A0A077ZM87_TRITR Loading...

V-type proton ATPase 116 kDa subunit a isoform 2

AlphaFold DB , UniProt , Accession A0A077ZM87, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 137 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
1M49.5Very low60.6Low248 Ų248118.4 Ų118.4100%1.22265%0.646SS**  0850-68.8-135.1167.500107.7
2S50.1Low60.6Low90 Ų90118.8 Ų118.863%0.62965%0.646SS**  trans-99.1115.7173.8-176.70000105.5D6S2-D6 PolarHBondContact OG-OD2 2.85Å; S2-D6 VanDerWaalsContact OG-OD2 3.04Å
3S61.9Low60.6Low96 Ų96120.2 Ų120.267%0.67165%0.645SS**  trans-157.68.1-170-161.90000118.2
4K59.8Low60.6Low176 Ų176117.3 Ų117.377%0.76564%0.639SS**SBendtrans-133.6-34.2170.8-79.1-177.2175.1163.60113.6
5D63.7Low60.2Low122 Ų122120.3 Ų120.365%0.65265%0.646SS**Hα-helixtrans-74.7-30.3178.5-62.5-46.4000113.6R9D5-R9 PolarHBondContact O-N 2.78Å; D5-R9 VanDerWaalsContact O-N 3.15Å
6D64.5Low60Low84 Ų84120 Ų12045%0.44965%0.65SS.*Hα-helixtrans-64.4-43.1175.7-92.9-35.6000111.7S2 V8 R9 T10S2-D6 PolarHBondContact OG-OD2 2.85Å; S2-D6 VanDerWaalsContact OG-OD2 3.04Å; D6-V8 VanDerWaalsContact C-N 3.3Å; D6-V8 PolarHBondContact O-N 2.71Å; D6-R9 PolarHBondContact O-N 3.37Å; D6-T10 PolarHBondContact O-N 3.1Å; D6-T10 PolarHBondContact O-OG1 2.77Å
7V62.6Low59.8Low101 Ų101123.5 Ų123.561%0.61266%0.661SS**Hα-helixtrans-64.3-36.5-177.7-177.10000111.5A11V7-A11 WeakPolarHBondContact O-CB 2.99Å; V7-A11 PolarHBondContact O-N 3.24Å; V7-A11 VanDerWaalsContact O-N 3.08Å
8V64.2Low59.4Low89 Ų89122.6 Ų122.654%0.53967%0.667SS.*Hα-helixtrans-72.8-37.2178-179.90000111.3D6 A11 L12D6-V8 VanDerWaalsContact C-N 3.3Å; D6-V8 PolarHBondContact O-N 2.71Å; V8-A11 PolarHBondContact O-N 3Å; V8-L12 HydrophobicContact CG1-CD1 4.25Å; V8-L12 PolarHBondContact O-N 2.91Å; V8-L12 VanDerWaalsContact O-N 3.16Å
9R64.7Low58.9Low155 Ų155126.6 Ų126.659%0.58568%0.68SS**Hα-helixtrans-66.1-45.4173.8-74.1-176.2-164.2159.85.7111.9D5 D6 A11 L12 E13D5-R9 PolarHBondContact O-N 2.78Å; D5-R9 VanDerWaalsContact O-N 3.15Å; D6-R9 PolarHBondContact O-N 3.37Å; R9-A11 VanDerWaalsContact C-N 3.28Å; R9-A11 PolarHBondContact O-N 2.82Å; R9-L12 PolarHBondContact O-N 3Å; R9-L12 VanDerWaalsContact O-N 3.13Å; R9-E13 WeakPolarHBondContact O-CB 3.27Å; R9-E13 WeakPolarHBondContact O-CG 3.23Å; R9-E13 PolarHBondContact O-N 3.18Å
10T63.7Low58.7Low89 Ų89125.2 Ų125.255%0.54668%0.68SS.*Hα-helixtrans-63.6-34.7178.3-39.60000111.9D6 S14D6-T10 PolarHBondContact O-N 3.1Å; D6-T10 PolarHBondContact O-OG1 2.77Å; T10-S14 WeakPolarHBondContact O-CB 3.4Å; T10-S14 PolarHBondContact O-N 3.31Å
11A62.3Low58.5Low52 Ų52124.1 Ų124.143%0.4369%0.689SS.*Hα-helixtrans-66.6-38.217500000112.3V7 V8 R9 S14 H15V7-A11 WeakPolarHBondContact O-CB 2.99Å; V7-A11 PolarHBondContact O-N 3.24Å; V7-A11 VanDerWaalsContact O-N 3.08Å; V8-A11 PolarHBondContact O-N 3Å; R9-A11 VanDerWaalsContact C-N 3.28Å; R9-A11 PolarHBondContact O-N 2.82Å; A11-S14 PolarHBondContact O-OG 2.84Å; A11-H15 PolarHBondContact O-CD2 3.11Å; A11-H15 VanDerWaalsContact O-CD2 3.32Å
12L59.7Low58.7Low124 Ų124121.1 Ų121.165%0.64967%0.672SS**Hα-helixtrans-76.8-34.6178.7-75.9167.6000113.3V8 R9 S14V8-L12 HydrophobicContact CG1-CD1 4.25Å; V8-L12 PolarHBondContact O-N 2.91Å; V8-L12 VanDerWaalsContact O-N 3.16Å; R9-L12 PolarHBondContact O-N 3Å; R9-L12 VanDerWaalsContact O-N 3.13Å; L12-S14 VanDerWaalsContact C-N 3.26Å; L12-S14 PolarHBondContact O-N 2.74Å
13E60.9Low58.9Low136 Ų136125 Ų12564%0.63668%0.68SS**Hα-helixtrans-73.1-18.8176.6-73168.9174.300112.5R9 H15 T16R9-E13 WeakPolarHBondContact O-CB 3.27Å; R9-E13 WeakPolarHBondContact O-CG 3.23Å; R9-E13 PolarHBondContact O-N 3.18Å; E13-H15 VanDerWaalsContact C-N 3.3Å; E13-H15 PolarHBondContact O-N 2.88Å; E13-T16 PolarHBondContact O-OG1 2.98Å
14S60.4Low58.6Low80 Ų80129.2 Ų129.256%0.55969%0.689SS**THydrogen-bonded Turntrans-77.5-8.4177.376.50000115.3T10 A11 L12T10-S14 WeakPolarHBondContact O-CB 3.4Å; T10-S14 PolarHBondContact O-N 3.31Å; A11-S14 PolarHBondContact O-OG 2.84Å; L12-S14 VanDerWaalsContact C-N 3.26Å; L12-S14 PolarHBondContact O-N 2.74Å
15H55.4Low58.5Low162 Ų162126.4 Ų126.475%0.7569%0.687SS**THydrogen-bonded Turntrans-106.36-177.6-73-60.2000114.4A11 E13A11-H15 PolarHBondContact O-CD2 3.11Å; A11-H15 VanDerWaalsContact O-CD2 3.32Å; E13-H15 VanDerWaalsContact C-N 3.3Å; E13-H15 PolarHBondContact O-N 2.88Å
16T56.1Low58.4Low116 Ų116125 Ų12571%0.71269%0.687SS**SBendtrans-103.43.9-17950.20000114.8E13E13-T16 PolarHBondContact O-OG1 2.98Å
17E57.3Low58Low179 Ų179126.4 Ų126.484%0.83670%0.7SS**  trans-113.866.2174.6-73.1-173.4159.100111.4
18S52.6Low57.6Low108 Ų108124.9 Ų124.976%0.75569%0.694SS**  trans-158.966.6155.3-82.30000108.6S20S18-S20 PolarHBondContact O-N 2.69Å
19E49.1Very low57.4Low198 Ų198126.6 Ų126.693%0.92570%0.699SS**  trans-68.483.2154.1-170.1177.7168.300106.8
20S54.9Low56.8Low98 Ų98124.6 Ų124.669%0.68570%0.7SS**  trans-132.798.4171-86.20000108.1S18 E22S18-S20 PolarHBondContact O-N 2.69Å; S20-E22 VanDerWaalsContact C-N 3.35Å; S20-E22 PolarHBondContact O-N 2.81Å
