CE2 3.33Å; Y89-Y97 AromaticContact CD1-CZ 3.52Å; Y89-Y97 HydrophobicContact CD2-CD1 4.08Å; Y89-Y97 HydrophobicContact CD2-CD2 4.13Å; Y89-Y97 AromaticContact CD2-CE1 3.9Å; Y89-Y97 HydrophobicContact CD2-CE1 3.9Å; Y89-Y97 AromaticContact CD2-CE2 3.95Å; Y89-Y97 HydrophobicContact CD2-CE2 3.95Å; Y89-Y97 HydrophobicContact CD2-CG 4.2Å; Y89-Y97 AromaticContact CD2-CZ 3.86Å; Y89-Y97 HydrophobicContact CE1-CE1 4.04Å; Y89-Y97 AromaticContact CE1-CE2 3.61Å; Y89-Y97 HydrophobicContact CE1-CE2 3.61Å; Y89-Y97 AromaticContact CE1-CZ 3.25Å; Y89-Y97 WeakPolarHBondContact CE1-OH 3.39Å; Y89-Y97 HydrophobicContact CE2-CD1 4.04Å; Y89-Y97 AromaticContact CE2-CE1 3.5Å; Y89-Y97 HydrophobicContact CE2-CE1 3.5Å; Y89-Y97 VanDerWaalsContact CE2-CE1 3.5Å; Y89-Y97 HydrophobicContact CE2-CE2 4.18Å; Y89-Y97 AromaticContact CE2-CZ 3.6Å; Y89-Y97 AromaticContact CG-CD2 3.83Å; Y89-Y97 HydrophobicContact CG-CD2 3.83Å; Y89-Y97 HydrophobicContact CG-CE1 4.32Å; Y89-Y97 AromaticContact CG-CE2 3.52Å; Y89-Y97 HydrophobicContact CG-CE2 3.52Å; Y89-Y97 HydrophobicContact CG-CG 4.36Å; Y89-Y97 AromaticContact CG-CZ 3.81Å; Y89-Y97 AromaticContact CZ-CE1 3.56Å; Y89-Y97 AromaticContact CZ-CZ 3.27Å; Y89-Y97 PolarHBondContact OH-OH 2.92Å; L93-Y97 PolarHBondContact O-N 3.33Å; K94-Y97 PolarHBondContact O-N 3.26Å; Y97-A99 PolarHBondContact O-N 3.41Å; Y97-E100 PolarHBondContact O-N 3.06Å; Y97-E100 VanDerWaalsContact O-N 3.13Å; Y97-E101 WeakPolarHBondContact O-CG 3.45Å; Y97-E101 PolarHBondContact O-N 3.44Å
98L84Confident76Confident85 Ų85111 Ų11145%0.44553%0.528SS..Hα-helixtrans-60-37.5175.5-69.3173.9000111.6K94 E102K94-L98 HydrophobicContact CG-CD1 4.06Å; K94-L98 HydrophobicContact CG-CG 4.35Å; K94-L98 VanDerWaalsContact O-CG 3.29Å; K94-L98 WeakPolarHBondContact O-CG 3.47Å; K94-L98 PolarHBondContact O-N 3.03Å; L98-E102 WeakPolarHBondContact O-CB 3.28Å; L98-E102 WeakPolarHBondContact O-CG 3.42Å; L98-E102 PolarHBondContact O-N 2.87Å
99A80.6Confident75.8Confident59 Ų59113.5 Ų113.549%0.48854%0.537SS..Hα-helixtrans-67.7-37.417600000112.8H95 L96 Y97 R103H95-A99 VanDerWaalsContact O-CB 3.32Å; H95-A99 WeakPolarHBondContact O-CB 2.98Å; H95-A99 PolarHBondContact O-N 3.37Å; H95-A99 VanDerWaalsContact O-N 3.1Å; L96-A99 WeakPolarHBondContact O-CB 3.28Å; L96-A99 PolarHBondContact O-N 3.44Å; Y97-A99 PolarHBondContact O-N 3.41Å; A99-R103 WeakPolarHBondContact O-CB 3.47Å; A99-R103 PolarHBondContact O-N 3.28Å
100E77.4Confident75.4Confident93 Ų93117.8 Ų117.844%0.43556%0.558SS.*Hα-helixtrans-69.1-44.5176.2-177.1168.9-157.300112.2L96 Y97 E102 R103 L104L96-E100 PolarHBondContact O-N 2.79Å; Y97-E100 PolarHBondContact O-N 3.06Å; Y97-E100 VanDerWaalsContact O-N 3.13Å; E100-E102 VanDerWaalsContact C-N 3.34Å; E100-E102 PolarHBondContact O-N 3.14Å; E100-R103 WeakPolarHBondContact O-CB 3.45Å; E100-R103 PolarHBondContact O-N 2.99Å; E100-R103 VanDerWaalsContact O-N 3.15Å; E100-L104 HydrophobicContact CG-CD1 4.37Å; E100-L104 WeakPolarHBondContact O-CG 3.46Å; E100-L104 PolarHBondContact O-N 3.4Å
101E80.2Confident73.9Confident112 Ų112119.8 Ų119.852%0.52357%0.569SS.*Hα-helixtrans-59.1-45173.4-74177.6-174.700111.5Y97 R103 L104 R105Y97-E101 WeakPolarHBondContact O-CG 3.45Å; Y97-E101 PolarHBondContact O-N 3.44Å; E101-R103 VanDerWaalsContact C-N 3.32Å; E101-R103 PolarHBondContact O-N 3.31Å; E101-L104 PolarHBondContact O-N 3Å; E101-R105 WeakPolarHBondContact O-CB 3.3Å; E101-R105 VanDerWaalsContact O-CG 3.28Å; E101-R105 WeakPolarHBondContact O-CG 3.27Å; E101-R105 PolarHBondContact O-N 2.95Å
102E80.6Confident72.6Confident108 Ų108119 Ų11951%0.50556%0.564SS.*Hα-helixtrans-60.9-41.1174.4-83.1-164.1-162.700112L98 E100 R105 K106L98-E102 WeakPolarHBondContact O-CB 3.28Å; L98-E102 WeakPolarHBondContact O-CG 3.42Å; L98-E102 PolarHBondContact O-N 2.87Å; E100-E102 VanDerWaalsContact C-N 3.34Å; E100-E102 PolarHBondContact O-N 3.14Å; E102-R105 PolarHBondContact O-N 3.49Å; E102-K106 VanDerWaalsContact O-CB 3.28Å; E102-K106 WeakPolarHBondContact O-CB 3.39Å; E102-K106 WeakPolarHBondContact O-CD 3.27Å; E102-K106 WeakPolarHBondContact O-CG 3.48Å; E102-K106 PolarHBondContact O-N 2.94Å; E102-K106 IonicContact OE2-NZ 2.68Å; E102-K106 PolarHBondContact OE2-NZ 3.44Å
103R75.6Confident70.6Confident137 Ų137121.3 Ų121.352%0.51757%0.571SS.*Hα-helixtrans-61.1-46.9176.8-167.7-173.372.995.32.2110.5A99 E100 E101 K106 Q107A99-R103 WeakPolarHBondContact O-CB 3.47Å; A99-R103 PolarHBondContact O-N 3.28Å; E100-R103 WeakPolarHBondContact O-CB 3.45Å; E100-R103 PolarHBondContact O-N 2.99Å; E100-R103 VanDerWaalsContact O-N 3.15Å; E101-R103 VanDerWaalsContact C-N 3.32Å; E101-R103 PolarHBondContact O-N 3.31Å; R103-K106 CarbonylContact O-C 3.29Å; R103-K106 PolarHBondContact O-N 2.72Å; R103-Q107 WeakPolarHBondContact O-CG 3.29Å; R103-Q107 PolarHBondContact O-N 2.93Å
104L73.3Confident68.4Low102 Ų102125.8 Ų125.853%0.53460%0.595SS.*Hα-helixtrans-66.6-36.4179.3-72.3170.4000112.9E100 E101 Q107E100-L104 HydrophobicContact CG-CD1 4.37Å; E100-L104 WeakPolarHBondContact O-CG 3.46Å; E100-L104 PolarHBondContact O-N 3.4Å; E101-L104 PolarHBondContact O-N 3Å; L104-Q107 PolarHBondContact O-N 3.1Å
105R74.6Confident66.2Low212 Ų212128.1 Ų128.180%0.861%0.612SS**Hα-helixtrans-68.7-34.1174.1-73.8-76179.1168.2-1.2112.7E101 E102E101-R105 WeakPolarHBondContact O-CB 3.3Å; E101-R105 VanDerWaalsContact O-CG 3.28Å; E101-R105 WeakPolarHBondContact O-CG 3.27Å; E101-R105 PolarHBondContact O-N 2.95Å; E102-R105 PolarHBondContact O-N 3.49Å
106K74.2Confident64Low151 Ų151127.8 Ų127.866%0.65762%0.623SS**Hα-helixtrans-82.3-17.2177.3-70.8167.7-179.8164.50113E102 R103 P108E102-K106 VanDerWaalsContact O-CB 3.28Å; E102-K106 WeakPolarHBondContact O-CB 3.39Å; E102-K106 WeakPolarHBondContact O-CD 3.27Å; E102-K106 WeakPolarHBondContact O-CG 3.48Å; E102-K106 PolarHBondContact O-N 2.94Å; E102-K106 IonicContact OE2-NZ 2.68Å; E102-K106 PolarHBondContact OE2-NZ 3.44Å; R103-K106 CarbonylContact O-C 3.29Å; R103-K106 PolarHBondContact O-N 2.72Å; K106-P108 WeakPolarHBondContact O-CD 3.47Å
107Q66.6Low61.5Low98 Ų98131.2 Ų131.246%0.45864%0.636SS.*SBendtrans-62.4123.1166.7-70.2-61.2-9.900107.6R103 L104 R109R103-Q107 WeakPolarHBondContact O-CG 3.29Å; R103-Q107 PolarHBondContact O-N 2.93Å; L104-Q107 PolarHBondContact O-N 3.1Å; Q107-R109 PolarHBondContact O-N 3.16Å
108P56.6Low59.9Low95 Ų95136.2 Ų136.262%0.61766%0.662SS**  trans-59.6126.1170.525.9-31.9000107.4K106 K110K106-P108 WeakPolarHBondContact O-CD 3.47Å; P108-K110 VanDerWaalsContact C-N 3.34Å; P108-K110 PolarHBondContact O-N 3.45Å
109R57.4Low57.5Low220 Ų220137.8 Ų137.883%0.8368%0.675SS**  trans-59102.7168-72.4-175.9176.3-178.3-3.1106.6Q107 V111Q107-R109 PolarHBondContact O-N 3.16Å; R109-V111 VanDerWaalsContact C-N 3.3Å; R109-V111 HydrophobicContact CB-CG2 4.46Å; R109-V111 PolarHBondContact O-N 2.89Å
