A0A077ZEZ9_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZEZ9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 170 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
1M42Very low57.8Low241 Ų241128.7 Ų128.7100%1.18765%0.65SS**  0124.30-79.6172.5156.900108.1
2H43Very low58.7Low160 Ų160124.9 Ų124.974%0.74164%0.638SS**  trans-71.1144.6-172.3-90.1-64.4000112.4K4 F5H2-K4 PolarHBondContact O-N 2.89Å; H2-K4 VanDerWaalsContact O-N 3.08Å; H2-F5 PolarHBondContact O-N 2.8Å; H2-F5 VanDerWaalsContact O-N 3.12Å
3P57.3Low59.2Low100 Ų100123.2 Ų123.265%0.64963%0.63SS**Hα-helixtrans-61.7-21.2-174.224-34.6000114.4F5 V6 S7P3-F5 PolarHBondContact O-N 2.93Å; P3-V6 PolarHBondContact O-N 2.84Å; P3-S7 PolarHBondContact O-N 3.26Å
4K55.5Low59.8Low165 Ų165120.4 Ų120.472%0.71763%0.625SS**Hα-helixtrans-62.1-30176.5-64.6-175.8178.5179.30113H2 S7 I8H2-K4 PolarHBondContact O-N 2.89Å; H2-K4 VanDerWaalsContact O-N 3.08Å; K4-S7 PolarHBondContact O-OG 3.04Å; K4-I8 WeakPolarHBondContact O-CD1 3.31Å; K4-I8 VanDerWaalsContact O-CG1 3.31Å; K4-I8 WeakPolarHBondContact O-CG1 3.44Å; K4-I8 PolarHBondContact O-N 3.19Å
5F52.2Low60Low150 Ų150115.7 Ų115.766%0.65861%0.611SS**Hα-helixtrans-71.2-39.7178.6-121.7-89.6000111.4H2 P3 S7 I8 E9H2-F5 PolarHBondContact O-N 2.8Å; H2-F5 VanDerWaalsContact O-N 3.12Å; P3-F5 PolarHBondContact O-N 2.93Å; F5-S7 PolarHBondContact O-N 2.91Å; F5-I8 PolarHBondContact O-N 3.08Å; F5-E9 PolarHBondContact O-N 2.69Å; F5-E9 VanDerWaalsContact O-N 3.13Å
6V57.7Low60.1Low95 Ų95115.7 Ų115.758%0.57661%0.609SS**Hα-helixtrans-66.3-39.6179.7-177.40000111.4P3 I8 E9 M10P3-V6 PolarHBondContact O-N 2.84Å; V6-I8 VanDerWaalsContact C-N 3.35Å; V6-I8 PolarHBondContact O-N 3.12Å; V6-E9 PolarHBondContact O-N 3.22Å; V6-M10 WeakPolarHBondContact O-CG 3.43Å; V6-M10 PolarHBondContact O-N 3.22Å
7S62.2Low60Low60 Ų60113.2 Ų113.242%0.4260%0.602SS.*Hα-helixtrans-65.8-36.8176.752.70000112.7P3 K4 F5 I11P3-S7 PolarHBondContact O-N 3.26Å; K4-S7 PolarHBondContact O-OG 3.04Å; F5-S7 PolarHBondContact O-N 2.91Å; S7-I11 WeakPolarHBondContact O-CD1 3.21Å; S7-I11 WeakPolarHBondContact O-CG1 3.46Å; S7-I11 PolarHBondContact O-N 3.34Å
8I68.5Low60.1Low100 Ų100110.2 Ų110.251%0.51360%0.596SS.*Hα-helixtrans-67.6-43.4178.4-68166.2000110K4 F5 V6 M10 I11 V12K4-I8 WeakPolarHBondContact O-CD1 3.31Å; K4-I8 VanDerWaalsContact O-CG1 3.31Å; K4-I8 WeakPolarHBondContact O-CG1 3.44Å; K4-I8 PolarHBondContact O-N 3.19Å; F5-I8 PolarHBondContact O-N 3.08Å; V6-I8 VanDerWaalsContact C-N 3.35Å; V6-I8 PolarHBondContact O-N 3.12Å; I8-M10 PolarHBondContact O-N 2.89Å; I8-I11 PolarHBondContact O-N 2.91Å; I8-V12 HydrophobicContact CG2-CG2 4.37Å; I8-V12 VanDerWaalsContact O-CG2 3.29Å; I8-V12 WeakPolarHBondContact O-CG2 3.46Å; I8-V12 PolarHBondContact O-N 3.26Å