21A55.5Low56.5Low104 Ų104124.6 Ų124.686%0.8670%0.704SS**  trans-8.475.7160.100000116.4Q23A21-Q23 VanDerWaalsContact C-N 3.3Å; A21-Q23 PolarHBondContact O-N 2.57Å
22E52.3Low56.2Low184 Ų184128.6 Ų128.686%0.8672%0.717SS**  trans-80.595.8147.9-66-154.2153.300105.9S20 E24S20-E22 VanDerWaalsContact C-N 3.35Å; S20-E22 PolarHBondContact O-N 2.81Å; E22-E24 PolarHBondContact O-N 3.48Å
23Q55.2Low56.3Low171 Ų171127.6 Ų127.680%0.79971%0.712SS**  trans-47.1105.1165.7-139.1170.723.400106.8A21 T25A21-Q23 VanDerWaalsContact C-N 3.3Å; A21-Q23 PolarHBondContact O-N 2.57Å; Q23-T25 PolarHBondContact O-N 3.33Å
24E55.9Low56.2Low185 Ų185123.8 Ų123.886%0.86470%0.699SS**  trans-62.888.5167.2-76.2-165.6151.500106.7E22 S26E22-E24 PolarHBondContact O-N 3.48Å; E24-S26 PolarHBondContact O-N 3.09Å
25T57.3Low56.1Low117 Ų117124.1 Ų124.172%0.71872%0.715SS**  trans-65.589.2164.453.60000105.9Q23Q23-T25 PolarHBondContact O-N 3.33Å
26S61.4Low56.2Low93 Ų93119.5 Ų119.565%0.6570%0.695SS**  trans-47.8126.7161-680000106.6E24 S28E24-S26 PolarHBondContact O-N 3.09Å; S26-S28 PolarHBondContact O-N 3.06Å
27P56Low56.1Low113 Ų113117.6 Ų117.673%0.73469%0.685SS**  trans-56.7110.2174.621.7-30.2000107.1I29P27-I29 PolarHBondContact O-N 3.18Å
28S55.1Low56Low69 Ų69117.1 Ų117.148%0.48369%0.687SS.*  trans-57.8133.1-179.3-149.50000107.2S26 D30 S31S26-S28 PolarHBondContact O-N 3.06Å; S28-D30 PolarHBondContact O-N 2.92Å; S28-D30 PolarHBondContact OG-OD2 2.65Å; S28-S31 WeakPolarHBondContact O-CB 3.46Å; S28-S31 PolarHBondContact O-N 2.92Å; S28-S31 PolarHBondContact O-OG 3.42Å
29I58.5Low56.1Low125 Ų125118.5 Ų118.564%0.64168%0.681SS**G310 helixtrans-52.5-26.1176.2-74.4166.8000110.8P27 S31 L32 L33P27-I29 PolarHBondContact O-N 3.18Å; I29-S31 PolarHBondContact O-N 3.27Å; I29-S31 VanDerWaalsContact O-N 3.11Å; I29-L32 WeakPolarHBondContact O-CA 3.42Å; I29-L32 WeakPolarHBondContact O-CB 3.28Å; I29-L32 PolarHBondContact O-N 3.32Å; I29-L33 PolarHBondContact O-N 2.88Å
30D54Low56.5Low114 Ų114117.6 Ų117.661%0.6168%0.677SS**G310 helixtrans-57.5-22.3174.3-51-49.9000114.4S28S28-D30 PolarHBondContact O-N 2.92Å; S28-D30 PolarHBondContact OG-OD2 2.65Å
31S57.2Low56.6Low89 Ų89119 Ų11962%0.62268%0.677SS**G310 helixtrans-80.7-16.2173.264.30000113.9S28 I29S28-S31 WeakPolarHBondContact O-CB 3.46Å; S28-S31 PolarHBondContact O-N 2.92Å; S28-S31 PolarHBondContact O-OG 3.42Å; I29-S31 PolarHBondContact O-N 3.27Å; I29-S31 VanDerWaalsContact O-N 3.11Å
32L55.7Low56.6Low135 Ų135116.7 Ų116.771%0.70765%0.65SS**THydrogen-bonded Turntrans-91.5-17.4175.3-63.5170.6000112.2I29 P34I29-L32 WeakPolarHBondContact O-CA 3.42Å; I29-L32 WeakPolarHBondContact O-CB 3.28Å; I29-L32 PolarHBondContact O-N 3.32Å; L32-P34 VanDerWaalsContact O-CD 3.27Å; L32-P34 WeakPolarHBondContact O-CD 3.36Å
33L60.7Low57Low104 Ų104118 Ų11855%0.54565%0.648SS.*SBendtrans-82110.5169.6-64.3175000106.7I29 G35I29-L33 PolarHBondContact O-N 2.88Å; L33-G35 PolarHBondContact O-N 2.89Å
34P60Low57.9Low56 Ų56113.9 Ų113.936%0.36463%0.632SS.*  trans-51.7136.9168.321.8-30000106.9L32 L36L32-P34 VanDerWaalsContact O-CD 3.27Å; L32-P34 WeakPolarHBondContact O-CD 3.36Å; P34-L36 HydrophobicContact CG-CD1 4.28Å; P34-L36 HydrophobicContact CG-CG 4.5Å; P34-L36 VanDerWaalsContact O-CG 3.28Å; P34-L36 WeakPolarHBondContact O-CG 3.4Å; P34-L36 PolarHBondContact O-N 3.3Å
35G58.4Low59.2Low87 Ų87110.7 Ų110.790%0.89762%0.617SS**  trans-58.469.3-172.900000112.9L33L33-G35 PolarHBondContact O-N 2.89Å
36L56Low60.5Low64 Ų64111.5 Ų111.534%0.33561%0.613SS.*  trans-69.8128.8-177-79153.3000105.5P34 I38 L51P34-L36 HydrophobicContact CG-CD1 4.28Å; P34-L36 HydrophobicContact CG-CG 4.5Å; P34-L36 VanDerWaalsContact O-CG 3.28Å; P34-L36 WeakPolarHBondContact O-CG 3.4Å; P34-L36 PolarHBondContact O-N 3.3Å; L36-I38 VanDerWaalsContact C-N 3.3Å; L36-I38 PolarHBondContact O-N 3.15Å; L36-L51 HydrophobicContact CD1-CD1 3.37Å; L36-L51 HydrophobicContact CD1-CD2 3.87Å; L36-L51 HydrophobicContact CD1-CG 4.27Å; L36-L51 HydrophobicContact CD2-CD1 3.59Å; L36-L51 HydrophobicContact CD2-CD2 4.38Å; L36-L51 HydrophobicContact CG-CD1 4.08Å
37P55.8Low61.3Low77 Ų77109.2 Ų109.250%0.560%0.596SS.*  trans-58104.9170.324.9-30.5000105.6Q39 L42P37-Q39 HydrophobicContact CB-CB 4.17Å; P37-Q39 HydrophobicContact CB-CG 3.9Å; P37-Q39 PolarHBondContact O-N 2.87Å; P37-L42 WeakPolarHBondContact O-CD1 3.21Å
38I54.7Low62.6Low169 Ų169106.8 Ų106.887%0.86758%0.577SS**  trans-69.967.1165.3-51.9172.1000104.6L36L36-I38 VanDerWaalsContact C-N 3.3Å; L36-I38 PolarHBondContact O-N 3.15Å
39Q54.5Low64.1Low136 Ų136111.2 Ų111.264%0.63658%0.583SS**  trans-113.8141.3177-72.5-172.6-20.200105.4P37 D41 L42P37-Q39 HydrophobicContact CB-CB 4.17Å; P37-Q39 HydrophobicContact CB-CG 3.9Å; P37-Q39 PolarHBondContact O-N 2.87Å; Q39-D41 PolarHBondContact O-N 2.88Å; Q39-L42 PolarHBondContact O-N 2.9Å
40E56.4Low65.4Low179 Ų179109.1 Ų109.184%0.83658%0.576SS**G310 helixtrans-55.3-8.6-164.4-67.2158.1154.100114.9L42E40-L42 VanDerWaalsContact C-N 3.26Å; E40-L42 PolarHBondContact O-N 3.41Å