110K58.8Low55.1Low196 Ų196143.4 Ų143.485%0.85269%0.691SS**  trans-73.294.2169.3-69.4-166.2177.8-1720107.4P108P108-K110 VanDerWaalsContact C-N 3.34Å; P108-K110 PolarHBondContact O-N 3.45Å
111V47.6Very low53.2Low113 Ų113147.8 Ų147.869%0.68571%0.711SS**  trans-88.3111.6155.7177.40000101.6R109R109-V111 VanDerWaalsContact C-N 3.3Å; R109-V111 HydrophobicContact CB-CG2 4.46Å; R109-V111 PolarHBondContact O-N 2.89Å
112D45.9Very low51.4Low121 Ų121147.8 Ų147.865%0.64772%0.721SS**  cis-162.4163.631.6-82.8-36.4000113.1
113H41.6Very low48.8Very low167 Ų167149 Ų14977%0.77373%0.73SS**  trans51.5120.7149.2-62.7-50.8000122.7
114L34Very low46.6Very low163 Ų163149.6 Ų149.685%0.85374%0.743SS**  -172.9114.2112.1-93.3164.2000111.4
115L37.3Very low44.9Very low163 Ų163152.3 Ų152.385%0.85375%0.753SS**  trans8.6119.4151.9-78.6143.7000119.4
116S35.5Very low43.7Very low111 Ų111151.1 Ų151.178%0.77676%0.756SS**  trans-145.7100.2138.2-1630000109
117E34.4Very low41.7Very low171 Ų171151.7 Ų151.780%0.79976%0.761SS**  trans54.9102.7150-74.8168.8152.200120
118Q41.1Very low39.7Very low184 Ų184152.6 Ų152.686%0.8678%0.777SS**  trans-5.9130.4133.2-63.2170.29.900114.8
119V34.6Very low38.7Very low117 Ų117153 Ų15371%0.70978%0.782SS**  -175.9126.2116.4154.40000109
120H30Very low37.6Very low178 Ų178149.7 Ų149.782%0.82478%0.779SS**  trans83.788.4172.9-60.5-49.9000119.7
121Q37.7Very low36.6Very low185 Ų185147 Ų14786%0.86477%0.774SS**  trans-113.4138.5133.5-144.717018.200106.5
122P42.5Very low36.6Very low112 Ų112150.3 Ų150.373%0.72778%0.782SS**  -140.2138.396.935.5-19.1000110
123L26.2Very low36Very low134 Ų134148.6 Ų148.670%0.70279%0.785SS**  125.711666.1173137.8000105.5
124L28.8Very low35.1Very low148 Ų148144.7 Ų144.778%0.77578%0.775SS**  trans-159.993.8131.4-105.3-175.8000107.3
125E37.3Very low35.1Very low159 Ų159146 Ų14674%0.74377%0.774SS**  trans-67.8124.9149.3-64.6173.7163.500106.9
126E48.8Very low35.2Very low188 Ų188145.6 Ų145.688%0.87977%0.768SS**  trans-123.6133.5140.7-78.4-148.1164.900108.3
127Q33.1Very low35.2Very low163 Ų163147.2 Ų147.276%0.76277%0.768SS**  trans-81.7157.4-167.1-59.2-176.50.200112.3
128C25.4Very low35Very low116 Ų116147 Ų14778%0.78477%0.767SS**  21.9140.1129.4-54.80000117.9
129S34.3Very low34.4Very low103 Ų103144 Ų14472%0.7277%0.765SS**  cis-176.9-168.231.7-100.30000106.5
130I35Very low34.7Very low151 Ų151143.6 Ų143.677%0.77477%0.768SS**  trans94107.4164.9-50.9158000111.4
131D38.1Very low34.9Very low141 Ų141144.6 Ų144.675%0.75477%0.77SS**  cis-147.6137.416.2-84.5-39.4000112.4A133D131-A133 VanDerWaalsContact C-N 3.3Å; D131-A133 PolarHBondContact O-N 3.07Å; D131-A133 VanDerWaalsContact O-N 3.14Å
132Q47.3Very low35Very low182 Ų182142.2 Ų142.285%0.8576%0.763SS**  trans-7087.1152.9-177.1167.55.800108.2C134Q132-C134 PolarHBondContact O-N 2.92Å
133A32.2Very low34.7Very low84 Ų84144 Ų14469%0.69477%0.766SS**  trans-85101.715900000108D131 F135D131-A133 VanDerWaalsContact C-N 3.3Å; D131-A133 PolarHBondContact O-N 3.07Å; D131-A133 VanDerWaalsContact O-N 3.14Å; A133-F135 PolarHBondContact O-N 3.06Å
134C23.8Very low35.5Very low85 Ų85143 Ų14357%0.57477%0.768SS**  trans-41.9131.2163.4-55.60000111.5Q132Q132-C134 PolarHBondContact O-N 2.92Å
135F34.9Very low35.6Very low190 Ų190143.6 Ų143.683%0.83377%0.766SS**  trans-12983.1136.5-86.8-78.8000106.9A133 D137A133-F135 PolarHBondContact O-N 3.06Å; F135-D137 PolarHBondContact O-N 3.2Å
136E38.9Very low35.8Very low155 Ų155141.9 Ų141.972%0.72477%0.769SS**  trans-57115.8136.8-69.6-178.914500106.4
137D34.3Very low35.3Very low145 Ų145141.9 Ų141.978%0.77577%0.769SS**  trans-136.699.3141.8-100.8-22.4000106.6F135 C139F135-D137 PolarHBondContact O-N 3.2Å; D137-C139 PolarHBondContact O-N 3.05Å; D137-C139 VanDerWaalsContact O-N 3.08Å
138Q30.3Very low35.9Very low167 Ų167141.9 Ų141.978%0.7877%0.769SS**  trans-58.5102.9156-66.6166.720.700107
139C28.5Very low36.6Very low122 Ų122144.5 Ų144.582%0.82477%0.769SS**  trans-111.782.4153.2-104.20000107D137 F141D137-C139 PolarHBondContact O-N 3.05Å; D137-C139 VanDerWaalsContact O-N 3.08Å; C139-F141 PolarHBondContact O-N 3.37Å
140S42.3Very low36.2Very low108 Ų108145.6 Ų145.676%0.75578%0.776SS**  trans-42.5110.1153.9390000110.2
141F34.1Very low36.7Very low198 Ų198142.4 Ų142.487%0.86877%0.767SS**  trans-126.1113.4161-172.6-99000107.4C139C139-F141 PolarHBondContact O-N 3.37Å
142D39.8Very low36.9Very low136 Ų136144.1 Ų144.173%0.72777%0.768SS**  trans-57.4133-161.4-63.3-60.2000114.3P144D142-P144 WeakPolarHBondContact O-CD 3.37Å
143L35.3Very low37.2Very low149 Ų149142.2 Ų142.278%0.7877%0.768SS**  trans-70.1120.2155.1177.474.3000108.5
144P43.1Very low37.5Very low114 Ų114143.2 Ų143.274%0.7477%0.766SS**  trans-93.4113.1157.911.57.6000108.2D142D142-P144 WeakPolarHBondContact O-CD 3.37Å
145Q29.8Very low39.1Very low159 Ų159146.6 Ų146.674%0.74378%0.778SS**  trans-56.9139.2157.1-71.7-171.7-38.800109.3E147Q145-E147 PolarHBondContact O-N 2.98Å
146P41.9Very low40.1Very low123 Ų123146.3 Ų146.380%0.79977%0.773SS**  trans-75.2109.7166.529.8-29000108.4E148P146-E148 PolarHBondContact O-N 2.95Å
147E38.7Very low40.6Very low189 Ų189148.1 Ų148.188%0.88378%0.779SS**  trans-63.5132.2168.1-66.7-178.8-169.900110.1Q145Q145-E147 PolarHBondContact O-N 2.98Å
148E46.8Very low41.7Very low162 Ų162147.4 Ų147.476%0.75778%0.78SS**  trans-72.4137.7178.6-79.6-168.8-177.500112.4P146P146-E148 PolarHBondContact O-N 2.95Å
149Q39.8Very low43Very low171 Ų171146 Ų14680%0.79978%0.776SS**  trans76.1108.8146.9-62.117153.900119.3
150C24.7Very low44.3Very low126 Ų126145.4 Ų145.485%0.85177%0.771SS**  trans-122.8113.2142.2-175.40000110.1
151S46.1Very low45.3Very low84 Ų84149 Ų14959%0.58777%0.773SS**  trans-35.5141165.558.30000115.8
152K41.8Very low46.9Very low178 Ų178149 Ų14977%0.77477%0.772SS**  156.6106119-84.3156.3-170.8173.80110.5V154K152-V154 HydrophobicContact CB-CG2 4.31Å; K152-V154 PolarHBondContact O-N 3.04Å; K152-V154 VanDerWaalsContact O-N 3.08Å
153T54.1Low48.2Very low141 Ų141150.2 Ų150.287%0.86578%0.779SS**  trans-58.6104.7155.5-46.20000108.2
154V37.8Very low50.1Low106 Ų106152.5 Ų152.564%0.64278%0.783SS**  trans-136.2113.2156.6-161.20000106.4K152 Y156K152-V154 HydrophobicContact CB-CG2 4.31Å; K152-V154 PolarHBondContact O-N 3.04Å; K152-V154 VanDerWaalsContact O-N 3.08Å; V154-Y156 VanDerWaalsContact C-N 3.29Å; V154-Y156 WeakPolarHBondContact O-CD1 3.23Å; V154-Y156 PolarHBondContact O-N 3.23Å
155N59.1Low52Low155 Ų155156.8 Ų156.883%0.82979%0.789SS**  trans-55.892.8169.9-76.8-31000108.9
156Y54.8Low54.6Low185 Ų185154 Ų15473%0.72578%0.775SS**  trans-86.3119.7162.361.3-89.9000106.4V154 T158V154-Y156 VanDerWaalsContact C-N 3.29Å; V154-Y156 WeakPolarHBondContact O-CD1 3.23Å; V154-Y156 PolarHBondContact O-N 3.23Å; Y156-T158 PolarHBondContact O-N 2.86Å; Y156-T158 VanDerWaalsContact O-N 3.07Å
157F50.6Low57Low192 Ų192151.7 Ų151.784%0.84276%0.759SS**  trans-33.4118168.4-70.1-92.3000110.3I159F157-I159 PolarHBondContact O-N 2.82Å