9E60.5Low60Low121 Ų121108.6 Ų108.657%0.56559%0.59SS**Hα-helixtrans-64.9-39.2177.7-66.6-148.916900112.7F5 V6 I11 V12 L13F5-E9 PolarHBondContact O-N 2.69Å; F5-E9 VanDerWaalsContact O-N 3.13Å; V6-E9 PolarHBondContact O-N 3.22Å; E9-I11 PolarHBondContact O-N 3.3Å; E9-V12 PolarHBondContact O-N 3.31Å; E9-L13 WeakPolarHBondContact O-CB 3.2Å; E9-L13 PolarHBondContact O-N 3.33Å
10M66.6Low59.5Low106 Ų106107.2 Ų107.252%0.52258%0.581SS.*Hα-helixtrans-63.3-40.1174.4-76.5-64.8-64.300112.5V6 I8 L13 C14V6-M10 WeakPolarHBondContact O-CG 3.43Å; V6-M10 PolarHBondContact O-N 3.22Å; I8-M10 PolarHBondContact O-N 2.89Å; M10-L13 PolarHBondContact O-N 3.16Å; M10-C14 WeakPolarHBondContact O-CB 3.29Å; M10-C14 PolarHBondContact O-N 2.93Å
11I69.9Low59.2Low118 Ų118112.2 Ų112.261%0.60559%0.592SS**Hα-helixtrans-66.8-41.8176.7-67.8163.8000110.5S7 I8 E9 C14 A15S7-I11 WeakPolarHBondContact O-CD1 3.21Å; S7-I11 WeakPolarHBondContact O-CG1 3.46Å; S7-I11 PolarHBondContact O-N 3.34Å; I8-I11 PolarHBondContact O-N 2.91Å; E9-I11 PolarHBondContact O-N 3.3Å; I11-C14 PolarHBondContact O-N 3.45Å; I11-A15 WeakPolarHBondContact O-CB 3.31Å; I11-A15 PolarHBondContact O-N 3.48Å
12V68.7Low59.8Low83 Ų83105 Ų10550%0.50357%0.565SS.*Hα-helixtrans-64.4-41.7176.91730000111.1I8 E9 A15 M16I8-V12 HydrophobicContact CG2-CG2 4.37Å; I8-V12 VanDerWaalsContact O-CG2 3.29Å; I8-V12 WeakPolarHBondContact O-CG2 3.46Å; I8-V12 PolarHBondContact O-N 3.26Å; E9-V12 PolarHBondContact O-N 3.31Å; V12-A15 PolarHBondContact O-N 3.27Å; V12-M16 HydrophobicContact CG1-CG 4.43Å; V12-M16 WeakPolarHBondContact O-CB 3.45Å; V12-M16 WeakPolarHBondContact O-CG 3.39Å; V12-M16 PolarHBondContact O-N 3.29Å
13L65.7Low60Low103 Ų103103.4 Ų103.454%0.53956%0.562SS.*Hα-helixtrans-63.7-43.6175.7-118.3119.6000111.8E9 M10 M16 C17E9-L13 WeakPolarHBondContact O-CB 3.2Å; E9-L13 PolarHBondContact O-N 3.33Å; M10-L13 PolarHBondContact O-N 3.16Å; L13-M16 PolarHBondContact O-N 3.04Å; L13-C17 WeakPolarHBondContact O-CB 3.34Å; L13-C17 PolarHBondContact O-N 3.06Å; L13-C17 PolarHBondContact O-SG 3.22Å; L13-C17 VanDerWaalsContact O-SG 3.36Å
14C67.5Low59.3Low83 Ų83101.5 Ų101.556%0.56156%0.561SS**Hα-helixtrans-63.6-40.9175.5-81.50000112.4M10 I11 C17 A18M10-C14 WeakPolarHBondContact O-CB 3.29Å; M10-C14 PolarHBondContact O-N 2.93Å; I11-C14 PolarHBondContact O-N 3.45Å; C14-C17 PolarHBondContact O-N 3.13Å; C14-A18 WeakPolarHBondContact O-CB 3.28Å; C14-A18 PolarHBondContact O-N 3.21Å
15A62.9Low58.4Low50 Ų5099.6 Ų99.641%0.41356%0.558SS.*Hα-helixtrans-66.3-43.2177.200000111.6I11 V12 A18 V19I11-A15 WeakPolarHBondContact O-CB 3.31Å; I11-A15 PolarHBondContact O-N 3.48Å; V12-A15 PolarHBondContact O-N 3.27Å; A15-A18 PolarHBondContact O-N 3.47Å; A15-V19 WeakPolarHBondContact O-CG2 3.27Å; A15-V19 PolarHBondContact O-N 3.49Å