41D57.5Low66.7Low129 Ų129105.2 Ų105.269%0.6956%0.555SS**G310 helixtrans-70.8-8.2169.6-77.4-18.9000115.1Q39 Y43 N44 S47Q39-D41 PolarHBondContact O-N 2.88Å; D41-Y43 PolarHBondContact O-N 3.17Å; D41-N44 PolarHBondContact O-N 3.26Å; D41-S47 WeakPolarHBondContact O-CB 3.47Å; D41-S47 PolarHBondContact O-OG 3.28Å; D41-S47 VanDerWaalsContact O-OG 3.1Å
42L56.2Low68.1Low55 Ų55108.2 Ų108.229%0.28856%0.557SS.*G310 helixtrans-66.9-9174.9-11395.7000114.1P37 Q39 E40 L48 L51P37-L42 WeakPolarHBondContact O-CD1 3.21Å; Q39-L42 PolarHBondContact O-N 2.9Å; E40-L42 VanDerWaalsContact C-N 3.26Å; E40-L42 PolarHBondContact O-N 3.41Å; L42-L48 VanDerWaalsContact O-CD2 3.27Å; L42-L48 WeakPolarHBondContact O-CD2 3.43Å; L42-L48 VanDerWaalsContact O-CG 3.23Å; L42-L48 WeakPolarHBondContact O-CG 3.27Å; L42-L51 HydrophobicContact CD2-CD2 4.21Å
43Y60.1Low69.6Low210 Ų210104 Ų10482%0.82454%0.541SS*.G310 helixtrans-90.7-3.5177.4-66.6-74.7000114D41D41-Y43 PolarHBondContact O-N 3.17Å
44N75.5Confident70.8Confident85 Ų85101.5 Ų101.546%0.45553%0.53SS..SBendtrans-74.9131.5169.7-177.615.1000110D41 E46 S47 L48D41-N44 PolarHBondContact O-N 3.26Å; N44-E46 PolarHBondContact O-N 3.4Å; N44-E46 PolarHBondContact OD1-N 3.21Å; N44-S47 WeakPolarHBondContact O-CB 3.39Å; N44-S47 PolarHBondContact O-N 3.41Å; N44-L48 PolarHBondContact O-N 2.91Å; N44-L48 VanDerWaalsContact O-N 3.09Å
45E81.5Confident72.1Confident118 Ų118100.6 Ų100.655%0.55152%0.524SS*.Hα-helixtrans-55-36.6179.6-167.9-173.2157.800111.9L48 R49E45-L48 PolarHBondContact O-N 3.44Å; E45-R49 WeakPolarHBondContact O-CB 3.47Å; E45-R49 WeakPolarHBondContact O-CG 3.49Å; E45-R49 PolarHBondContact O-N 3.34Å; E45-R49 IonicContact OE1-CZ 2.65Å; E45-R49 IonicContact OE1-NE 2.66Å; E45-R49 PolarHBondContact OE1-NE 2.93Å; E45-R49 IonicContact OE1-NH2 2.92Å; E45-R49 PolarHBondContact OE1-NH2 2.94Å
46E84.5Confident73.7Confident135 Ų13598.2 Ų98.263%0.63150%0.499SS*.Hα-helixtrans-68-40.1177.9-172.7171.1-164.600112.8N44 R49 T50N44-E46 PolarHBondContact O-N 3.4Å; N44-E46 PolarHBondContact OD1-N 3.21Å; E46-R49 PolarHBondContact O-N 3.32Å; E46-T50 WeakPolarHBondContact O-CB 3.26Å; E46-T50 PolarHBondContact O-N 3.08Å; E46-T50 PolarHBondContact O-OG1 2.91Å
47S79.6Confident75.4Confident44 Ų44102.6 Ų102.631%0.30851%0.511SS..Hα-helixtrans-62.3-45.8175-58.30000110.8D41 N44 T50 L51D41-S47 WeakPolarHBondContact O-CB 3.47Å; D41-S47 PolarHBondContact O-OG 3.28Å; D41-S47 VanDerWaalsContact O-OG 3.1Å; N44-S47 WeakPolarHBondContact O-CB 3.39Å; N44-S47 PolarHBondContact O-N 3.41Å; S47-T50 PolarHBondContact O-N 3.49Å; S47-L51 WeakPolarHBondContact O-CB 3.08Å; S47-L51 PolarHBondContact O-N 2.89Å
48L82.9Confident77.1Confident62 Ų62103.2 Ų103.233%0.32551%0.508SS..Hα-helixtrans-63.6-44.6176.4-70.3174.7000112L42 N44 E45 T50 L51 F52L42-L48 VanDerWaalsContact O-CD2 3.27Å; L42-L48 WeakPolarHBondContact O-CD2 3.43Å; L42-L48 VanDerWaalsContact O-CG 3.23Å; L42-L48 WeakPolarHBondContact O-CG 3.27Å; N44-L48 PolarHBondContact O-N 2.91Å; N44-L48 VanDerWaalsContact O-N 3.09Å; E45-L48 PolarHBondContact O-N 3.44Å; L48-T50 VanDerWaalsContact C-N 3.3Å; L48-T50 PolarHBondContact O-N 2.83Å; L48-L51 PolarHBondContact O-N 3.13Å; L48-F52 HydrophobicContact CB-CD2 4.44Å; L48-F52 HydrophobicContact CB-CE2 4.36Å; L48-F52 WeakPolarHBondContact O-CD2 3.44Å; L48-F52 PolarHBondContact O-N 3.42Å
49R86.2Confident79Confident162 Ų162100.4 Ų100.461%0.61149%0.493SS*.Hα-helixtrans-58.9-43.3176.2-77171179.5-89.32.9111.4E45 E46 A53E45-R49 WeakPolarHBondContact O-CB 3.47Å; E45-R49 WeakPolarHBondContact O-CG 3.49Å; E45-R49 PolarHBondContact O-N 3.34Å; E45-R49 IonicContact OE1-CZ 2.65Å; E45-R49 IonicContact OE1-NE 2.66Å; E45-R49 PolarHBondContact OE1-NE 2.93Å; E45-R49 IonicContact OE1-NH2 2.92Å; E45-R49 PolarHBondContact OE1-NH2 2.94Å; E46-R49 PolarHBondContact O-N 3.32Å; R49-A53 VanDerWaalsContact O-CB 3.26Å; R49-A53 WeakPolarHBondContact O-CB 3.38Å; R49-A53 PolarHBondContact O-N 3.34Å
50T85.6Confident80.9Confident81 Ų8197.6 Ų97.650%0.49748%0.482SS..Hα-helixtrans-64.9-45.5177.7-58.80000111.1E46 S47 L48 A53 V54E46-T50 WeakPolarHBondContact O-CB 3.26Å; E46-T50 PolarHBondContact O-N 3.08Å; E46-T50 PolarHBondContact O-OG1 2.91Å; S47-T50 PolarHBondContact O-N 3.49Å; L48-T50 VanDerWaalsContact C-N 3.3Å; L48-T50 PolarHBondContact O-N 2.83Å; T50-A53 PolarHBondContact O-N 3.33Å; T50-V54 HydrophobicContact CG2-CG2 4.42Å; T50-V54 WeakPolarHBondContact O-CG2 3.46Å; T50-V54 PolarHBondContact O-N 3.07Å
51L82.6Confident82.7Confident33 Ų3395.2 Ų95.217%0.17347%0.471CS..Hα-helixtrans-57.1-54.6175.5171.354.1000111.6L36 L42 S47 L48 A53 V54 T55L36-L51 HydrophobicContact CD1-CD1 3.37Å; L36-L51 HydrophobicContact CD1-CD2 3.87Å; L36-L51 HydrophobicContact CD1-CG 4.27Å; L36-L51 HydrophobicContact CD2-CD1 3.59Å; L36-L51 HydrophobicContact CD2-CD2 4.38Å; L36-L51 HydrophobicContact CG-CD1 4.08Å; L42-L51 HydrophobicContact CD2-CD2 4.21Å; S47-L51 WeakPolarHBondContact O-CB 3.08Å; S47-L51 PolarHBondContact O-N 2.89Å; L48-L51 PolarHBondContact O-N 3.13Å; L51-A53 PolarHBondContact O-N 3.16Å; L51-V54 PolarHBondContact O-N 2.91Å; L51-T55 WeakPolarHBondContact CD1-OG1 3.46Å; L51-T55 WeakPolarHBondContact O-CB 3.48Å; L51-T55 PolarHBondContact O-N 3.29Å; L51-T55 PolarHBondContact O-OG1 3.22Å