158T57Low59.6Low130 Ų130147.6 Ų147.680%0.79875%0.751SS**  trans-68.779.6176.144.60000108.5Y156 P160Y156-T158 PolarHBondContact O-N 2.86Å; Y156-T158 VanDerWaalsContact O-N 3.07Å; T158-P160 WeakPolarHBondContact O-CD 3.38Å
159I56.9Low61.8Low138 Ų138145 Ų14571%0.70874%0.742SS**  trans-61.2117.1163.1-59.5170000104.5F157 K161F157-I159 PolarHBondContact O-N 2.82Å; I159-K161 PolarHBondContact O-N 3.44Å
160P56.7Low64.4Low110 Ų110141.2 Ų141.271%0.71473%0.725SS**  trans-60.2107.9178.523.7-31.6000107.2T158 K162T158-P160 WeakPolarHBondContact O-CD 3.38Å; P160-K162 PolarHBondContact O-N 2.94Å
161K63.6Low67.7Low184 Ų184140.4 Ų140.480%0.871%0.707SS**  trans-57.4107.9175.2-75.4-177.2177.2174.20106.2I159 N163I159-K161 PolarHBondContact O-N 3.44Å; K161-N163 PolarHBondContact O-N 2.97Å
162K65.7Low70Confident197 Ų197139.1 Ų139.186%0.85770%0.701SS**  trans-53118.9173-60-176-177.9-178.90106.7P160 K164P160-K162 PolarHBondContact O-N 2.94Å; K162-K164 PolarHBondContact O-N 3.15Å
163N68.4Low72.6Confident161 Ų161135.9 Ų135.986%0.86169%0.689SS**  trans-50.8110.2-172.7-60.9-30.6000109.5K161 K165K161-N163 PolarHBondContact O-N 2.97Å; N163-K165 PolarHBondContact O-N 3.03Å
164K75.4Confident74.5Confident198 Ų198132.4 Ų132.486%0.86166%0.662SS**PPolyproline II helixtrans-58.9134.5173.4-67.2-172.6-179.9-176.30107.3K162 K166K162-K164 PolarHBondContact O-N 3.15Å; K164-K166 PolarHBondContact O-N 3.49Å
165K82.4Confident77.3Confident203 Ų203133.3 Ų133.388%0.88366%0.66SS**PPolyproline II helixtrans-56.7127.4179-66179.5-179.11770108.5N163N163-K165 PolarHBondContact O-N 3.03Å
166K85Confident79.1Confident102 Ų102133 Ų13344%0.44365%0.648SS.*PPolyproline II helixtrans-58.5139.8178.4-55.4-172.4-173.2-172.40110.4K164 Q170 K171 E174K164-K166 PolarHBondContact O-N 3.49Å; K166-Q170 HydrophobicContact CB-CB 4.41Å; K166-K171 HydrophobicContact CB-CG 4.02Å; K166-E174 VanDerWaalsContact CD-OE1 3.27Å; K166-E174 WeakPolarHBondContact CD-OE1 3.36Å; K166-E174 WeakPolarHBondContact CD-OE2 3.43Å; K166-E174 WeakPolarHBondContact CE-OE1 3.3Å; K166-E174 IonicContact NZ-OE1 3.74Å; K166-E174 PolarHBondContact NZ-OE1 3.3Å; K166-E174 IonicContact NZ-OE2 2.71Å; K166-E174 PolarHBondContact NZ-OE2 3.32Å
167T91.6Very high81.1Confident74 Ų74130.2 Ų130.245%0.45464%0.642SS.*PPolyproline II helixtrans-69.8158.4175.380.20000110N169 Q170 K171T167-N169 VanDerWaalsContact C-N 3.27Å; T167-N169 PolarHBondContact O-N 3.29Å; T167-Q170 PolarHBondContact O-N 3.06Å; T167-Q170 WeakPolarHBondContact OG1-CG 3.38Å; T167-Q170 PolarHBondContact OG1-N 2.91Å; T167-K171 WeakPolarHBondContact O-CG 3.45Å; T167-K171 PolarHBondContact O-N 3.22Å
168S93.3Very high83.2Confident103 Ų103126 Ų12672%0.7262%0.624SS**Hα-helixtrans-55.8-42.8177.9-177.10000112.2Q170 K171 A172S168-Q170 PolarHBondContact O-N 3.37Å; S168-K171 WeakPolarHBondContact O-CB 3.26Å; S168-K171 PolarHBondContact O-N 2.97Å; S168-A172 PolarHBondContact O-N 2.92Å
169N93.3Very high85.1Confident108 Ų108122.6 Ų122.658%0.57860%0.603SS**Hα-helixtrans-63.5-42.1179.3-169.5-68000111.9T167 K171 A172 Q173T167-N169 VanDerWaalsContact C-N 3.27Å; T167-N169 PolarHBondContact O-N 3.29Å; N169-K171 VanDerWaalsContact C-N 3.33Å; N169-K171 PolarHBondContact O-N 3.38Å; N169-A172 WeakPolarHBondContact O-CB 3.43Å; N169-A172 PolarHBondContact O-N 2.94Å; N169-Q173 PolarHBondContact O-N 3.4Å; N169-Q173 VanDerWaalsContact O-N 3.11Å
170Q93.9Very high86.9Confident91 Ų91120.8 Ų120.843%0.42559%0.592SS.*Hα-helixtrans-61.5-40174.5-71.5170-11.600112.1K166 T167 S168 Q173 E174K166-Q170 HydrophobicContact CB-CB 4.41Å; T167-Q170 PolarHBondContact O-N 3.06Å; T167-Q170 WeakPolarHBondContact OG1-CG 3.38Å; T167-Q170 PolarHBondContact OG1-N 2.91Å; S168-Q170 PolarHBondContact O-N 3.37Å; Q170-Q173 PolarHBondContact O-N 3.39Å; Q170-E174 WeakPolarHBondContact O-CG 3.43Å; Q170-E174 PolarHBondContact O-N 2.9Å; Q170-E174 VanDerWaalsContact O-N 3.13Å
171K94.3Very high88.8Confident109 Ų109118.5 Ų118.547%0.47458%0.582SS.*Hα-helixtrans-64.3-40.2175.5-67.5178.1-178.8-177.50112K166 T167 S168 N169 Q173 E174 E175K166-K171 HydrophobicContact CB-CG 4.02Å; T167-K171 WeakPolarHBondContact O-CG 3.45Å; T167-K171 PolarHBondContact O-N 3.22Å; S168-K171 WeakPolarHBondContact O-CB 3.26Å; S168-K171 PolarHBondContact O-N 2.97Å; N169-K171 VanDerWaalsContact C-N 3.33Å; N169-K171 PolarHBondContact O-N 3.38Å; K171-Q173 VanDerWaalsContact C-N 3.33Å; K171-Q173 PolarHBondContact O-N 2.87Å; K171-E174 PolarHBondContact O-N 2.88Å; K171-E175 WeakPolarHBondContact O-CG 3.27Å; K171-E175 PolarHBondContact O-N 3.11Å
172A94.6Very high90.3Very high56 Ų56115.9 Ų115.946%0.46357%0.571SS.*Hα-helixtrans-63.4-38.217800000112.4S168 N169 Y176S168-A172 PolarHBondContact O-N 2.92Å; N169-A172 WeakPolarHBondContact O-CB 3.43Å; N169-A172 PolarHBondContact O-N 2.94Å; A172-Y176 WeakPolarHBondContact O-CB 3.38Å; A172-Y176 PolarHBondContact O-N 2.89Å
173Q95.4Very high91.6Very high111 Ų111114.8 Ų114.852%0.51956%0.561SS.*Hα-helixtrans-63.7-47.7174.1-69.9176.3-16.400111.5N169 Q170 K171 E175 Y176 E177N169-Q173 PolarHBondContact O-N 3.4Å; N169-Q173 VanDerWaalsContact O-N 3.11Å; Q170-Q173 PolarHBondContact O-N 3.39Å; K171-Q173 VanDerWaalsContact C-N 3.33Å; K171-Q173 PolarHBondContact O-N 2.87Å; Q173-E175 VanDerWaalsContact C-N 3.33Å; Q173-E175 PolarHBondContact O-N 3.38Å; Q173-Y176 WeakPolarHBondContact O-CB 3.38Å; Q173-Y176 PolarHBondContact O-N 3.43Å; Q173-Y176 VanDerWaalsContact O-N 3.16Å; Q173-E177 WeakPolarHBondContact O-CG 3.42Å; Q173-E177 PolarHBondContact O-N 2.79Å
174E95.3Very high92.8Very high67 Ų67109.3 Ų109.331%0.31354%0.539SS..Hα-helixtrans-61.2-41.2177.4-70.6175.7-176.300112.3K166 Q170 K171 Y176 E177 Q178K166-E174 VanDerWaalsContact CD-OE1 3.27Å; K166-E174 WeakPolarHBondContact CD-OE1 3.36Å; K166-E174 WeakPolarHBondContact CD-OE2 3.43Å; K166-E174 WeakPolarHBondContact CE-OE1 3.3Å; K166-E174 IonicContact NZ-OE1 3.74Å; K166-E174 PolarHBondContact NZ-OE1 3.3Å; K166-E174 IonicContact NZ-OE2 2.71Å; K166-E174 PolarHBondContact NZ-OE2 3.32Å; Q170-E174 WeakPolarHBondContact O-CG 3.43Å; Q170-E174 PolarHBondContact O-N 2.9Å; Q170-E174 VanDerWaalsContact O-N 3.13Å; K171-E174 PolarHBondContact O-N 2.88Å; E174-Y176 VanDerWaalsContact C-N 3.34Å; E174-E177 PolarHBondContact O-N 3.06Å; E174-Q178 WeakPolarHBondContact O-CB 3.46Å; E174-Q178 VanDerWaalsContact O-CG 3.25Å; E174-Q178 WeakPolarHBondContact O-CG 3.3Å; E174-Q178 PolarHBondContact O-N 3.09Å
175E96Very high93.8Very high125 Ų125102.5 Ų102.558%0.58452%0.519SS*.Hα-helixtrans-64.7-39.3175.8-75.3-178.1-172.600111.9K171 Q173 Q178 V179K171-E175 WeakPolarHBondContact O-CG 3.27Å; K171-E175 PolarHBondContact O-N 3.11Å; Q173-E175 VanDerWaalsContact C-N 3.33Å; Q173-E175 PolarHBondContact O-N 3.38Å; E175-Q178 PolarHBondContact O-N 2.91Å; E175-V179 WeakPolarHBondContact O-CB 3.48Å; E175-V179 VanDerWaalsContact O-CG2 3.26Å; E175-V179 WeakPolarHBondContact O-CG2 3.44Å; E175-V179 PolarHBondContact O-N 3.02Å