16M61.7Low57.7Low116 Ų116101.2 Ų101.257%0.57157%0.567SS**Hα-helixtrans-63.9-41.9175.4-74.7-66.9-74.900111.7V12 L13 A18 V19 L20V12-M16 HydrophobicContact CG1-CG 4.43Å; V12-M16 WeakPolarHBondContact O-CB 3.45Å; V12-M16 WeakPolarHBondContact O-CG 3.39Å; V12-M16 PolarHBondContact O-N 3.29Å; L13-M16 PolarHBondContact O-N 3.04Å; M16-A18 VanDerWaalsContact C-N 3.3Å; M16-A18 PolarHBondContact O-N 3.34Å; M16-V19 PolarHBondContact O-N 3.14Å; M16-L20 WeakPolarHBondContact O-CB 3.5Å; M16-L20 PolarHBondContact O-N 3.32Å
17C58.8Low56.9Low74 Ų74100 Ų10050%0.556%0.563SS.*Hα-helixtrans-63.8-34.9174.5-75.10000112.7L13 C14 R21L13-C17 WeakPolarHBondContact O-CB 3.34Å; L13-C17 PolarHBondContact O-N 3.06Å; L13-C17 PolarHBondContact O-SG 3.22Å; L13-C17 VanDerWaalsContact O-SG 3.36Å; C14-C17 PolarHBondContact O-N 3.13Å; C17-R21 WeakPolarHBondContact O-CB 3.49Å; C17-R21 PolarHBondContact O-N 3.5Å; C17-R21 VanDerWaalsContact O-N 3.1Å
18A61.8Low55.9Low59 Ų59102 Ų10249%0.48857%0.574SS.*Hα-helixtrans-69.8-44176.100000111.8C14 A15 M16 R21 S22C14-A18 WeakPolarHBondContact O-CB 3.28Å; C14-A18 PolarHBondContact O-N 3.21Å; A15-A18 PolarHBondContact O-N 3.47Å; M16-A18 VanDerWaalsContact C-N 3.3Å; M16-A18 PolarHBondContact O-N 3.34Å; A18-R21 PolarHBondContact O-N 2.98Å; A18-S22 PolarHBondContact O-N 3.44Å
19V57.5Low54.7Low80 Ų80102.6 Ų102.649%0.48558%0.584SS.*Hα-helixtrans-68-36.6177.2175.70000111.7A15 M16 S22 N23A15-V19 WeakPolarHBondContact O-CG2 3.27Å; A15-V19 PolarHBondContact O-N 3.49Å; M16-V19 PolarHBondContact O-N 3.14Å; V19-S22 PolarHBondContact O-N 3.21Å; V19-S22 PolarHBondContact O-OG 2.79Å; V19-N23 PolarHBondContact O-N 3.12Å
20L50.9Low53.8Low79 Ų79100.6 Ų100.641%0.41458%0.584SS.*Hα-helixtrans-65.3-39.5173.8-120.975.9000111.7M16 N23M16-L20 WeakPolarHBondContact O-CB 3.5Å; M16-L20 PolarHBondContact O-N 3.32Å; L20-N23 PolarHBondContact O-N 2.8Å
21R51.8Low52.7Low214 Ų21498.2 Ų98.281%0.80859%0.587SS**Hα-helixtrans-67-35.8176.2-88-176.9171.2170.5-1.2112.7C17 A18 N23 G24C17-R21 WeakPolarHBondContact O-CB 3.49Å; C17-R21 PolarHBondContact O-N 3.5Å; C17-R21 VanDerWaalsContact O-N 3.1Å; A18-R21 PolarHBondContact O-N 2.98Å; R21-N23 VanDerWaalsContact C-N 3.3Å; R21-N23 PolarHBondContact O-N 3.01Å; R21-G24 PolarHBondContact O-N 3.37Å
22S54.6Low51.6Low89 Ų8996.6 Ų96.662%0.62258%0.584SS**Hα-helixtrans-70.2-27.2177.962.20000113A18 V19 G24A18-S22 PolarHBondContact O-N 3.44Å; V19-S22 PolarHBondContact O-N 3.21Å; V19-S22 PolarHBondContact O-OG 2.79Å; S22-G24 VanDerWaalsContact C-N 3.27Å; S22-G24 PolarHBondContact O-N 2.86Å
23N47.9Very low50.3Low126 Ų12695.8 Ų95.867%0.67459%0.586SS**THydrogen-bonded Turntrans-88.514.9177.1-72.3-14.5000113.9V19 L20 R21 L25V19-N23 PolarHBondContact O-N 3.12Å; L20-N23 PolarHBondContact O-N 2.8Å; R21-N23 VanDerWaalsContact C-N 3.3Å; R21-N23 PolarHBondContact O-N 3.01Å; N23-L25 PolarHBondContact O-N 2.87Å