52F85.6Confident84.6Confident152 Ų15293.5 Ų93.567%0.66747%0.465SS*.Hα-helixtrans-59.8-35177.8-75.4-60.8000112.5L48 G56L48-F52 HydrophobicContact CB-CD2 4.44Å; L48-F52 HydrophobicContact CB-CE2 4.36Å; L48-F52 WeakPolarHBondContact O-CD2 3.44Å; L48-F52 PolarHBondContact O-N 3.42Å; F52-G56 VanDerWaalsContact O-CA 3.3Å; F52-G56 WeakPolarHBondContact O-CA 3.32Å; F52-G56 PolarHBondContact O-N 3.15Å
53A87.1Confident86.5Confident45 Ų4598.1 Ų98.137%0.37248%0.483SS..Hα-helixtrans-68.9-41.8176.600000112.6R49 T50 L51 R57R49-A53 VanDerWaalsContact O-CB 3.26Å; R49-A53 WeakPolarHBondContact O-CB 3.38Å; R49-A53 PolarHBondContact O-N 3.34Å; T50-A53 PolarHBondContact O-N 3.33Å; L51-A53 PolarHBondContact O-N 3.16Å; A53-R57 VanDerWaalsContact O-CG 3.32Å; A53-R57 WeakPolarHBondContact O-CG 3.34Å; A53-R57 PolarHBondContact O-N 2.82Å; A53-R57 VanDerWaalsContact O-N 3.16Å
54V86Confident88.3Confident52 Ų5295 Ų9532%0.31547%0.47SS..Hα-helixtrans-67.9-55.9177.3173.90000110T50 L51 G56 R57 E58T50-V54 HydrophobicContact CG2-CG2 4.42Å; T50-V54 WeakPolarHBondContact O-CG2 3.46Å; T50-V54 PolarHBondContact O-N 3.07Å; L51-V54 PolarHBondContact O-N 2.91Å; V54-G56 VanDerWaalsContact C-N 3.28Å; V54-G56 PolarHBondContact O-N 3.33Å; V54-R57 WeakPolarHBondContact O-CB 3.25Å; V54-R57 PolarHBondContact O-N 3.08Å; V54-R57 VanDerWaalsContact O-N 3.07Å; V54-E58 PolarHBondContact O-N 2.9Å; V54-E58 VanDerWaalsContact O-N 3.08Å
55T88.5Confident89.3Confident38 Ų3898.9 Ų98.923%0.23348%0.478CS..Hα-helixtrans-62.1-37.6-179.9-53.80000111.4L51 R57 E58 I59L51-T55 WeakPolarHBondContact CD1-OG1 3.46Å; L51-T55 WeakPolarHBondContact O-CB 3.48Å; L51-T55 PolarHBondContact O-N 3.29Å; L51-T55 PolarHBondContact O-OG1 3.22Å; T55-R57 VanDerWaalsContact C-N 3.33Å; T55-R57 PolarHBondContact O-N 3.16Å; T55-E58 PolarHBondContact O-N 3.23Å; T55-I59 HydrophobicContact CG2-CD1 3.88Å; T55-I59 HydrophobicContact CG2-CG1 4.37Å; T55-I59 WeakPolarHBondContact O-CB 3.3Å; T55-I59 VanDerWaalsContact O-CG1 3.25Å; T55-I59 WeakPolarHBondContact O-CG1 3.49Å; T55-I59 PolarHBondContact O-N 3.04Å
56G91.1Very high90.1Very high36 Ų3698.5 Ų98.537%0.37148%0.479SS..Hα-helixtrans-62.1-37.7175.100000113.1F52 V54 L60F52-G56 VanDerWaalsContact O-CA 3.3Å; F52-G56 WeakPolarHBondContact O-CA 3.32Å; F52-G56 PolarHBondContact O-N 3.15Å; V54-G56 VanDerWaalsContact C-N 3.28Å; V54-G56 PolarHBondContact O-N 3.33Å; G56-L60 WeakPolarHBondContact O-CB 3.4Å; G56-L60 PolarHBondContact O-N 2.86Å
57R91.2Very high90.7Very high157 Ų15799.1 Ų99.159%0.59248%0.48SS*.Hα-helixtrans-67-44.8173.8-77-171.1-60.2-96.85.4111.8A53 V54 T55 L60 E61A53-R57 VanDerWaalsContact O-CG 3.32Å; A53-R57 WeakPolarHBondContact O-CG 3.34Å; A53-R57 PolarHBondContact O-N 2.82Å; A53-R57 VanDerWaalsContact O-N 3.16Å; V54-R57 WeakPolarHBondContact O-CB 3.25Å; V54-R57 PolarHBondContact O-N 3.08Å; V54-R57 VanDerWaalsContact O-N 3.07Å; T55-R57 VanDerWaalsContact C-N 3.33Å; T55-R57 PolarHBondContact O-N 3.16Å; R57-L60 PolarHBondContact O-N 3.4Å; R57-E61 WeakPolarHBondContact O-CB 3.35Å; R57-E61 PolarHBondContact O-N 3.4Å
58E91.9Very high91.6Very high90 Ų90103.3 Ų103.342%0.42149%0.489SS..Hα-helixtrans-62.6-42.5178.4-69.2173.2170.200112.3V54 T55 E61 T62V54-E58 PolarHBondContact O-N 2.9Å; V54-E58 VanDerWaalsContact O-N 3.08Å; T55-E58 PolarHBondContact O-N 3.23Å; E58-E61 PolarHBondContact O-N 3.46Å; E58-T62 WeakPolarHBondContact O-CB 3.49Å; E58-T62 PolarHBondContact O-N 3.05Å; E58-T62 PolarHBondContact O-OG1 2.89Å
59I94Very high92.3Very high109 Ų109103.7 Ų103.756%0.55949%0.491SS*.Hα-helixtrans-61.8-45174.3-70168.7000110.2T55 E61 T62 K63T55-I59 HydrophobicContact CG2-CD1 3.88Å; T55-I59 HydrophobicContact CG2-CG1 4.37Å; T55-I59 WeakPolarHBondContact O-CB 3.3Å; T55-I59 VanDerWaalsContact O-CG1 3.25Å; T55-I59 WeakPolarHBondContact O-CG1 3.49Å; T55-I59 PolarHBondContact O-N 3.04Å; I59-E61 PolarHBondContact O-N 2.87Å; I59-T62 PolarHBondContact O-N 3.49Å; I59-K63 WeakPolarHBondContact O-CB 3.34Å; I59-K63 PolarHBondContact O-N 2.87Å
60L94.5Very high92.9Very high77 Ų7799.3 Ų99.340%0.40348%0.481SS..Hα-helixtrans-64.2-40.7179.4-177.860.3000111.9G56 R57 K63 R64G56-L60 WeakPolarHBondContact O-CB 3.4Å; G56-L60 PolarHBondContact O-N 2.86Å; R57-L60 PolarHBondContact O-N 3.4Å; L60-K63 PolarHBondContact O-N 3.49Å; L60-R64 WeakPolarHBondContact O-CG 3.32Å; L60-R64 PolarHBondContact O-N 2.89Å
61E95.5Very high93.5Very high129 Ų12999.9 Ų99.960%0.60348%0.481SS*.Hα-helixtrans-64.5-46.9175.4-176.9168.4-171.800111.8R57 E58 I59 K63 R64 R65R57-E61 WeakPolarHBondContact O-CB 3.35Å; R57-E61 PolarHBondContact O-N 3.4Å; E58-E61 PolarHBondContact O-N 3.46Å; I59-E61 PolarHBondContact O-N 2.87Å; E61-K63 VanDerWaalsContact C-N 3.31Å; E61-K63 PolarHBondContact O-N 3.25Å; E61-R64 WeakPolarHBondContact O-CB 3.46Å; E61-R64 PolarHBondContact O-N 3.23Å; E61-R64 VanDerWaalsContact O-N 3.13Å; E61-R65 PolarHBondContact O-N 3.13Å