176Y96.6Very high94.4Very high148 Ų148100 Ų10058%0.5851%0.508SS*.Hα-helixtrans-61.8-45.8175.9178.9-102.4000111.7A172 Q173 E174 V179 Q180A172-Y176 WeakPolarHBondContact O-CB 3.38Å; A172-Y176 PolarHBondContact O-N 2.89Å; Q173-Y176 WeakPolarHBondContact O-CB 3.38Å; Q173-Y176 PolarHBondContact O-N 3.43Å; Q173-Y176 VanDerWaalsContact O-N 3.16Å; E174-Y176 VanDerWaalsContact C-N 3.34Å; Y176-V179 PolarHBondContact O-N 3.23Å; Y176-Q180 HydrophobicContact CD1-CG 4.44Å; Y176-Q180 HydrophobicContact CE1-CG 4.1Å; Y176-Q180 WeakPolarHBondContact O-CG 3.28Å; Y176-Q180 PolarHBondContact O-N 3.5Å; Y176-Q180 PolarHBondContact OH-NE2 3.44Å
177E96.6Very high94.8Very high128 Ų128101.6 Ų101.660%0.59852%0.516SS*.Hα-helixtrans-62.6-42.6175.4-70.8174.9-17300111.8Q173 E174 V179 Q180 A181Q173-E177 WeakPolarHBondContact O-CG 3.42Å; Q173-E177 PolarHBondContact O-N 2.79Å; E174-E177 PolarHBondContact O-N 3.06Å; E177-V179 VanDerWaalsContact C-N 3.31Å; E177-V179 PolarHBondContact O-N 3.26Å; E177-Q180 WeakPolarHBondContact O-CB 3.46Å; E177-Q180 PolarHBondContact O-N 3.17Å; E177-A181 WeakPolarHBondContact O-CB 3.37Å; E177-A181 PolarHBondContact O-N 2.89Å
178Q95.9Very high94.8Very high102 Ų102104 Ų10448%0.47752%0.522SS..Hα-helixtrans-61.6-39.8174.7-74.5178.93600112.2E174 E175 A181 K182E174-Q178 WeakPolarHBondContact O-CB 3.46Å; E174-Q178 VanDerWaalsContact O-CG 3.25Å; E174-Q178 WeakPolarHBondContact O-CG 3.3Å; E174-Q178 PolarHBondContact O-N 3.09Å; E175-Q178 PolarHBondContact O-N 2.91Å; Q178-A181 PolarHBondContact O-N 2.94Å; Q178-K182 WeakPolarHBondContact O-CB 3.34Å; Q178-K182 VanDerWaalsContact O-CG 3.23Å; Q178-K182 WeakPolarHBondContact O-CG 3.46Å; Q178-K182 PolarHBondContact O-N 2.91Å
179V96.5Very high94.9Very high59 Ų59105.3 Ų105.336%0.35852%0.516SS..Hα-helixtrans-66.8-40.7176.3169.60000110.7E175 Y176 E177 K182 R183E175-V179 WeakPolarHBondContact O-CB 3.48Å; E175-V179 VanDerWaalsContact O-CG2 3.26Å; E175-V179 WeakPolarHBondContact O-CG2 3.44Å; E175-V179 PolarHBondContact O-N 3.02Å; Y176-V179 PolarHBondContact O-N 3.23Å; E177-V179 VanDerWaalsContact C-N 3.31Å; E177-V179 PolarHBondContact O-N 3.26Å; V179-K182 PolarHBondContact O-N 3.24Å; V179-R183 VanDerWaalsContact O-CG 3.27Å; V179-R183 WeakPolarHBondContact O-CG 3.37Å; V179-R183 PolarHBondContact O-N 2.84Å
180Q95Very high94.9Very high101 Ų101106.3 Ų106.347%0.47252%0.516SS..Hα-helixtrans-60.3-50.2173.3-76-136.726.500111.7Y176 E177 K182 R183 A184Y176-Q180 HydrophobicContact CD1-CG 4.44Å; Y176-Q180 HydrophobicContact CE1-CG 4.1Å; Y176-Q180 WeakPolarHBondContact O-CG 3.28Å; Y176-Q180 PolarHBondContact O-N 3.5Å; Y176-Q180 PolarHBondContact OH-NE2 3.44Å; E177-Q180 WeakPolarHBondContact O-CB 3.46Å; E177-Q180 PolarHBondContact O-N 3.17Å; Q180-K182 VanDerWaalsContact C-N 3.33Å; Q180-K182 PolarHBondContact O-N 2.94Å; Q180-R183 WeakPolarHBondContact O-CB 3.48Å; Q180-R183 PolarHBondContact O-N 2.89Å; Q180-R183 VanDerWaalsContact O-N 3.08Å; Q180-A184 PolarHBondContact O-N 3.39Å
181A96.6Very high94.9Very high62 Ų62106.2 Ų106.251%0.51252%0.515SS..Hα-helixtrans-58.8-44.4178.700000111.7E177 Q178 R183 A184 A185E177-A181 WeakPolarHBondContact O-CB 3.37Å; E177-A181 PolarHBondContact O-N 2.89Å; Q178-A181 PolarHBondContact O-N 2.94Å; A181-R183 VanDerWaalsContact C-N 3.33Å; A181-R183 PolarHBondContact O-N 3.29Å; A181-A184 PolarHBondContact O-N 3.31Å; A181-A185 WeakPolarHBondContact O-CB 3.46Å; A181-A185 PolarHBondContact O-N 3.45Å
182K95.5Very high95Very high128 Ų128108.9 Ų108.956%0.55752%0.522SS*.Hα-helixtrans-61.4-38.8175.2-75.2170.3-177.6169.90112.4Q178 V179 Q180 K186Q178-K182 WeakPolarHBondContact O-CB 3.34Å; Q178-K182 VanDerWaalsContact O-CG 3.23Å; Q178-K182 WeakPolarHBondContact O-CG 3.46Å; Q178-K182 PolarHBondContact O-N 2.91Å; V179-K182 PolarHBondContact O-N 3.24Å; Q180-K182 VanDerWaalsContact C-N 3.33Å; Q180-K182 PolarHBondContact O-N 2.94Å; K182-K186 WeakPolarHBondContact O-CB 3.36Å; K182-K186 VanDerWaalsContact O-CG 3.29Å; K182-K186 WeakPolarHBondContact O-CG 3.14Å; K182-K186 PolarHBondContact O-N 3.43Å; K182-K186 VanDerWaalsContact O-N 3.1Å
183R91.4Very high95Very high174 Ų174113.5 Ų113.566%0.65753%0.528SS*.Hα-helixtrans-68.3-42.4176.2-72.9172.1-176.8-178.33.8111.5V179 Q180 A181 K186 K187V179-R183 VanDerWaalsContact O-CG 3.27Å; V179-R183 WeakPolarHBondContact O-CG 3.37Å; V179-R183 PolarHBondContact O-N 2.84Å; Q180-R183 WeakPolarHBondContact O-CB 3.48Å; Q180-R183 PolarHBondContact O-N 2.89Å; Q180-R183 VanDerWaalsContact O-N 3.08Å; A181-R183 VanDerWaalsContact C-N 3.33Å; A181-R183 PolarHBondContact O-N 3.29Å; R183-K186 PolarHBondContact O-N 3.43Å; R183-K187 WeakPolarHBondContact O-CB 3.43Å; R183-K187 PolarHBondContact O-N 2.84Å
184A95.3Very high95.1Very high47 Ų47113.4 Ų113.439%0.38853%0.526SS..Hα-helixtrans-63.3-46.4176.900000111.6Q180 A181 K186 K187 Q188Q180-A184 PolarHBondContact O-N 3.39Å; A181-A184 PolarHBondContact O-N 3.31Å; A184-K186 PolarHBondContact O-N 3.37Å; A184-K187 WeakPolarHBondContact O-CB 3.41Å; A184-K187 PolarHBondContact O-N 2.84Å; A184-K187 VanDerWaalsContact O-N 3.14Å; A184-Q188 WeakPolarHBondContact O-CG 3.37Å; A184-Q188 PolarHBondContact O-N 3.31Å
185A95.5Very high95.1Very high55 Ų55114.6 Ų114.646%0.45553%0.531SS..Hα-helixtrans-58.8-46.417600000111.8A181 K187 Q188 E189A181-A185 WeakPolarHBondContact O-CB 3.46Å; A181-A185 PolarHBondContact O-N 3.45Å; A185-K187 VanDerWaalsContact C-N 3.3Å; A185-K187 PolarHBondContact O-N 3.29Å; A185-Q188 PolarHBondContact O-N 2.99Å; A185-E189 WeakPolarHBondContact O-CB 3.48Å; A185-E189 PolarHBondContact O-N 3.14Å
186K94.1Very high95.1Very high149 Ų149114.4 Ų114.465%0.64853%0.53SS*.Hα-helixtrans-61.3-36.9175.4-76179.3179.5-174.30113K182 R183 A184 F190K182-K186 WeakPolarHBondContact O-CB 3.36Å; K182-K186 VanDerWaalsContact O-CG 3.29Å; K182-K186 WeakPolarHBondContact O-CG 3.14Å; K182-K186 PolarHBondContact O-N 3.43Å; K182-K186 VanDerWaalsContact O-N 3.1Å; R183-K186 PolarHBondContact O-N 3.43Å; A184-K186 PolarHBondContact O-N 3.37Å; K186-F190 WeakPolarHBondContact O-CB 3.4Å; K186-F190 PolarHBondContact O-N 3.11Å
187K94.2Very high94.9Very high137 Ų137113.2 Ų113.260%0.59653%0.525SS*.Hα-helixtrans-66.1-47.5177-175-177.8175.1-171.40110.9R183 A184 A185 F190 E191R183-K187 WeakPolarHBondContact O-CB 3.43Å; R183-K187 PolarHBondContact O-N 2.84Å; A184-K187 WeakPolarHBondContact O-CB 3.41Å; A184-K187 PolarHBondContact O-N 2.84Å; A184-K187 VanDerWaalsContact O-N 3.14Å; A185-K187 VanDerWaalsContact C-N 3.3Å; A185-K187 PolarHBondContact O-N 3.29Å; K187-F190 PolarHBondContact O-N 3.46Å; K187-E191 VanDerWaalsContact CE-OE1 3.27Å; K187-E191 WeakPolarHBondContact CE-OE1 3.46Å; K187-E191 WeakPolarHBondContact O-CG 3.27Å; K187-E191 PolarHBondContact O-N 3.47Å