24G41.6Very low49.4Very low60 Ų6096.1 Ų96.162%0.61959%0.587SS**THydrogen-bonded Turntrans667.1170.200000115.1R21 S22 H26R21-G24 PolarHBondContact O-N 3.37Å; S22-G24 VanDerWaalsContact C-N 3.27Å; S22-G24 PolarHBondContact O-N 2.86Å; G24-H26 VanDerWaalsContact C-N 3.33Å; G24-H26 PolarHBondContact O-N 2.97Å
25L36.5Very low48.3Very low125 Ų12598.7 Ų98.765%0.65459%0.591SS**  trans-83.584.1177.3-136.179.7000108.6N23 S27N23-L25 PolarHBondContact O-N 2.87Å; L25-S27 PolarHBondContact O-N 3.46Å
26H39.2Very low47.4Very low184 Ų184102.6 Ų102.685%0.85260%0.601SS**  trans-65.869.2163.9-102.8-83.9000109.3G24 P28G24-H26 VanDerWaalsContact C-N 3.33Å; G24-H26 PolarHBondContact O-N 2.97Å; H26-P28 VanDerWaalsContact O-CD 3.28Å; H26-P28 WeakPolarHBondContact O-CD 3.49Å
27S39.8Very low46.9Very low70 Ų70104.3 Ų104.349%0.4961%0.605SS.*  trans-74.1114.2159.2540000106.6L25L25-S27 PolarHBondContact O-N 3.46Å
28P41.1Very low46.1Very low102 Ų102105 Ų10566%0.66260%0.604SS**  trans-55.6147.9170.825.9-33000107.9H26 S30H26-P28 VanDerWaalsContact O-CD 3.28Å; H26-P28 WeakPolarHBondContact O-CD 3.49Å; P28-S30 VanDerWaalsContact C-N 3.26Å; P28-S30 PolarHBondContact O-N 3.49Å
29P44.4Very low45.3Very low112 Ų112109.4 Ų109.473%0.72761%0.608SS**  trans-58.199.5175.225.6-32.4000106.8G31P29-G31 PolarHBondContact O-N 3.43Å
30S40.2Very low44.9Very low79 Ų79109.7 Ų109.755%0.55261%0.611SS**  trans-60.5129.1175.644.10000105.1P28 P32 A33P28-S30 VanDerWaalsContact C-N 3.26Å; P28-S30 PolarHBondContact O-N 3.49Å; S30-P32 WeakPolarHBondContact O-CD 3.48Å; S30-A33 PolarHBondContact O-N 2.88Å
31G44.7Very low44.9Very low57 Ų57112.9 Ų112.959%0.58862%0.622SS**THydrogen-bonded Turntrans-51.1-19.2-177.100000117.4P29 A33P29-G31 PolarHBondContact O-N 3.43Å; G31-A33 PolarHBondContact O-N 2.92Å
32P45.6Very low44.6Very low83 Ų83107.6 Ų107.654%0.53961%0.607SS.*Hα-helixtrans-72.4-26.3179.44.74000114.1S30 I34 Q35 E36S30-P32 WeakPolarHBondContact O-CD 3.48Å; P32-I34 PolarHBondContact O-N 3.23Å; P32-Q35 PolarHBondContact O-N 3.35Å; P32-E36 PolarHBondContact O-N 2.89Å
33A42.9Very low43.9Very low67 Ų67109.4 Ų109.455%0.55461%0.609SS**Hα-helixtrans-70.7-34.2-176.700000112.9S30 G31 Q35S30-A33 PolarHBondContact O-N 2.88Å; G31-A33 PolarHBondContact O-N 2.92Å; A33-Q35 VanDerWaalsContact C-N 3.3Å
34I45.7Very low44Very low109 Ų109113.5 Ų113.556%0.55962%0.615SS**Hα-helixtrans-74.1-26.6175.7-57.4176.6000110.6P32P32-I34 PolarHBondContact O-N 3.23Å
35Q43.9Very low44.3Very low137 Ų137117 Ų11764%0.6462%0.619SS**Hα-helixtrans-75.9-33.6179.6-159.6174.252.100112.6P32 A33P32-Q35 PolarHBondContact O-N 3.35Å; A33-Q35 VanDerWaalsContact C-N 3.3Å