62T95.5Very high94.2Very high94 Ų94103.1 Ų103.158%0.57750%0.495SS*.Hα-helixtrans-58.1-44175.5-60.10000111.1E58 I59 R64 R65 L66E58-T62 WeakPolarHBondContact O-CB 3.49Å; E58-T62 PolarHBondContact O-N 3.05Å; E58-T62 PolarHBondContact O-OG1 2.89Å; I59-T62 PolarHBondContact O-N 3.49Å; T62-R64 PolarHBondContact O-N 3.38Å; T62-R65 PolarHBondContact O-N 3Å; T62-L66 WeakPolarHBondContact O-CB 3.33Å; T62-L66 PolarHBondContact O-N 3.37Å
63K96.9Very high94.8Very high151 Ų151101.1 Ų101.166%0.65749%0.491SS*.Hα-helixtrans-60.7-42.7174.9-177.4179.1178.9177.50112.3I59 L60 E61 L66 K67I59-K63 WeakPolarHBondContact O-CB 3.34Å; I59-K63 PolarHBondContact O-N 2.87Å; L60-K63 PolarHBondContact O-N 3.49Å; E61-K63 VanDerWaalsContact C-N 3.31Å; E61-K63 PolarHBondContact O-N 3.25Å; K63-L66 PolarHBondContact O-N 2.91Å; K63-K67 PolarHBondContact O-N 3.06Å
64R97.4Very high95.3Very high145 Ų145102.3 Ų102.355%0.54749%0.491SS..Hα-helixtrans-65.1-41.4176.2-73172.7-174.7162.8-0.2111.5L60 E61 T62 K67 R68L60-R64 WeakPolarHBondContact O-CG 3.32Å; L60-R64 PolarHBondContact O-N 2.89Å; E61-R64 WeakPolarHBondContact O-CB 3.46Å; E61-R64 PolarHBondContact O-N 3.23Å; E61-R64 VanDerWaalsContact O-N 3.13Å; T62-R64 PolarHBondContact O-N 3.38Å; R64-K67 PolarHBondContact O-N 2.86Å; R64-R68 PolarHBondContact O-N 3.45Å; R64-R68 VanDerWaalsContact O-N 3.12Å
65R97.7Very high95.9Very high167 Ų167106.2 Ų106.263%0.6351%0.505SS*.Hα-helixtrans-62-47.2175.9-176.6178.5178.7-177.8-0.9111.2E61 T62 K67 R68 I69E61-R65 PolarHBondContact O-N 3.13Å; T62-R65 PolarHBondContact O-N 3Å; R65-K67 VanDerWaalsContact C-N 3.32Å; R65-K67 PolarHBondContact O-N 3.01Å; R65-R68 PolarHBondContact O-N 2.95Å; R65-R68 VanDerWaalsContact O-N 3.17Å; R65-I69 HydrophobicContact CG-CD1 4.08Å; R65-I69 WeakPolarHBondContact O-CG1 3.32Å; R65-I69 PolarHBondContact O-N 3.36Å
66L98Very high96.3Very high109 Ų109111.1 Ų111.157%0.57152%0.521SS*.Hα-helixtrans-58.9-44.2176.5-177.761.4000111.3T62 K63 R68 I69 V70T62-L66 WeakPolarHBondContact O-CB 3.33Å; T62-L66 PolarHBondContact O-N 3.37Å; K63-L66 PolarHBondContact O-N 2.91Å; L66-R68 VanDerWaalsContact C-N 3.32Å; L66-R68 PolarHBondContact O-N 3.3Å; L66-I69 PolarHBondContact O-N 3.17Å; L66-V70 HydrophobicContact CD1-CG2 4.37Å; L66-V70 WeakPolarHBondContact O-CG2 3.34Å; L66-V70 PolarHBondContact O-N 3.44Å
67K97.8Very high96.6Very high148 Ų148114.1 Ų114.164%0.64353%0.525SS*.Hα-helixtrans-58.1-41.9176.2-172.7178.1179.8-178.50112.4K63 R64 R65 V70 L71K63-K67 PolarHBondContact O-N 3.06Å; R64-K67 PolarHBondContact O-N 2.86Å; R65-K67 VanDerWaalsContact C-N 3.32Å; R65-K67 PolarHBondContact O-N 3.01Å; K67-V70 PolarHBondContact O-N 3.09Å; K67-L71 WeakPolarHBondContact O-CG 3.34Å; K67-L71 PolarHBondContact O-N 3.49Å; K67-L71 VanDerWaalsContact O-N 3.14Å
68R98Very high96.9Very high132 Ų132112.7 Ų112.750%0.49852%0.523SS..Hα-helixtrans-63.2-48176.4-71.9-172.2-65.3-100.12.8111.9R64 R65 L66 V70 L71 E72R64-R68 PolarHBondContact O-N 3.45Å; R64-R68 VanDerWaalsContact O-N 3.12Å; R65-R68 PolarHBondContact O-N 2.95Å; R65-R68 VanDerWaalsContact O-N 3.17Å; L66-R68 VanDerWaalsContact C-N 3.32Å; L66-R68 PolarHBondContact O-N 3.3Å; R68-V70 VanDerWaalsContact C-N 3.3Å; R68-V70 PolarHBondContact O-N 3.26Å; R68-L71 PolarHBondContact O-N 2.97Å; R68-L71 VanDerWaalsContact O-N 3.13Å; R68-E72 PolarHBondContact O-N 3.13Å
69I97.9Very high97.2Very high71 Ų71113.8 Ų113.836%0.36453%0.526SS..Hα-helixtrans-58.7-43.4178.5-66.3167.4000110.8R65 L66 L71 E72 L73R65-I69 HydrophobicContact CG-CD1 4.08Å; R65-I69 WeakPolarHBondContact O-CG1 3.32Å; R65-I69 PolarHBondContact O-N 3.36Å; L66-I69 PolarHBondContact O-N 3.17Å; I69-L71 VanDerWaalsContact C-N 3.34Å; I69-L71 PolarHBondContact O-N 3.42Å; I69-E72 PolarHBondContact O-N 3.12Å; I69-L73 HydrophobicContact CG2-CD1 4.13Å; I69-L73 HydrophobicContact CG2-CG 4.39Å; I69-L73 WeakPolarHBondContact O-CG 3.35Å; I69-L73 PolarHBondContact O-N 3.38Å
70V97.8Very high97.4Very high69 Ų69112.4 Ų112.442%0.41852%0.523SS..Hα-helixtrans-62.1-41.4177.8171.10000111.7L66 K67 R68 L73 I74L66-V70 HydrophobicContact CD1-CG2 4.37Å; L66-V70 WeakPolarHBondContact O-CG2 3.34Å; L66-V70 PolarHBondContact O-N 3.44Å; K67-V70 PolarHBondContact O-N 3.09Å; R68-V70 VanDerWaalsContact C-N 3.3Å; R68-V70 PolarHBondContact O-N 3.26Å; V70-L73 PolarHBondContact O-N 3.37Å; V70-I74 HydrophobicContact CG1-CD1 4.13Å; V70-I74 WeakPolarHBondContact O-CG1 3.44Å; V70-I74 PolarHBondContact O-N 3.14Å; V70-I74 VanDerWaalsContact O-N 3.09Å
71L98.1Very high97.5Very high93 Ų93114.9 Ų114.949%0.48753%0.53SS..Hα-helixtrans-64.8-43.7176.4-69.7172.3000111.8K67 R68 I69 L73 I74 E75K67-L71 WeakPolarHBondContact O-CG 3.34Å; K67-L71 PolarHBondContact O-N 3.49Å; K67-L71 VanDerWaalsContact O-N 3.14Å; R68-L71 PolarHBondContact O-N 2.97Å; R68-L71 VanDerWaalsContact O-N 3.13Å; I69-L71 VanDerWaalsContact C-N 3.34Å; I69-L71 PolarHBondContact O-N 3.42Å; L71-L73 VanDerWaalsContact C-N 3.33Å; L71-L73 PolarHBondContact O-N 3.44Å; L71-I74 PolarHBondContact O-N 3.33Å; L71-E75 PolarHBondContact O-N 2.88Å