188Q92Very high94.9Very high124 Ų124111 Ų11158%0.57952%0.515SS*.Hα-helixtrans-62.9-43.8177.9-70.2178.8-4.200111.8A184 A185 F190 E191 R192A184-Q188 WeakPolarHBondContact O-CG 3.37Å; A184-Q188 PolarHBondContact O-N 3.31Å; A185-Q188 PolarHBondContact O-N 2.99Å; Q188-F190 VanDerWaalsContact C-N 3.31Å; Q188-F190 PolarHBondContact O-N 3.39Å; Q188-E191 PolarHBondContact O-N 3.45Å; Q188-R192 WeakPolarHBondContact O-CG 3.43Å; Q188-R192 PolarHBondContact O-N 2.8Å
189E94.5Very high95Very high130 Ų130111.2 Ų111.261%0.60752%0.515SS*.Hα-helixtrans-59.9-41.9176.1-170.5-170.6165.200111.6A185 E191 R192 R193A185-E189 WeakPolarHBondContact O-CB 3.48Å; A185-E189 PolarHBondContact O-N 3.14Å; E189-E191 PolarHBondContact O-N 2.87Å; E189-R192 PolarHBondContact O-N 2.88Å; E189-R193 WeakPolarHBondContact O-CB 3.48Å; E189-R193 PolarHBondContact O-N 3.12Å
190F93.9Very high95Very high129 Ų129111 Ų11157%0.56652%0.52SS*.Hα-helixtrans-63.4-41.8176.3-178.8-94.2000112.5K186 K187 Q188 R193 K194K186-F190 WeakPolarHBondContact O-CB 3.4Å; K186-F190 PolarHBondContact O-N 3.11Å; K187-F190 PolarHBondContact O-N 3.46Å; Q188-F190 VanDerWaalsContact C-N 3.31Å; Q188-F190 PolarHBondContact O-N 3.39Å; F190-R193 PolarHBondContact O-N 3.33Å; F190-K194 WeakPolarHBondContact O-CB 3.41Å; F190-K194 PolarHBondContact O-N 3.37Å
191E94.2Very high95.1Very high90 Ų90111.8 Ų111.842%0.42152%0.523SS..Hα-helixtrans-63.3-44.1176.3-73.8170.9-17300111.5K187 Q188 E189 K194 Q195K187-E191 VanDerWaalsContact CE-OE1 3.27Å; K187-E191 WeakPolarHBondContact CE-OE1 3.46Å; K187-E191 WeakPolarHBondContact O-CG 3.27Å; K187-E191 PolarHBondContact O-N 3.47Å; Q188-E191 PolarHBondContact O-N 3.45Å; E189-E191 PolarHBondContact O-N 2.87Å; E191-K194 WeakPolarHBondContact O-CB 3.43Å; E191-K194 PolarHBondContact O-N 3.33Å; E191-K194 VanDerWaalsContact O-N 3.15Å; E191-Q195 WeakPolarHBondContact O-CG 3.49Å; E191-Q195 PolarHBondContact O-N 3.46Å
192R96.2Very high95.2Very high165 Ų165116.5 Ų116.562%0.62353%0.528SS*.Hα-helixtrans-58.4-50.8173.6-69.4-67.9-173.8170.72.2111.6Q188 E189 K194 Q195 E196Q188-R192 WeakPolarHBondContact O-CG 3.43Å; Q188-R192 PolarHBondContact O-N 2.8Å; E189-R192 PolarHBondContact O-N 2.88Å; R192-K194 PolarHBondContact O-N 2.85Å; R192-K194 VanDerWaalsContact O-N 3.17Å; R192-Q195 WeakPolarHBondContact O-CB 3.31Å; R192-Q195 PolarHBondContact O-N 2.89Å; R192-Q195 VanDerWaalsContact O-N 3.09Å; R192-E196 WeakPolarHBondContact O-CG 3.47Å; R192-E196 PolarHBondContact O-N 3.48Å
193R95.3Very high95.3Very high153 Ų153115.8 Ų115.858%0.57753%0.527SS*.Hα-helixtrans-62-26.9177.4-166.1-178.8-178.6122.42.4112.9E189 F190 R197E189-R193 WeakPolarHBondContact O-CB 3.48Å; E189-R193 PolarHBondContact O-N 3.12Å; F190-R193 PolarHBondContact O-N 3.33Å; R193-R197 WeakPolarHBondContact O-CG 3.37Å; R193-R197 PolarHBondContact O-N 3.33Å; R193-R197 PolarHBondContact O-NE 3.03Å
194K96.7Very high95.6Very high108 Ų108114.8 Ų114.847%0.4752%0.524SS..Hα-helixtrans-73-48.1174.1-175.7-175.8173.1-169.30110.3F190 E191 R192 E196 R197 E198F190-K194 WeakPolarHBondContact O-CB 3.41Å; F190-K194 PolarHBondContact O-N 3.37Å; E191-K194 WeakPolarHBondContact O-CB 3.43Å; E191-K194 PolarHBondContact O-N 3.33Å; E191-K194 VanDerWaalsContact O-N 3.15Å; R192-K194 PolarHBondContact O-N 2.85Å; R192-K194 VanDerWaalsContact O-N 3.17Å; K194-E196 PolarHBondContact O-N 2.89Å; K194-R197 PolarHBondContact O-N 3.07Å; K194-E198 WeakPolarHBondContact CE-OE1 3.31Å; K194-E198 WeakPolarHBondContact O-CG 3.31Å; K194-E198 PolarHBondContact O-N 3.19Å
195Q94.3Very high95.7Very high93 Ų93118.6 Ų118.644%0.43553%0.532SS..Hα-helixtrans-58.1-48.2176.1-70.7173.4-10.600111.4E191 R192 R197 E198 E199E191-Q195 WeakPolarHBondContact O-CG 3.49Å; E191-Q195 PolarHBondContact O-N 3.46Å; R192-Q195 WeakPolarHBondContact O-CB 3.31Å; R192-Q195 PolarHBondContact O-N 2.89Å; R192-Q195 VanDerWaalsContact O-N 3.09Å; Q195-R197 VanDerWaalsContact C-N 3.28Å; Q195-R197 PolarHBondContact O-N 3.3Å; Q195-E198 PolarHBondContact O-N 3.08Å; Q195-E199 WeakPolarHBondContact O-CB 3.46Å; Q195-E199 WeakPolarHBondContact O-CG 3.3Å; Q195-E199 PolarHBondContact O-N 3.33Å
196E95.9Very high95.8Very high121 Ų121122.6 Ų122.657%0.56554%0.539SS*.Hα-helixtrans-55.6-42.2176.8-72.4169.1-173.300112.4R192 K194 A200R192-E196 WeakPolarHBondContact O-CG 3.47Å; R192-E196 PolarHBondContact O-N 3.48Å; K194-E196 PolarHBondContact O-N 2.89Å; E196-A200 WeakPolarHBondContact O-CB 3.44Å; E196-A200 PolarHBondContact O-N 3.28Å
197R93.7Very high95.9Very high123 Ų123122 Ų12246%0.46454%0.536SS..Hα-helixtrans-65.4-42.9176.7-81.4-179.8-81.9164.5-6.6111.9R193 K194 Q195 Q201R193-R197 WeakPolarHBondContact O-CG 3.37Å; R193-R197 PolarHBondContact O-N 3.33Å; R193-R197 PolarHBondContact O-NE 3.03Å; K194-R197 PolarHBondContact O-N 3.07Å; Q195-R197 VanDerWaalsContact C-N 3.28Å; Q195-R197 PolarHBondContact O-N 3.3Å; R197-Q201 VanDerWaalsContact O-CG 3.31Å; R197-Q201 WeakPolarHBondContact O-CG 3.22Å; R197-Q201 PolarHBondContact O-N 2.91Å
198E96.6Very high96.1Very high82 Ų82121.5 Ų121.538%0.38353%0.534SS..Hα-helixtrans-66.4-42.7177.8-71.6178.9-167.300111.5K194 Q195 Q201 R202K194-E198 WeakPolarHBondContact CE-OE1 3.31Å; K194-E198 WeakPolarHBondContact O-CG 3.31Å; K194-E198 PolarHBondContact O-N 3.19Å; Q195-E198 PolarHBondContact O-N 3.08Å; E198-Q201 PolarHBondContact O-N 2.9Å; E198-R202 WeakPolarHBondContact O-CB 3.32Å; E198-R202 VanDerWaalsContact O-CG 3.3Å; E198-R202 WeakPolarHBondContact O-CG 3.26Å; E198-R202 PolarHBondContact O-N 2.85Å
199E97.4Very high96.3Very high105 Ų105120.5 Ų120.549%0.49153%0.531SS..Hα-helixtrans-63.2-46.1175.6-73.2178.4-17700111.5Q195 Q201 R202 Q203Q195-E199 WeakPolarHBondContact O-CB 3.46Å; Q195-E199 WeakPolarHBondContact O-CG 3.3Å; Q195-E199 PolarHBondContact O-N 3.33Å; E199-Q201 VanDerWaalsContact C-N 3.31Å; E199-Q201 PolarHBondContact O-N 3.36Å; E199-R202 WeakPolarHBondContact O-CB 3.38Å; E199-R202 PolarHBondContact O-N 2.93Å; E199-R202 VanDerWaalsContact O-N 3.12Å; E199-Q203 WeakPolarHBondContact O-CB 3.44Å; E199-Q203 VanDerWaalsContact O-CG 3.31Å; E199-Q203 WeakPolarHBondContact O-CG 3.3Å; E199-Q203 PolarHBondContact O-N 2.89Å
200A97.4Very high96.3Very high54 Ų54119.5 Ų119.545%0.44653%0.526SS..Hα-helixtrans-58.8-42.3175.300000111.7E196 Q203 Y204E196-A200 WeakPolarHBondContact O-CB 3.44Å; E196-A200 PolarHBondContact O-N 3.28Å; A200-Q203 PolarHBondContact O-N 2.98Å; A200-Y204 WeakPolarHBondContact O-CB 3.48Å; A200-Y204 PolarHBondContact O-N 2.71Å
201Q97.1Very high96.4Very high118 Ų118115.2 Ų115.255%0.55151%0.51SS*.Hα-helixtrans-64.9-42.2174.6-74.2-179.520.800112.3R197 E198 E199 Y204 K205R197-Q201 VanDerWaalsContact O-CG 3.31Å; R197-Q201 WeakPolarHBondContact O-CG 3.22Å; R197-Q201 PolarHBondContact O-N 2.91Å; E198-Q201 PolarHBondContact O-N 2.9Å; E199-Q201 VanDerWaalsContact C-N 3.31Å; E199-Q201 PolarHBondContact O-N 3.36Å; Q201-Y204 PolarHBondContact O-N 3.26Å; Q201-K205 WeakPolarHBondContact O-CB 3.22Å; Q201-K205 VanDerWaalsContact O-CG 3.3Å; Q201-K205 WeakPolarHBondContact O-CG 3.35Å; Q201-K205 PolarHBondContact O-N 3.33Å