36E45Very low44.7Very low132 Ų132118.9 Ų118.962%0.61762%0.619SS**Hα-helixtrans-72.5-31.6175.7-84.4-171.8151.900113.5P32 N38 R39 P40P32-E36 PolarHBondContact O-N 2.89Å; E36-N38 VanDerWaalsContact C-N 3.26Å; E36-N38 PolarHBondContact O-N 3Å; E36-R39 PolarHBondContact O-N 3.26Å; E36-P40 WeakPolarHBondContact O-CD 3.45Å
37F51.3Low45Very low153 Ų153119.3 Ų119.367%0.67162%0.618SS**Hα-helixtrans-67.6-26.6179-146.1-92.8000113
38N40.7Very low45.4Very low87 Ų87126.5 Ų126.547%0.46564%0.635SS.*Hα-helixtrans-88.9-18.1178.5-76.1-37.7000114.4E36 F41 E42E36-N38 VanDerWaalsContact C-N 3.26Å; E36-N38 PolarHBondContact O-N 3Å; N38-F41 PolarHBondContact O-N 2.91Å; N38-F41 VanDerWaalsContact O-N 3.11Å; N38-E42 PolarHBondContact O-N 3.22Å; N38-E42 VanDerWaalsContact O-N 3.15Å
39R45.1Very low45.5Very low153 Ų153130.3 Ų130.358%0.57764%0.643SS**Hα-helixtrans-56.1-41.2-179.6-99.7-177.3171.1164.8-1.2115.5E36 F41E36-R39 PolarHBondContact O-N 3.26Å; R39-F41 VanDerWaalsContact C-N 3.28Å; R39-F41 PolarHBondContact O-N 3.17Å
40P49.6Very low46Very low85 Ų85129.7 Ų129.755%0.55264%0.638SS**Hα-helixtrans-71.5-22.917924.9-31000113.1E36E36-P40 WeakPolarHBondContact O-CD 3.45Å
41F50.5Low46.5Very low147 Ų147131.8 Ų131.865%0.64565%0.649SS**Hα-helixtrans-83.5-32.7178.8-91.1-85.3000113.3N38 R39 N43 R44 L45N38-F41 PolarHBondContact O-N 2.91Å; N38-F41 VanDerWaalsContact O-N 3.11Å; R39-F41 VanDerWaalsContact C-N 3.28Å; R39-F41 PolarHBondContact O-N 3.17Å; F41-N43 PolarHBondContact O-N 3.46Å; F41-R44 PolarHBondContact O-N 3.14Å; F41-L45 PolarHBondContact O-N 3.44Å
42E45.1Very low47.2Very low103 Ų103133.2 Ų133.248%0.48165%0.646SS.*Hα-helixtrans-62.8-41.9176.3-72.9-172.4161.900111.9N38 R44 L45 Y46N38-E42 PolarHBondContact O-N 3.22Å; N38-E42 VanDerWaalsContact O-N 3.15Å; E42-R44 VanDerWaalsContact C-N 3.26Å; E42-R44 PolarHBondContact O-N 3.06Å; E42-L45 PolarHBondContact O-N 3.43Å; E42-L45 VanDerWaalsContact O-N 3.08Å; E42-Y46 HydrophobicContact CB-CE2 4.22Å; E42-Y46 WeakPolarHBondContact O-CD2 3.44Å; E42-Y46 WeakPolarHBondContact O-CE2 3.35Å; E42-Y46 PolarHBondContact O-N 2.98Å
43N41.8Very low48.1Very low127 Ų127134.3 Ų134.368%0.67965%0.647SS**Hα-helixtrans-64.7-24.4-178.3-80.7-22.8000114.6F41F41-N43 PolarHBondContact O-N 3.46Å
44R48.9Very low49.6Very low212 Ų212135.8 Ų135.880%0.865%0.651SS**Hα-helixtrans-82.5-25.8174.9-77.5-169.9-176.7-166.21.5113.1F41 E42F41-R44 PolarHBondContact O-N 3.14Å; E42-R44 VanDerWaalsContact C-N 3.26Å; E42-R44 PolarHBondContact O-N 3.06Å
45L47.6Very low51Low134 Ų134136.1 Ų136.170%0.70266%0.659SS**Hα-helixtrans-74.8-28.4-179.1-90.2156.8000112.8F41 E42 K47F41-L45 PolarHBondContact O-N 3.44Å; E42-L45 PolarHBondContact O-N 3.43Å; E42-L45 VanDerWaalsContact O-N 3.08Å; L45-K47 VanDerWaalsContact C-N 3.26Å; L45-K47 PolarHBondContact O-N 2.99Å