72E97.9Very high97.4Very high102 Ų102117.2 Ų117.248%0.47753%0.533SS..Hα-helixtrans-59.3-43.2174.8-72.5173.3-162.900111.4R68 I69 I74 E75 Y76R68-E72 PolarHBondContact O-N 3.13Å; I69-E72 PolarHBondContact O-N 3.12Å; E72-I74 VanDerWaalsContact C-N 3.34Å; E72-I74 PolarHBondContact O-N 3.17Å; E72-E75 WeakPolarHBondContact O-CB 3.38Å; E72-E75 PolarHBondContact O-N 3.42Å; E72-E75 VanDerWaalsContact O-N 3.17Å; E72-Y76 HydrophobicContact CB-CE2 4.46Å; E72-Y76 WeakPolarHBondContact O-CD2 3.5Å; E72-Y76 PolarHBondContact O-N 2.88Å
73L98Very high97.4Very high110 Ų110117.9 Ų117.958%0.57653%0.531SS*.Hα-helixtrans-61.5-40.1177-72.9174.5000112.5I69 V70 L71 E75 Y76 E77I69-L73 HydrophobicContact CG2-CD1 4.13Å; I69-L73 HydrophobicContact CG2-CG 4.39Å; I69-L73 WeakPolarHBondContact O-CG 3.35Å; I69-L73 PolarHBondContact O-N 3.38Å; V70-L73 PolarHBondContact O-N 3.37Å; L71-L73 VanDerWaalsContact C-N 3.33Å; L71-L73 PolarHBondContact O-N 3.44Å; L73-E75 VanDerWaalsContact C-N 3.33Å; L73-E75 PolarHBondContact O-N 2.94Å; L73-Y76 PolarHBondContact O-N 3.13Å; L73-E77 WeakPolarHBondContact O-CB 3.45Å; L73-E77 PolarHBondContact O-N 3.05Å
74I98Very high97.3Very high70 Ų70118.3 Ų118.336%0.35953%0.529SS..Hα-helixtrans-63.4-40.6175.1-68.1164.7000110.7V70 L71 E72 E77 K78V70-I74 HydrophobicContact CG1-CD1 4.13Å; V70-I74 WeakPolarHBondContact O-CG1 3.44Å; V70-I74 PolarHBondContact O-N 3.14Å; V70-I74 VanDerWaalsContact O-N 3.09Å; L71-I74 PolarHBondContact O-N 3.33Å; E72-I74 VanDerWaalsContact C-N 3.34Å; E72-I74 PolarHBondContact O-N 3.17Å; I74-E77 PolarHBondContact O-N 3.5Å; I74-K78 WeakPolarHBondContact O-CG 3.12Å; I74-K78 PolarHBondContact O-N 3.42Å
75E97.7Very high97.1Very high133 Ų133114.1 Ų114.162%0.62153%0.525SS*.Hα-helixtrans-66.2-42.5176.2-71.2-178.3177.300112.3L71 E72 L73 E77 K78 K79L71-E75 PolarHBondContact O-N 2.88Å; E72-E75 WeakPolarHBondContact O-CB 3.38Å; E72-E75 PolarHBondContact O-N 3.42Å; E72-E75 VanDerWaalsContact O-N 3.17Å; L73-E75 VanDerWaalsContact C-N 3.33Å; L73-E75 PolarHBondContact O-N 2.94Å; E75-E77 VanDerWaalsContact C-N 3.35Å; E75-K78 PolarHBondContact O-N 2.66Å; E75-K79 PolarHBondContact O-N 3.43Å
76Y97.9Very high96.8Very high142 Ų142109.1 Ų109.156%0.55752%0.519SS*.Hα-helixtrans-60.4-43.8173.2-81.1-63.4000111.6E72 L73 K78 K79 V80E72-Y76 HydrophobicContact CB-CE2 4.46Å; E72-Y76 WeakPolarHBondContact O-CD2 3.5Å; E72-Y76 PolarHBondContact O-N 2.88Å; L73-Y76 PolarHBondContact O-N 3.13Å; Y76-K78 VanDerWaalsContact C-N 3.34Å; Y76-K78 PolarHBondContact O-N 3.43Å; Y76-K79 WeakPolarHBondContact O-CB 3.31Å; Y76-K79 PolarHBondContact O-N 2.86Å; Y76-K79 VanDerWaalsContact O-N 3.13Å; Y76-V80 WeakPolarHBondContact O-CG2 3.46Å; Y76-V80 PolarHBondContact O-N 3.36Å
77E97.5Very high96.5Very high99 Ų99109.7 Ų109.746%0.46352%0.523SS..Hα-helixtrans-59.2-45.6176.7-166.7-163.7158.300111.4L73 I74 E75 K79 V80 K81L73-E77 WeakPolarHBondContact O-CB 3.45Å; L73-E77 PolarHBondContact O-N 3.05Å; I74-E77 PolarHBondContact O-N 3.5Å; E75-E77 VanDerWaalsContact C-N 3.35Å; E77-K79 VanDerWaalsContact C-N 3.33Å; E77-K79 PolarHBondContact O-N 3.06Å; E77-V80 PolarHBondContact O-N 3.23Å; E77-K81 WeakPolarHBondContact O-CG 3.46Å; E77-K81 PolarHBondContact O-N 3.44Å; E77-K81 VanDerWaalsContact OE1-CE 3.31Å; E77-K81 WeakPolarHBondContact OE1-CE 3.37Å; E77-K81 IonicContact OE1-NZ 3.2Å; E77-K81 PolarHBondContact OE1-NZ 3.27Å
78K97.6Very high95.9Very high127 Ų127108.7 Ų108.755%0.55252%0.52SS*.Hα-helixtrans-61-40.2174.7-71.5174-178178.60111.9I74 E75 Y76 R82I74-K78 WeakPolarHBondContact O-CG 3.12Å; I74-K78 PolarHBondContact O-N 3.42Å; E75-K78 PolarHBondContact O-N 2.66Å; Y76-K78 VanDerWaalsContact C-N 3.34Å; Y76-K78 PolarHBondContact O-N 3.43Å; K78-R82 WeakPolarHBondContact O-CG 3.37Å; K78-R82 PolarHBondContact O-N 3.1Å; K78-R82 VanDerWaalsContact O-N 3.1Å
79K97.5Very high95.2Very high113 Ų113109 Ų10949%0.49153%0.527SS..Hα-helixtrans-64.6-45.4176.8-173.6178.9178.6-178.70111.3E75 Y76 E77 K81 R82 M83E75-K79 PolarHBondContact O-N 3.43Å; Y76-K79 WeakPolarHBondContact O-CB 3.31Å; Y76-K79 PolarHBondContact O-N 2.86Å; Y76-K79 VanDerWaalsContact O-N 3.13Å; E77-K79 VanDerWaalsContact C-N 3.33Å; E77-K79 PolarHBondContact O-N 3.06Å; K79-K81 PolarHBondContact O-N 2.86Å; K79-R82 PolarHBondContact O-N 2.99Å; K79-M83 HydrophobicContact CG-SD 4.24Å; K79-M83 WeakPolarHBondContact O-CG 3.46Å; K79-M83 PolarHBondContact O-N 3.48Å
80V97.1Very high93.9Very high79 Ų79107.9 Ų107.948%0.47953%0.533SS..Hα-helixtrans-62-43.1177.3171.30000111Y76 E77 R82 M83 R84Y76-V80 WeakPolarHBondContact O-CG2 3.46Å; Y76-V80 PolarHBondContact O-N 3.36Å; E77-V80 PolarHBondContact O-N 3.23Å; V80-R82 PolarHBondContact O-N 3.49Å; V80-M83 PolarHBondContact O-N 3.42Å; V80-R84 WeakPolarHBondContact O-CB 3.33Å; V80-R84 PolarHBondContact O-N 3.33Å