202R98Very high96.5Very high162 Ų162116.7 Ų116.761%0.61152%0.516SS*.Hα-helixtrans-61.8-46.5176.4-75.3175.1-179-172.11.7110.8E198 E199 K205 K206E198-R202 WeakPolarHBondContact O-CB 3.32Å; E198-R202 VanDerWaalsContact O-CG 3.3Å; E198-R202 WeakPolarHBondContact O-CG 3.26Å; E198-R202 PolarHBondContact O-N 2.85Å; E199-R202 WeakPolarHBondContact O-CB 3.38Å; E199-R202 PolarHBondContact O-N 2.93Å; E199-R202 VanDerWaalsContact O-N 3.12Å; R202-K205 PolarHBondContact O-N 3.43Å; R202-K206 WeakPolarHBondContact O-CB 3.07Å; R202-K206 VanDerWaalsContact O-CG 3.31Å; R202-K206 WeakPolarHBondContact O-CG 3.47Å; R202-K206 PolarHBondContact O-N 3.44Å
203Q97.3Very high96.5Very high113 Ų113115.4 Ų115.453%0.52851%0.514SS..Hα-helixtrans-61.6-46.3177.2-72179.22.600111.4E199 A200 K205 K206 K207E199-Q203 WeakPolarHBondContact O-CB 3.44Å; E199-Q203 VanDerWaalsContact O-CG 3.31Å; E199-Q203 WeakPolarHBondContact O-CG 3.3Å; E199-Q203 PolarHBondContact O-N 2.89Å; A200-Q203 PolarHBondContact O-N 2.98Å; Q203-K205 VanDerWaalsContact C-N 3.35Å; Q203-K205 PolarHBondContact O-N 3.41Å; Q203-K206 PolarHBondContact O-N 3.42Å; Q203-K207 WeakPolarHBondContact O-CB 3.11Å; Q203-K207 WeakPolarHBondContact O-CG 3.28Å; Q203-K207 PolarHBondContact O-N 2.93Å
204Y97.6Very high96.5Very high152 Ų152110.4 Ų110.460%0.59650%0.499SS*.Hα-helixtrans-57.8-47.1175.6173.1-98000111.7A200 Q201 K207 K208A200-Y204 WeakPolarHBondContact O-CB 3.48Å; A200-Y204 PolarHBondContact O-N 2.71Å; Q201-Y204 PolarHBondContact O-N 3.26Å; Y204-K207 PolarHBondContact O-N 3.42Å; Y204-K208 HydrophobicContact CE1-CD 4.12Å; Y204-K208 WeakPolarHBondContact O-CB 3.4Å; Y204-K208 PolarHBondContact O-N 2.97Å
205K97.7Very high96.3Very high128 Ų128108.4 Ų108.456%0.55749%0.493SS*.Hα-helixtrans-62.2-44.6177.5-73.9175.9-178.7-179.80111.6Q201 R202 Q203 K208 M209Q201-K205 WeakPolarHBondContact O-CB 3.22Å; Q201-K205 VanDerWaalsContact O-CG 3.3Å; Q201-K205 WeakPolarHBondContact O-CG 3.35Å; Q201-K205 PolarHBondContact O-N 3.33Å; R202-K205 PolarHBondContact O-N 3.43Å; Q203-K205 VanDerWaalsContact C-N 3.35Å; Q203-K205 PolarHBondContact O-N 3.41Å; K205-K208 PolarHBondContact O-N 3.15Å; K205-M209 WeakPolarHBondContact O-CB 3.38Å; K205-M209 VanDerWaalsContact O-CG 3.26Å; K205-M209 WeakPolarHBondContact O-CG 3.25Å; K205-M209 PolarHBondContact O-N 2.88Å
206K97.4Very high96.2Very high139 Ų139107.5 Ų107.560%0.60449%0.491SS*.Hα-helixtrans-58-54.7176.4-75.5179178.2-1710111.1R202 Q203 K208 M209 E210R202-K206 WeakPolarHBondContact O-CB 3.07Å; R202-K206 VanDerWaalsContact O-CG 3.31Å; R202-K206 WeakPolarHBondContact O-CG 3.47Å; R202-K206 PolarHBondContact O-N 3.44Å; Q203-K206 PolarHBondContact O-N 3.42Å; K206-K208 VanDerWaalsContact C-N 3.31Å; K206-K208 PolarHBondContact O-N 3.45Å; K206-M209 PolarHBondContact O-N 2.93Å; K206-M209 VanDerWaalsContact O-N 3.08Å; K206-E210 WeakPolarHBondContact O-CG 3.39Å; K206-E210 PolarHBondContact O-N 2.9Å
207K96.6Very high96.2Very high137 Ų137106.8 Ų106.860%0.59649%0.486SS*.Hα-helixtrans-56.5-44.7176.9-71.5-176.8176.5-172.30111.8Q203 Y204 M209 E210 V211Q203-K207 WeakPolarHBondContact O-CB 3.11Å; Q203-K207 WeakPolarHBondContact O-CG 3.28Å; Q203-K207 PolarHBondContact O-N 2.93Å; Y204-K207 PolarHBondContact O-N 3.42Å; K207-M209 VanDerWaalsContact C-N 3.34Å; K207-M209 PolarHBondContact O-N 2.88Å; K207-E210 PolarHBondContact O-N 2.95Å; K207-V211 WeakPolarHBondContact O-CB 3.08Å; K207-V211 VanDerWaalsContact O-CG2 3.28Å; K207-V211 WeakPolarHBondContact O-CG2 3.05Å; K207-V211 PolarHBondContact O-N 2.83Å
208K97.7Very high96.3Very high126 Ų126109.2 Ų109.255%0.54850%0.495SS..Hα-helixtrans-59-44.8176.7-175.9-179.7-179.6-179.80111.6Y204 K205 K206 F212Y204-K208 HydrophobicContact CE1-CD 4.12Å; Y204-K208 WeakPolarHBondContact O-CB 3.4Å; Y204-K208 PolarHBondContact O-N 2.97Å; K205-K208 PolarHBondContact O-N 3.15Å; K206-K208 VanDerWaalsContact C-N 3.31Å; K206-K208 PolarHBondContact O-N 3.45Å; K208-F212 VanDerWaalsContact O-CB 3.22Å; K208-F212 WeakPolarHBondContact O-CB 3.45Å; K208-F212 PolarHBondContact O-N 3.04Å
209M96.8Very high96.1Very high102 Ų102107.9 Ų107.950%0.50249%0.493SS..Hα-helixtrans-67.9-38.9178.5-70.1-55.4-62.800112.3K205 K206 K207 F212 K213K205-M209 WeakPolarHBondContact O-CB 3.38Å; K205-M209 VanDerWaalsContact O-CG 3.26Å; K205-M209 WeakPolarHBondContact O-CG 3.25Å; K205-M209 PolarHBondContact O-N 2.88Å; K206-M209 PolarHBondContact O-N 2.93Å; K206-M209 VanDerWaalsContact O-N 3.08Å; K207-M209 VanDerWaalsContact C-N 3.34Å; K207-M209 PolarHBondContact O-N 2.88Å; M209-F212 PolarHBondContact O-N 3.3Å; M209-K213 WeakPolarHBondContact O-CB 3.37Å; M209-K213 VanDerWaalsContact O-CG 3.25Å; M209-K213 WeakPolarHBondContact O-CG 3.38Å; M209-K213 PolarHBondContact O-N 3Å
210E95.4Very high96Very high109 Ų109113.5 Ų113.551%0.50952%0.516SS..Hα-helixtrans-63.3-49.4176-73.1162.5-169.100111.4K206 K207 F212 K213 I214K206-E210 WeakPolarHBondContact O-CG 3.39Å; K206-E210 PolarHBondContact O-N 2.9Å; K207-E210 PolarHBondContact O-N 2.95Å; E210-F212 VanDerWaalsContact C-N 3.33Å; E210-F212 PolarHBondContact O-N 2.81Å; E210-K213 WeakPolarHBondContact O-CB 3.47Å; E210-K213 PolarHBondContact O-N 3.43Å; E210-K213 VanDerWaalsContact O-N 3.15Å; E210-I214 VanDerWaalsContact O-CG1 3.32Å; E210-I214 WeakPolarHBondContact O-CG1 3.22Å; E210-I214 PolarHBondContact O-N 2.88Å
211V95.6Very high95.8Very high39 Ų39119.8 Ų119.824%0.23653%0.533CS..Hα-helixtrans-60.1-44.7175.5172.50000110.8K207 K213 I214 L215 Y232K207-V211 WeakPolarHBondContact O-CB 3.08Å; K207-V211 VanDerWaalsContact O-CG2 3.28Å; K207-V211 WeakPolarHBondContact O-CG2 3.05Å; K207-V211 PolarHBondContact O-N 2.83Å; V211-K213 VanDerWaalsContact C-N 3.32Å; V211-K213 PolarHBondContact O-N 3.47Å; V211-I214 PolarHBondContact O-N 2.92Å; V211-L215 HydrophobicContact CG1-CD1 3.7Å; V211-L215 HydrophobicContact CG1-CG 4.23Å; V211-L215 WeakPolarHBondContact O-CB 3.42Å; V211-L215 WeakPolarHBondContact O-CG 3.14Å; V211-L215 PolarHBondContact O-N 3.39Å; V211-Y232 HydrophobicContact CG1-CE1 4.06Å; V211-Y232 HydrophobicContact CG1-CE2 4.36Å; V211-Y232 WeakPolarHBondContact CG1-OH 3.25Å; V211-Y232 HydrophobicContact CG2-CE2 3.79Å; V211-Y232 WeakPolarHBondContact CG2-OH 3.43Å