46Y44.6Very low52.1Low163 Ų163135 Ų13564%0.63966%0.656SS**THydrogen-bonded Turntrans-68.8-17.2179.3-70.5-72.5000115E42E42-Y46 HydrophobicContact CB-CE2 4.22Å; E42-Y46 WeakPolarHBondContact O-CD2 3.44Å; E42-Y46 WeakPolarHBondContact O-CE2 3.35Å; E42-Y46 PolarHBondContact O-N 2.98Å
47K46.1Very low53.5Low194 Ų194133.2 Ų133.284%0.84365%0.648SS**THydrogen-bonded Turntrans-87.2-11.2-177.1-98.1-177.7178-178.70115.3L45L45-K47 VanDerWaalsContact C-N 3.26Å; L45-K47 PolarHBondContact O-N 2.99Å
48R48.7Very low54.4Low221 Ų221133.8 Ų133.883%0.83465%0.65SS**  trans-105.764.4174.5-68.2-173.7177.7-177.6-1.8109.8V50R48-V50 PolarHBondContact O-N 3.33Å
49Q43Very low55.7Low181 Ų181132.2 Ų132.285%0.84665%0.649SS**  trans-69.378.2158.6-91.7167.42.300108
50V55.7Low56.6Low100 Ų100127.1 Ų127.161%0.60664%0.64SS**  trans-64.4132.6156.5-178.80000105.4R48 V52R48-V50 PolarHBondContact O-N 3.33Å; V50-V52 VanDerWaalsContact C-N 3.35Å; V50-V52 WeakPolarHBondContact O-CG2 3.33Å; V50-V52 PolarHBondContact O-N 2.82Å
51P49.2Very low57.4Low122 Ų122128.9 Ų128.979%0.79264%0.642SS**  trans-59.2102.6172.623.8-31.4000107.7
52V59.6Low58Low87 Ų87125.1 Ų125.153%0.52764%0.638SS.*  trans-80122.8177.6-176.10000106.4V50 Q57V50-V52 VanDerWaalsContact C-N 3.35Å; V50-V52 WeakPolarHBondContact O-CG2 3.33Å; V50-V52 PolarHBondContact O-N 2.82Å; V52-Q57 HydrophobicContact CG1-CB 3.84Å; V52-Q57 HydrophobicContact CG1-CG 4.45Å
53D65.4Low58.7Low106 Ų106125 Ų12557%0.56765%0.649SS**  trans-53.5129.7173.3-78.2-35.6000109.8V55 L56 Q57D53-V55 PolarHBondContact O-N 2.93Å; D53-V55 VanDerWaalsContact O-N 3.08Å; D53-L56 HydrophobicContact CB-CB 4.27Å; D53-L56 HydrophobicContact CB-CD1 4.25Å; D53-L56 PolarHBondContact O-N 3.31Å; D53-Q57 PolarHBondContact O-N 3.1Å
54P74.2Confident59.6Low98 Ų98129 Ų12964%0.63665%0.654SS**Hα-helixtrans-61-26.6-174.622.4-32.7000112.3K58P54-K58 VanDerWaalsContact O-CB 3.3Å; P54-K58 WeakPolarHBondContact O-CB 3.48Å; P54-K58 PolarHBondContact O-N 3.45Å
55V74.3Confident59.6Low117 Ų117125.6 Ų125.671%0.70965%0.649SS**Hα-helixtrans-68.6-47175.1-177.30000111.2D53 K58 A59D53-V55 PolarHBondContact O-N 2.93Å; D53-V55 VanDerWaalsContact O-N 3.08Å; V55-K58 PolarHBondContact O-N 3.02Å; V55-A59 WeakPolarHBondContact O-CB 3.31Å; V55-A59 PolarHBondContact O-N 3.4Å
56L68.1Low59.8Low112 Ų112124.6 Ų124.659%0.58665%0.648SS**Hα-helixtrans-67.3-37.7176.7-87.6161.6000111.3D53 K58 A59 A60D53-L56 HydrophobicContact CB-CB 4.27Å; D53-L56 HydrophobicContact CB-CD1 4.25Å; D53-L56 PolarHBondContact O-N 3.31Å; L56-K58 VanDerWaalsContact C-N 3.34Å; L56-K58 PolarHBondContact O-N 3.38Å; L56-A59 PolarHBondContact O-N 2.97Å; L56-A60 VanDerWaalsContact O-CB 3.28Å; L56-A60 WeakPolarHBondContact O-CB 3.42Å; L56-A60 PolarHBondContact O-N 3.42Å