81K96.6Very high92.2Very high129 Ų129108.7 Ų108.756%0.56154%0.538SS*.Hα-helixtrans-59.3-44.5175.4-78.2172.7169.5166.90112.2E77 K79 R84 A85E77-K81 WeakPolarHBondContact O-CG 3.46Å; E77-K81 PolarHBondContact O-N 3.44Å; E77-K81 VanDerWaalsContact OE1-CE 3.31Å; E77-K81 WeakPolarHBondContact OE1-CE 3.37Å; E77-K81 IonicContact OE1-NZ 3.2Å; E77-K81 PolarHBondContact OE1-NZ 3.27Å; K79-K81 PolarHBondContact O-N 2.86Å; K81-R84 PolarHBondContact O-N 2.93Å; K81-A85 PolarHBondContact O-N 3.47Å
82R95.4Very high90.3Very high179 Ų179108.6 Ų108.668%0.67555%0.545SS*.Hα-helixtrans-63.7-45175.6-74.1-174-70.9165.3-4.1112.6K78 K79 V80 R84 A85 A86K78-R82 WeakPolarHBondContact O-CG 3.37Å; K78-R82 PolarHBondContact O-N 3.1Å; K78-R82 VanDerWaalsContact O-N 3.1Å; K79-R82 PolarHBondContact O-N 2.99Å; V80-R82 PolarHBondContact O-N 3.49Å; R82-R84 VanDerWaalsContact C-N 3.34Å; R82-R84 PolarHBondContact O-N 2.92Å; R82-A85 PolarHBondContact O-N 3.31Å; R82-A86 PolarHBondContact O-N 3.12Å
83M94.8Very high88.3Confident108 Ų108110.5 Ų110.553%0.53256%0.558SS.*Hα-helixtrans-62.8-41176.9-72178.164.900111.8K79 V80 A86 L87K79-M83 HydrophobicContact CG-SD 4.24Å; K79-M83 WeakPolarHBondContact O-CG 3.46Å; K79-M83 PolarHBondContact O-N 3.48Å; V80-M83 PolarHBondContact O-N 3.42Å; M83-A86 PolarHBondContact O-N 2.73Å; M83-L87 WeakPolarHBondContact O-CB 3.47Å; M83-L87 WeakPolarHBondContact O-CG 3.35Å; M83-L87 PolarHBondContact O-N 2.92Å
84R94.7Very high86.2Confident159 Ų159113.4 Ų113.460%0.657%0.568SS**Hα-helixtrans-62.5-43.2175.6-175.4-178.2-66.9-176-2111.7V80 K81 R82 L87 H88V80-R84 WeakPolarHBondContact O-CB 3.33Å; V80-R84 PolarHBondContact O-N 3.33Å; K81-R84 PolarHBondContact O-N 2.93Å; R82-R84 VanDerWaalsContact C-N 3.34Å; R82-R84 PolarHBondContact O-N 2.92Å; R84-L87 PolarHBondContact O-N 3.03Å; R84-H88 PolarHBondContact O-CD2 2.94Å; R84-H88 PolarHBondContact O-N 2.96Å
85A92.9Very high84.2Confident58 Ų58118.8 Ų118.848%0.47959%0.592SS.*Hα-helixtrans-61.9-46.9176.100000111.7K81 R82 L87 H88 E89K81-A85 PolarHBondContact O-N 3.47Å; R82-A85 PolarHBondContact O-N 3.31Å; A85-L87 VanDerWaalsContact C-N 3.32Å; A85-L87 PolarHBondContact O-N 3.17Å; A85-H88 PolarHBondContact O-N 3.39Å; A85-H88 VanDerWaalsContact O-N 3.17Å; A85-E89 PolarHBondContact O-N 3.4Å
86A91.7Very high81.9Confident61 Ų61115.5 Ų115.550%0.50459%0.594SS.*Hα-helixtrans-62.3-37177.400000112.9R82 M83 G90R82-A86 PolarHBondContact O-N 3.12Å; M83-A86 PolarHBondContact O-N 2.73Å; A86-G90 PolarHBondContact O-N 2.97Å
87L90.8Very high79.4Confident122 Ų122117.8 Ų117.864%0.63961%0.609SS**Hα-helixtrans-67.4-39.9173.8-75.8168.1000112.2M83 R84 A85 T91M83-L87 WeakPolarHBondContact O-CB 3.47Å; M83-L87 WeakPolarHBondContact O-CG 3.35Å; M83-L87 PolarHBondContact O-N 2.92Å; R84-L87 PolarHBondContact O-N 3.03Å; A85-L87 VanDerWaalsContact C-N 3.32Å; A85-L87 PolarHBondContact O-N 3.17Å; L87-T91 WeakPolarHBondContact O-CB 3.42Å; L87-T91 WeakPolarHBondContact O-CG2 3.36Å; L87-T91 PolarHBondContact O-N 2.98Å; L87-T91 PolarHBondContact O-OG1 3.48Å
88H86.7Confident77.4Confident127 Ų127121.5 Ų121.559%0.58863%0.627SS**Hα-helixtrans-67-38175.3-82.9-49.9000112.6R84 A85 T91 S92R84-H88 PolarHBondContact O-CD2 2.94Å; R84-H88 PolarHBondContact O-N 2.96Å; A85-H88 PolarHBondContact O-N 3.39Å; A85-H88 VanDerWaalsContact O-N 3.17Å; H88-T91 WeakPolarHBondContact CA-OG1 3.34Å; H88-T91 PolarHBondContact O-OG1 3.42Å; H88-T91 VanDerWaalsContact O-OG1 3.12Å; H88-S92 WeakPolarHBondContact O-CB 3.4Å; H88-S92 PolarHBondContact O-N 3.4Å
89E81.5Confident75Confident138 Ų138121 Ų12165%0.64564%0.636SS**Hα-helixtrans-67.8-44174.8-171.1173.8-169.100111.7A85 T91 S92 L93A85-E89 PolarHBondContact O-N 3.4Å; E89-T91 VanDerWaalsContact C-N 3.31Å; E89-T91 PolarHBondContact O-N 3.3Å; E89-S92 PolarHBondContact O-N 3.23Å; E89-L93 PolarHBondContact O-N 3.4Å
90G72.2Confident72.6Confident47 Ų47121.3 Ų121.349%0.48565%0.652SS.*Hα-helixtrans-67.2-27.4176.900000114.3A86A86-G90 PolarHBondContact O-N 2.97Å
91T60.7Low70.1Confident86 Ų86122.1 Ų122.153%0.52867%0.667SS.*Hα-helixtrans-83-25.4173.746.80000112.7L87 H88 E89 L93L87-T91 WeakPolarHBondContact O-CB 3.42Å; L87-T91 WeakPolarHBondContact O-CG2 3.36Å; L87-T91 PolarHBondContact O-N 2.98Å; L87-T91 PolarHBondContact O-OG1 3.48Å; H88-T91 WeakPolarHBondContact CA-OG1 3.34Å; H88-T91 PolarHBondContact O-OG1 3.42Å; H88-T91 VanDerWaalsContact O-OG1 3.12Å; E89-T91 VanDerWaalsContact C-N 3.31Å; E89-T91 PolarHBondContact O-N 3.3Å; T91-L93 VanDerWaalsContact C-N 3.32Å; T91-L93 PolarHBondContact O-N 2.93Å
92S58.2Low67.9Low91 Ų91125.6 Ų125.664%0.63668%0.677SS**Hα-helixtrans-76-16.2177.6-169.90000114H88 E89 E94H88-S92 WeakPolarHBondContact O-CB 3.4Å; H88-S92 PolarHBondContact O-N 3.4Å; E89-S92 PolarHBondContact O-N 3.23Å; S92-E94 VanDerWaalsContact C-N 3.35Å
93L56.8Low65.8Low142 Ų142123.2 Ų123.274%0.74369%0.685SS**THydrogen-bonded Turntrans-82.2-5.9-179.1-93.1157.8000114.5E89 T91E89-L93 PolarHBondContact O-N 3.4Å; T91-L93 VanDerWaalsContact C-N 3.32Å; T91-L93 PolarHBondContact O-N 2.93Å
94E54.7Low63.9Low171 Ų171123.6 Ų123.680%0.79969%0.693SS**THydrogen-bonded Turntrans-106.7-1.3-179.8-72.9-100.8145.500113.9S92S92-E94 VanDerWaalsContact C-N 3.35Å
95E54.3Low61.7Low184 Ų184124 Ų12486%0.8671%0.708SS**SBendtrans-103.815.2-177.5-71.1-166.3156.600115.1