212F96.5Very high95.7Very high122 Ų122116.1 Ų116.154%0.53553%0.526SS..Hα-helixtrans-60-42176.2-179.5-91.1000111.7K208 M209 E210 N216K208-F212 VanDerWaalsContact O-CB 3.22Å; K208-F212 WeakPolarHBondContact O-CB 3.45Å; K208-F212 PolarHBondContact O-N 3.04Å; M209-F212 PolarHBondContact O-N 3.3Å; E210-F212 VanDerWaalsContact C-N 3.33Å; E210-F212 PolarHBondContact O-N 2.81Å; F212-N216 WeakPolarHBondContact CD1-ND2 3.32Å; F212-N216 WeakPolarHBondContact CD2-ND2 2.92Å; F212-N216 VanDerWaalsContact CE1-ND2 3.28Å; F212-N216 WeakPolarHBondContact CE1-ND2 3.28Å; F212-N216 WeakPolarHBondContact CE2-ND2 3.02Å; F212-N216 WeakPolarHBondContact CG-ND2 3.47Å; F212-N216 WeakPolarHBondContact CZ-ND2 3.46Å; F212-N216 VanDerWaalsContact O-CB 3.29Å; F212-N216 WeakPolarHBondContact O-CB 3.29Å; F212-N216 PolarHBondContact O-N 3.32Å; F212-N216 PolarHBondContact O-ND2 3.4Å
213K96Very high95.5Very high137 Ų137114.2 Ų114.260%0.59652%0.524SS*.Hα-helixtrans-61.4-46176.2-77.6173.3-179.6-175.50111.4M209 E210 V211 K217M209-K213 WeakPolarHBondContact O-CB 3.37Å; M209-K213 VanDerWaalsContact O-CG 3.25Å; M209-K213 WeakPolarHBondContact O-CG 3.38Å; M209-K213 PolarHBondContact O-N 3Å; E210-K213 WeakPolarHBondContact O-CB 3.47Å; E210-K213 PolarHBondContact O-N 3.43Å; E210-K213 VanDerWaalsContact O-N 3.15Å; V211-K213 VanDerWaalsContact C-N 3.32Å; V211-K213 PolarHBondContact O-N 3.47Å; K213-K217 WeakPolarHBondContact O-CG 3.35Å; K213-K217 PolarHBondContact O-N 2.98Å
214I94.1Very high95.5Very high48 Ų48112.4 Ų112.425%0.24652%0.522CS..Hα-helixtrans-61.2-50.1179.2-69.5168.4000110.5E210 V211 N216 K217 V228 Y232E210-I214 VanDerWaalsContact O-CG1 3.32Å; E210-I214 WeakPolarHBondContact O-CG1 3.22Å; E210-I214 PolarHBondContact O-N 2.88Å; V211-I214 PolarHBondContact O-N 2.92Å; I214-N216 PolarHBondContact O-N 3.42Å; I214-K217 PolarHBondContact O-N 2.93Å; I214-V228 HydrophobicContact CB-CG1 4.41Å; I214-V228 HydrophobicContact CG2-CG1 3.61Å; I214-Y232 HydrophobicContact CG2-CG 4.29Å
215L92.9Very high95.4Very high67 Ų67107.6 Ų107.635%0.35151%0.507SS..Hα-helixtrans-70.7-31-176.2-66.4176.7000113.4V211 Q229 Y232V211-L215 HydrophobicContact CG1-CD1 3.7Å; V211-L215 HydrophobicContact CG1-CG 4.23Å; V211-L215 WeakPolarHBondContact O-CB 3.42Å; V211-L215 WeakPolarHBondContact O-CG 3.14Å; V211-L215 PolarHBondContact O-N 3.39Å; L215-Q229 HydrophobicContact CD2-CB 4.4Å; L215-Q229 HydrophobicContact CD2-CG 4.01Å; L215-Q229 PolarHBondContact O-NE2 3.44Å; L215-Y232 HydrophobicContact CD2-CD1 4.01Å; L215-Y232 HydrophobicContact CD2-CE1 4.43Å
216N93.4Very high95.2Very high73 Ų73106.9 Ų106.939%0.3951%0.509SS..THydrogen-bonded Turntrans-89.64.4179.4-70.6-64.9000114.6F212 I214 R218F212-N216 WeakPolarHBondContact CD1-ND2 3.32Å; F212-N216 WeakPolarHBondContact CD2-ND2 2.92Å; F212-N216 VanDerWaalsContact CE1-ND2 3.28Å; F212-N216 WeakPolarHBondContact CE1-ND2 3.28Å; F212-N216 WeakPolarHBondContact CE2-ND2 3.02Å; F212-N216 WeakPolarHBondContact CG-ND2 3.47Å; F212-N216 WeakPolarHBondContact CZ-ND2 3.46Å; F212-N216 VanDerWaalsContact O-CB 3.29Å; F212-N216 WeakPolarHBondContact O-CB 3.29Å; F212-N216 PolarHBondContact O-N 3.32Å; F212-N216 PolarHBondContact O-ND2 3.4Å; I214-N216 PolarHBondContact O-N 3.42Å; N216-R218 PolarHBondContact O-N 3.33Å
217K94.6Very high95.1Very high106 Ų106105.2 Ų105.246%0.46151%0.506SS..  trans-62.3129.8174.4-63.2-162.6-172.9166.10109.8K213 I214 N225 V228K213-K217 WeakPolarHBondContact O-CG 3.35Å; K213-K217 PolarHBondContact O-N 2.98Å; I214-K217 PolarHBondContact O-N 2.93Å; K217-N225 HydrophobicContact CB-CB 4.39Å; K217-N225 PolarHBondContact O-N 3.05Å; K217-V228 HydrophobicContact CD-CG1 4.14Å
218R95.4Very high95Very high174 Ų17499.8 Ų99.866%0.65749%0.485SS*.BIsolated β-bridgetrans-121.4152.9177.9-67.4175.7-178.6-159.43.1110.3N216 G222 Q223N216-R218 PolarHBondContact O-N 3.33Å; R218-G222 WeakPolarHBondContact CD-O 3.38Å; R218-Q223 CarbonylContact C-O 3.2Å; R218-Q223 WeakPolarHBondContact CA-O 3.48Å; R218-Q223 WeakPolarHBondContact CB-O 3.45Å
219T94.3Very high94.8Very high54 Ų5496.5 Ų96.533%0.33147%0.471SS..  trans-73.4169.8173.265.10000110.3K221 G222 Q223 N225T219-K221 PolarHBondContact O-N 3.21Å; T219-G222 PolarHBondContact O-N 3.36Å; T219-Q223 PolarHBondContact N-O 2.89Å; T219-Q223 PolarHBondContact OG1-N 3.27Å; T219-Q223 PolarHBondContact OG1-O 3.2Å; T219-N225 HydrophobicContact CG2-CB 4.5Å
220K93.4Very high94.7Very high224 Ų22496.7 Ų96.797%0.97447%0.472SS*.THydrogen-bonded Turntrans-55.4-25.6176.8-64.1-175.9-179.5-179.20113.1G222K220-G222 VanDerWaalsContact C-N 3.31Å
221K94.9Very high94.7Very high186 Ų18697.4 Ų97.481%0.80948%0.476SS*.THydrogen-bonded Turntrans-86.84.4176.9-60.8-174.4178.3-177.60113.5T219 Q223T219-K221 PolarHBondContact O-N 3.21Å; K221-Q223 VanDerWaalsContact C-N 3.29Å; K221-Q223 PolarHBondContact O-N 3.36Å
222G93.9Very high94.7Very high40 Ų4098 Ų9841%0.41247%0.474SS..SBendtrans80.21.2179.100000115.4R218 T219 K220R218-G222 WeakPolarHBondContact CD-O 3.38Å; T219-G222 PolarHBondContact O-N 3.36Å; K220-G222 VanDerWaalsContact C-N 3.31Å
223Q94.5Very high94.7Very high122 Ų12297.3 Ų97.357%0.5748%0.475SS*.  trans-76147.3177.4-65175.7-3100110.8R218 T219 K221R218-Q223 CarbonylContact C-O 3.2Å; R218-Q223 WeakPolarHBondContact CA-O 3.48Å; R218-Q223 WeakPolarHBondContact CB-O 3.45Å; T219-Q223 PolarHBondContact N-O 2.89Å; T219-Q223 PolarHBondContact OG1-N 3.27Å; T219-Q223 PolarHBondContact OG1-O 3.2Å; K221-Q223 VanDerWaalsContact C-N 3.29Å; K221-Q223 PolarHBondContact O-N 3.36Å
224P96.4Very high94.7Very high75 Ų7595.4 Ų95.449%0.48747%0.471SS..BIsolated β-bridgetrans-61.2139.2175.826.6-34.1000111.1L226P224-L226 PolarHBondContact O-N 3.21Å
225N94.9Very high94.8Very high52 Ų5297.8 Ų97.828%0.27848%0.481SS..  trans-85.195.1176.4-170.4-25.2000110.3K217 T219 N227 V228 Q229K217-N225 HydrophobicContact CB-CB 4.39Å; K217-N225 PolarHBondContact O-N 3.05Å; T219-N225 HydrophobicContact CG2-CB 4.5Å; N225-N227 VanDerWaalsContact C-N 3.35Å; N225-N227 PolarHBondContact O-N 3.41Å; N225-N227 PolarHBondContact OD1-N 3.41Å; N225-V228 HydrophobicContact CB-CG2 4.49Å; N225-V228 PolarHBondContact O-N 3.25Å; N225-Q229 PolarHBondContact O-N 3.32Å
226L94.3Very high94.9Very high113 Ų11399 Ų9959%0.59248%0.484SS*.Hα-helixtrans-63.7-35-174.9-68.8174.1000113.5P224 V228 Q229 M230P224-L226 PolarHBondContact O-N 3.21Å; L226-V228 VanDerWaalsContact C-N 3.33Å; L226-V228 PolarHBondContact O-N 3.4Å; L226-Q229 PolarHBondContact O-N 2.81Å; L226-M230 VanDerWaalsContact O-CB 3.31Å; L226-M230 WeakPolarHBondContact O-CB 3.45Å; L226-M230 PolarHBondContact O-N 3.39Å
227N94.8Very high95Very high103 Ų10399.9 Ų99.955%0.55149%0.487SS*.Hα-helixtrans-60.3-45.4-179.1-70.710.2000111.1N225 Q229 M230 E231N225-N227 VanDerWaalsContact C-N 3.35Å; N225-N227 PolarHBondContact O-N 3.41Å; N225-N227 PolarHBondContact OD1-N 3.41Å; N227-Q229 VanDerWaalsContact C-N 3.32Å; N227-Q229 PolarHBondContact O-N 2.85Å; N227-M230 PolarHBondContact O-N 3.21Å; N227-E231 WeakPolarHBondContact O-CG 2.91Å; N227-E231 PolarHBondContact O-N 2.79Å