57Q73.1Confident60.2Low96 Ų96120.8 Ų120.845%0.44964%0.644SS.*Hα-helixtrans-63.1-41.8174.3-166.2175.612.300111.5V52 D53 A60 M61V52-Q57 HydrophobicContact CG1-CB 3.84Å; V52-Q57 HydrophobicContact CG1-CG 4.45Å; D53-Q57 PolarHBondContact O-N 3.1Å; Q57-A60 PolarHBondContact O-N 3.32Å; Q57-M61 WeakPolarHBondContact O-CB 3.4Å; Q57-M61 WeakPolarHBondContact O-CG 3.35Å; Q57-M61 PolarHBondContact O-N 3.15Å
58K71.1Confident60.5Low164 Ų164116 Ų11671%0.71363%0.631SS**Hα-helixtrans-66.9-38.8176.3-162.6174.4-174.2178.90112P54 V55 L56 M61 A62P54-K58 VanDerWaalsContact O-CB 3.3Å; P54-K58 WeakPolarHBondContact O-CB 3.48Å; P54-K58 PolarHBondContact O-N 3.45Å; V55-K58 PolarHBondContact O-N 3.02Å; L56-K58 VanDerWaalsContact C-N 3.34Å; L56-K58 PolarHBondContact O-N 3.38Å; K58-M61 PolarHBondContact O-N 3.11Å; K58-A62 WeakPolarHBondContact O-CB 3.5Å; K58-A62 PolarHBondContact O-N 3.41Å
59A67.2Low60.8Low54 Ų54110.3 Ų110.345%0.44662%0.621SS.*Hα-helixtrans-67.3-41.3174.200000112.2V55 L56 A62 S63V55-A59 WeakPolarHBondContact O-CB 3.31Å; V55-A59 PolarHBondContact O-N 3.4Å; L56-A59 PolarHBondContact O-N 2.97Å; A59-A62 PolarHBondContact O-N 3.36Å; A59-S63 WeakPolarHBondContact O-CB 3.43Å; A59-S63 PolarHBondContact O-N 2.91Å
60A64Low61.2Low46 Ų46104.7 Ų104.738%0.3861%0.605SS.*Hα-helixtrans-66.6-38.7174.700000111.7L56 Q57 S63 R64L56-A60 VanDerWaalsContact O-CB 3.28Å; L56-A60 WeakPolarHBondContact O-CB 3.42Å; L56-A60 PolarHBondContact O-N 3.42Å; Q57-A60 PolarHBondContact O-N 3.32Å; A60-S63 PolarHBondContact O-N 3.08Å; A60-R64 VanDerWaalsContact O-CB 3.27Å; A60-R64 WeakPolarHBondContact O-CB 3.42Å; A60-R64 VanDerWaalsContact O-CG 3.27Å; A60-R64 WeakPolarHBondContact O-CG 3.41Å; A60-R64 PolarHBondContact O-N 3.19Å
61M67.6Low61.1Low123 Ų123102.1 Ų102.161%0.60659%0.594SS**Hα-helixtrans-63.5-41.1171-79.3-177.9155.800111.7Q57 K58 S63 R64 M65Q57-M61 WeakPolarHBondContact O-CB 3.4Å; Q57-M61 WeakPolarHBondContact O-CG 3.35Å; Q57-M61 PolarHBondContact O-N 3.15Å; K58-M61 PolarHBondContact O-N 3.11Å; M61-S63 VanDerWaalsContact C-N 3.31Å; M61-S63 PolarHBondContact O-N 3.5Å; M61-R64 PolarHBondContact O-N 3.4Å; M61-M65 PolarHBondContact O-N 3.47Å
62A63.1Low61.2Low68 Ų68102.9 Ų102.956%0.56259%0.591SS**Hα-helixtrans-64.9-34.9174.700000112.3K58 A59K58-A62 WeakPolarHBondContact O-CB 3.5Å; K58-A62 PolarHBondContact O-N 3.41Å; A59-A62 PolarHBondContact O-N 3.36Å
63S60.3Low60.9Low101 Ų101105.8 Ų105.871%0.70660%0.598SS**Hα-helixtrans-76.8-31.4175.7168.40000113.3A59 A60 M61A59-S63 WeakPolarHBondContact O-CB 3.43Å; A59-S63 PolarHBondContact O-N 2.91Å; A60-S63 PolarHBondContact O-N 3.08Å; M61-S63 VanDerWaalsContact C-N 3.31Å; M61-S63 PolarHBondContact O-N 3.5Å
64R59.6Low60.2Low210 Ų210107.4 Ų107.479%0.79260%0.603SS**Hα-helixtrans-87.2-11.7177.8-73.8-177-178.3-171.62.2113.5A60 M61 V66A60-R64 VanDerWaalsContact O-CB 3.27Å; A60-R64 WeakPolarHBondContact O-CB 3.42Å; A60-R64 VanDerWaalsContact O-CG 3.27Å; A60-R64 WeakPolarHBondContact O-CG 3.41Å; A60-R64 PolarHBondContact O-N 3.19Å; M61-R64 PolarHBondContact O-N 3.4Å; R64-V66 PolarHBondContact O-N 3.48Å