96G49.9Very low59.8Low63 Ų63125.6 Ų125.665%0.64972%0.721SS**SBendtrans-140.760.2-169.900000117
97E45.4Very low58.1Low190 Ų190126.9 Ų126.989%0.88873%0.731SS**  trans167.779.5141.8-98175.815800110.4P99E97-P99 WeakPolarHBondContact O-CD 3.36Å
98H55.7Low56.3Low178 Ų178127.5 Ų127.582%0.82474%0.735SS**  trans-78.5116.7155.5-76.7-70.3000107.8S100H98-S100 PolarHBondContact O-N 3.08Å; H98-S100 VanDerWaalsContact O-N 3.08Å
99P48Very low54.6Low116 Ų116127.9 Ų127.975%0.75374%0.741SS**  trans-65.2116.4172.326.7-30.8000107.2E97 A101E97-P99 WeakPolarHBondContact O-CD 3.36Å; P99-A101 VanDerWaalsContact C-N 3.26Å; P99-A101 PolarHBondContact O-N 2.99Å
100S47Very low53.3Low119 Ų119126.5 Ų126.583%0.83275%0.747SS**  trans-63.192.6172.4-165.40000108.3H98 R102H98-S100 PolarHBondContact O-N 3.08Å; H98-S100 VanDerWaalsContact O-N 3.08Å; S100-R102 PolarHBondContact O-N 2.79Å
101A44.4Very low52.1Low96 Ų96130.5 Ų130.579%0.79376%0.762SS**  trans-68.994.2172.600000108.3P99P99-A101 VanDerWaalsContact C-N 3.26Å; P99-A101 PolarHBondContact O-N 2.99Å
102R50.9Low51.6Low203 Ų203132.2 Ų132.277%0.76678%0.777SS**  trans-104.1103.8164.7-153.1179.6-168.5-174.72.6107.6S100 T104S100-R102 PolarHBondContact O-N 2.79Å; R102-T104 PolarHBondContact O-N 3.08Å; R102-T104 VanDerWaalsContact O-N 3.08Å
103P49.5Very low50.9Low128 Ų128134.1 Ų134.183%0.83179%0.785SS**  trans-77.894.3168.330.4-26.4000106.8
104T55.5Low50.8Low116 Ų116133.2 Ų133.271%0.71279%0.791SS**  trans-88.2105.9165.81.50000107.8R102 A106R102-T104 PolarHBondContact O-N 3.08Å; R102-T104 VanDerWaalsContact O-N 3.08Å; T104-A106 PolarHBondContact O-N 3.2Å
105D48.1Very low50.6Low169 Ų169131.4 Ų131.490%0.90479%0.791SS**  trans-57.4107.3169.7-154.40.7000109
106A54.1Low50.7Low91 Ų91133.1 Ų133.175%0.75279%0.789SS**  trans-150.8114.3169.400000108.9T104T104-A106 PolarHBondContact O-N 3.2Å
107A55.4Low50.9Low87 Ų87138.8 Ų138.872%0.71980%0.796SS**  trans-59.2161179.700000113.9
108D52.2Low51.6Low136 Ų136137.4 Ų137.473%0.72779%0.79SS**  trans73.6100.6148-83.5-3.7000119.5
109N52.1Low51.2Low134 Ų134140.9 Ų140.972%0.71780%0.795SS**  111.8117.5119.2-64.6-22.8000118.9
110S54.4Low51.5Low110 Ų110138.5 Ų138.577%0.76979%0.792SS**  trans91.194.1138.1-58.10000119.2
111V47.3Very low52Low131 Ų131140.8 Ų140.879%0.79480%0.795SS**  trans4.1119.7132.6-1770000116.3
112S49.7Very low52.3Low122 Ų122144.9 Ų144.985%0.85380%0.798SS**  trans-157.5119.8131-89.20000111.5
113T43.6Very low52.4Low130 Ų130139.9 Ų139.980%0.79879%0.791SS**  trans-64.5133170.450.30000110.6
114S54.6Low52.9Low123 Ų123141.1 Ų141.186%0.8679%0.79SS**  trans-148.296.9156-143.10000110.4
115V51.1Low52.9Low133 Ų133141.2 Ų141.281%0.80679%0.793SS**  trans-74.8117.7168.6177.50000107.3
116R56.8Low53.2Low220 Ų220136.8 Ų136.883%0.8379%0.787SS**  trans-129.4112.3161.7-154.8173.7-159155.56.3110
117K54.1Low52.7Low183 Ų183140.2 Ų140.280%0.79679%0.793SS**  trans-78.5131.4171.5-66.3-160.3176.4-168.60110.4
118H59.9Low52.9Low161 Ų161142.1 Ų142.175%0.74580%0.801SS**  trans-146.3102.3152-76.9-78.3000103.3
119R47.6Very low52.5Low250 Ų250140.5 Ų140.594%0.94381%0.806SS**  50.6108.263.5-152.6177.4-159.6175.76113.4
120G53.8Low52.9Low66 Ų66138.3 Ų138.368%0.6881%0.807SS**  trans140.275.117600000108.6
121D56.1Low53Low168 Ų168140.6 Ų140.690%0.89881%0.81SS**  78.593.297.2-82.2-8.8000112.6
122E51.5Low53.7Low182 Ų182141.6 Ų141.685%0.8581%0.811SS**  trans-98.5168.7144-102.1-166.3169.200107.5
123P52.1Low54Low97 Ų97141 Ų14163%0.6381%0.805SS**  cis-134175.2-1.424.62.1000111.6
124L61.5Low54.7Low154 Ų154143.6 Ų143.681%0.80681%0.808SS**  170.3155.581.7-82.9171.3000108.7
125P55.9Low54.9Low118 Ų118144.9 Ų144.977%0.76681%0.811SS**  trans-78124.5176.231.6-31.1000111.2N127P125-N127 PolarHBondContact O-N 3.34Å
126G52.5Low55Low77 Ų77146.3 Ų146.379%0.79481%0.814SS**  trans-81.3101.9172.800000111.4
127N45.5Very low54.7Low163 Ų163147.1 Ų147.187%0.87284%0.835SS**  trans-73.2116.8157.9-87.7-7.8000108.8P125P125-N127 PolarHBondContact O-N 3.34Å
128S58.2Low54.7Low127 Ų127145.3 Ų145.389%0.88884%0.836SS**  trans-112.892.3161.2-68.90000108.8
129A45.1Very low54.5Low101 Ų101144.5 Ų144.584%0.83584%0.841SS**  trans-94.2124.2154.100000107.6
130A60.3Low54.8Low88 Ų88138.6 Ų138.673%0.72784%0.836SS**  trans-164.599.4157.400000104.3
131D56.2Low54.9Low158 Ų158142.9 Ų142.985%0.84585%0.845SS**  53.1101.794.3-73.5-31.2000111.6
132D60.8Low54.8Low152 Ų152141.3 Ų141.381%0.81384%0.841SS**  171.9129.496-138.5-13.9000110.5
133P57.8Low55Low111 Ų111138.6 Ų138.672%0.72184%0.841SS**  trans-108.6109.2171.434.5-20.3000110.5
134E58.1Low55.2Low183 Ų183141.6 Ų141.686%0.85586%0.856SS**  trans-165.5121.8158.8-115.2173.5-162.500111.1
135T59.2Low54.8Low151 Ų151140.6 Ų140.693%0.92686%0.86SS**  trans-168.2106.6140.212.80000108.8
136D52.9Low54.7Low162 Ų162142.5 Ų142.587%0.86687%0.867SS**  trans-86.5118.3165-156.59.3000107
137N49.6Very low54.9Low237 Ų237148.5 Ų148.5100%1.26787%0.874SS**  trans-170.80157.1-114.7-0000110.3

Retrieved 137 of 137 residues in 27.6 ms (Link to these results)