228V95.2Very high95.1Very high24 Ų24101.8 Ų101.815%0.14550%0.498CS..Hα-helixtrans-67-34.5179.6178.20000111.9I214 K217 N225 L226 Y232I214-V228 HydrophobicContact CB-CG1 4.41Å; I214-V228 HydrophobicContact CG2-CG1 3.61Å; K217-V228 HydrophobicContact CD-CG1 4.14Å; N225-V228 HydrophobicContact CB-CG2 4.49Å; N225-V228 PolarHBondContact O-N 3.25Å; L226-V228 VanDerWaalsContact C-N 3.33Å; L226-V228 PolarHBondContact O-N 3.4Å; V228-Y232 PolarHBondContact O-N 3.42Å
229Q94.3Very high95Very high57 Ų57100 Ų10027%0.26650%0.497SS..Hα-helixtrans-70.2-38.3174.9-65.9-177.9-11.300111.7L215 N225 L226 N227 Y232 L233L215-Q229 HydrophobicContact CD2-CB 4.4Å; L215-Q229 HydrophobicContact CD2-CG 4.01Å; L215-Q229 PolarHBondContact O-NE2 3.44Å; N225-Q229 PolarHBondContact O-N 3.32Å; L226-Q229 PolarHBondContact O-N 2.81Å; N227-Q229 VanDerWaalsContact C-N 3.32Å; N227-Q229 PolarHBondContact O-N 2.85Å; Q229-Y232 PolarHBondContact O-N 3.2Å; Q229-L233 PolarHBondContact O-N 3.43Å
230M94.9Very high94.8Very high106 Ų106105 Ų10552%0.52251%0.514SS..Hα-helixtrans-67.5-43.4178.3-176.7157.848.500111.6L226 N227 Y232 L233 L234L226-M230 VanDerWaalsContact O-CB 3.31Å; L226-M230 WeakPolarHBondContact O-CB 3.45Å; L226-M230 PolarHBondContact O-N 3.39Å; N227-M230 PolarHBondContact O-N 3.21Å; M230-Y232 VanDerWaalsContact C-N 3.35Å; M230-Y232 PolarHBondContact O-N 3.12Å; M230-L233 WeakPolarHBondContact O-CB 3.42Å; M230-L233 PolarHBondContact O-N 3.47Å; M230-L233 VanDerWaalsContact O-N 3.12Å; M230-L234 HydrophobicContact CG-CD1 4.27Å; M230-L234 WeakPolarHBondContact O-CG 3.32Å; M230-L234 PolarHBondContact O-N 3.04Å
231E95.1Very high94Very high124 Ų124101.3 Ų101.358%0.57952%0.516SS*.Hα-helixtrans-55.4-47.9172.9-74.6168.4-171.900111.9N227 L233 L234 Q235N227-E231 WeakPolarHBondContact O-CG 2.91Å; N227-E231 PolarHBondContact O-N 2.79Å; E231-L233 VanDerWaalsContact C-N 3.31Å; E231-L233 PolarHBondContact O-N 3.41Å; E231-L234 PolarHBondContact O-N 2.92Å; E231-Q235 WeakPolarHBondContact O-CB 3.47Å; E231-Q235 PolarHBondContact O-N 2.89Å
232Y95.8Very high94Very high52 Ų5297.1 Ų97.120%0.20450%0.502CS..Hα-helixtrans-62.7-37.3176.6172.8-107.4000112.7V211 I214 L215 V228 Q229 M230 K236V211-Y232 HydrophobicContact CG1-CE1 4.06Å; V211-Y232 HydrophobicContact CG1-CE2 4.36Å; V211-Y232 WeakPolarHBondContact CG1-OH 3.25Å; V211-Y232 HydrophobicContact CG2-CE2 3.79Å; V211-Y232 WeakPolarHBondContact CG2-OH 3.43Å; I214-Y232 HydrophobicContact CG2-CG 4.29Å; L215-Y232 HydrophobicContact CD2-CD1 4.01Å; L215-Y232 HydrophobicContact CD2-CE1 4.43Å; V228-Y232 PolarHBondContact O-N 3.42Å; Q229-Y232 PolarHBondContact O-N 3.2Å; M230-Y232 VanDerWaalsContact C-N 3.35Å; M230-Y232 PolarHBondContact O-N 3.12Å; Y232-K236 WeakPolarHBondContact O-CB 3.31Å; Y232-K236 PolarHBondContact O-N 2.97Å
233L95.2Very high94Very high106 Ų106100.1 Ų100.156%0.55551%0.506SS*.Hα-helixtrans-67.2-44.4177.4-149.497.2000111.5Q229 M230 E231 K236 I237Q229-L233 PolarHBondContact O-N 3.43Å; M230-L233 WeakPolarHBondContact O-CB 3.42Å; M230-L233 PolarHBondContact O-N 3.47Å; M230-L233 VanDerWaalsContact O-N 3.12Å; E231-L233 VanDerWaalsContact C-N 3.31Å; E231-L233 PolarHBondContact O-N 3.41Å; L233-K236 PolarHBondContact O-N 2.97Å; L233-I237 HydrophobicContact CD2-CD1 4.36Å; L233-I237 WeakPolarHBondContact O-CG1 3.32Å; L233-I237 PolarHBondContact O-N 3.01Å
234L96.2Very high94Very high97 Ų9798.8 Ų98.851%0.50850%0.503SS..Hα-helixtrans-61.4-45.6176.8-70.1172.9000111M230 E231 K236 I237 Q238M230-L234 HydrophobicContact CG-CD1 4.27Å; M230-L234 WeakPolarHBondContact O-CG 3.32Å; M230-L234 PolarHBondContact O-N 3.04Å; E231-L234 PolarHBondContact O-N 2.92Å; L234-K236 VanDerWaalsContact C-N 3.29Å; L234-K236 PolarHBondContact O-N 2.91Å; L234-I237 PolarHBondContact O-N 2.96Å; L234-I237 VanDerWaalsContact O-N 3.11Å; L234-Q238 WeakPolarHBondContact O-CG 3.46Å; L234-Q238 PolarHBondContact O-N 3.11Å
235Q96Very high93.8Very high99 Ų99100.2 Ų100.246%0.46350%0.504SS..Hα-helixtrans-56.1-45.1174.1-177.8179.1-4.100111.2E231 I237 Q238 E239E231-Q235 WeakPolarHBondContact O-CB 3.47Å; E231-Q235 PolarHBondContact O-N 2.89Å; Q235-I237 VanDerWaalsContact C-N 3.29Å; Q235-I237 PolarHBondContact O-N 2.79Å; Q235-Q238 PolarHBondContact O-N 3.1Å; Q235-E239 HydrophobicContact CG-CG 4.4Å; Q235-E239 WeakPolarHBondContact CG-OE1 3.47Å; Q235-E239 PolarHBondContact NE2-OE1 2.83Å; Q235-E239 WeakPolarHBondContact O-CB 3.36Å; Q235-E239 WeakPolarHBondContact O-CG 3.35Å; Q235-E239 PolarHBondContact O-N 2.8Å
236K95.9Very high93.8Very high92 Ų92103.3 Ų103.340%0.452%0.518SS..Hα-helixtrans-67.6-26.9179.2-170.5173.6-175.2-179.60113.6Y232 L233 L234 K240Y232-K236 WeakPolarHBondContact O-CB 3.31Å; Y232-K236 PolarHBondContact O-N 2.97Å; L233-K236 PolarHBondContact O-N 2.97Å; L234-K236 VanDerWaalsContact C-N 3.29Å; L234-K236 PolarHBondContact O-N 2.91Å; K236-K240 WeakPolarHBondContact O-CB 3.46Å; K236-K240 WeakPolarHBondContact O-CD 3.48Å; K236-K240 WeakPolarHBondContact O-CG 3.18Å
237I95.9Very high93.7Very high92 Ų92102.6 Ų102.647%0.47251%0.513SS..Hα-helixtrans-74.6-44.7173.8-68.8165.3000109.7L233 L234 Q235 K240 S241L233-I237 HydrophobicContact CD2-CD1 4.36Å; L233-I237 WeakPolarHBondContact O-CG1 3.32Å; L233-I237 PolarHBondContact O-N 3.01Å; L234-I237 PolarHBondContact O-N 2.96Å; L234-I237 VanDerWaalsContact O-N 3.11Å; Q235-I237 VanDerWaalsContact C-N 3.29Å; Q235-I237 PolarHBondContact O-N 2.79Å; I237-K240 PolarHBondContact O-N 3.14Å; I237-S241 PolarHBondContact O-N 2.88Å; I237-S241 VanDerWaalsContact O-N 3.1Å; I237-S241 PolarHBondContact O-OG 3.34Å
238Q95.7Very high93.7Very high146 Ų146102.6 Ų102.668%0.68251%0.51SS*.Hα-helixtrans-62.4-43.2176.8-71.8175.6-14.600112.2L234 Q235 K240 S241L234-Q238 WeakPolarHBondContact O-CG 3.46Å; L234-Q238 PolarHBondContact O-N 3.11Å; Q235-Q238 PolarHBondContact O-N 3.1Å; Q238-K240 PolarHBondContact O-N 3.33Å; Q238-S241 PolarHBondContact O-N 2.97Å
239E93.8Very high93.5Very high136 Ų136108.6 Ų108.664%0.63654%0.538SS*.THydrogen-bonded Turntrans-65.2-19177.1-73.7174.6-173.200113.8Q235Q235-E239 HydrophobicContact CG-CG 4.4Å; Q235-E239 WeakPolarHBondContact CG-OE1 3.47Å; Q235-E239 PolarHBondContact NE2-OE1 2.83Å; Q235-E239 WeakPolarHBondContact O-CB 3.36Å; Q235-E239 WeakPolarHBondContact O-CG 3.35Å; Q235-E239 PolarHBondContact O-N 2.8Å
240K89.9Confident93.5Very high159 Ų159112.9 Ų112.969%0.69156%0.561SS**THydrogen-bonded Turntrans-100-13.9-179.2-76.4-180176.4-169.90113.9K236 I237 Q238K236-K240 WeakPolarHBondContact O-CB 3.46Å; K236-K240 WeakPolarHBondContact O-CD 3.48Å; K236-K240 WeakPolarHBondContact O-CG 3.18Å; I237-K240 PolarHBondContact O-N 3.14Å; Q238-K240 PolarHBondContact O-N 3.33Å
241S77.3Confident93.3Very high146 Ų146113.5 Ų113.5100%1.02157%0.565SS**  trans-87.40177.8-55.80000109I237 Q238I237-S241 PolarHBondContact O-N 2.88Å; I237-S241 VanDerWaalsContact O-N 3.1Å; I237-S241 PolarHBondContact O-OG 3.34Å; Q238-S241 PolarHBondContact O-N 2.97Å

Retrieved 241 of 241 residues in 33 ms (Link to these results)