65M49.8Very low59Low141 Ų141108.6 Ų108.670%0.69561%0.611SS**SBendtrans-58.591.2155.3-103.2177.4155.100105.7M61M61-M65 PolarHBondContact O-N 3.47Å
66V52Low58Low112 Ų112108.3 Ų108.368%0.67961%0.605SS**  trans-31.2126154.2176.60000105.3R64 T68R64-V66 PolarHBondContact O-N 3.48Å; V66-T68 PolarHBondContact O-N 3.28Å; V66-T68 PolarHBondContact O-OG1 3.47Å
67P52.1Low57.4Low84 Ų84108.8 Ų108.855%0.54561%0.607SS.*  trans-56.995.2176.723.2-31.8000106.5V69 A71P67-V69 PolarHBondContact O-N 3.25Å; P67-A71 HydrophobicContact CB-CB 4.4Å
68T53.6Low56.4Low94 Ų94113.3 Ų113.358%0.57762%0.62SS**  trans-54.2132.4171.4-47.90000103.1V66 A70 A71V66-T68 PolarHBondContact O-N 3.28Å; V66-T68 PolarHBondContact O-OG1 3.47Å; T68-A70 CarbonylContact O-C 3.5Å; T68-A70 PolarHBondContact O-N 3.42Å; T68-A71 PolarHBondContact O-N 2.87Å
69V54.3Low55.6Low101 Ų101107.3 Ų107.361%0.61261%0.605SS**Hα-helixtrans-44.4-28.7-170.2-177.40000113.1P67 A71 L72 E73P67-V69 PolarHBondContact O-N 3.25Å; V69-A71 VanDerWaalsContact C-N 3.33Å; V69-A71 PolarHBondContact O-N 3.41Å; V69-L72 WeakPolarHBondContact O-CB 3.38Å; V69-L72 PolarHBondContact O-N 3.35Å; V69-E73 PolarHBondContact O-N 3.19Å
70A51.6Low55Low62 Ų62111.2 Ų111.251%0.51262%0.618SS.*Hα-helixtrans-53.3-31.3168.700000116.9T68 E73 Q74T68-A70 CarbonylContact O-C 3.5Å; T68-A70 PolarHBondContact O-N 3.42Å; A70-E73 CarbonylContact O-C 3.56Å; A70-E73 WeakPolarHBondContact O-CB 3.45Å; A70-E73 PolarHBondContact O-N 2.77Å; A70-Q74 PolarHBondContact O-N 2.67Å
71A52.2Low54.6Low46 Ų46120 Ų12038%0.3864%0.641SS.*Hα-helixtrans-73.8-30.517500000112P67 T68 V69 Q74P67-A71 HydrophobicContact CB-CB 4.4Å; T68-A71 PolarHBondContact O-N 2.87Å; V69-A71 VanDerWaalsContact C-N 3.33Å; V69-A71 PolarHBondContact O-N 3.41Å; A71-Q74 WeakPolarHBondContact O-CB 3.41Å; A71-Q74 WeakPolarHBondContact O-CG 3.43Å; A71-Q74 PolarHBondContact O-N 3.33Å
72L52.7Low53.8Low139 Ų139121.8 Ų121.873%0.72865%0.646SS**Hα-helixtrans-71.9-20.6169.1-67.7165.6000111.6V69 Q74V69-L72 WeakPolarHBondContact O-CB 3.38Å; V69-L72 PolarHBondContact O-N 3.35Å; L72-Q74 VanDerWaalsContact C-N 3.34Å
73E51.9Low53.3Low147 Ų147122.1 Ų122.169%0.68765%0.649SS**THydrogen-bonded Turntrans-87.54.5171.1-63.9-173.116400113.6V69 A70 P75V69-E73 PolarHBondContact O-N 3.19Å; A70-E73 CarbonylContact O-C 3.56Å; A70-E73 WeakPolarHBondContact O-CB 3.45Å; A70-E73 PolarHBondContact O-N 2.77Å; E73-P75 VanDerWaalsContact O-N 3.09Å
74Q51.1Low53Low141 Ų141128.7 Ų128.766%0.65966%0.658SS**SBendtrans-53124.4171.7-80.6-173.73.300108.7A70 A71 L72 N76A70-Q74 PolarHBondContact O-N 2.67Å; A71-Q74 WeakPolarHBondContact O-CB 3.41Å; A71-Q74 WeakPolarHBondContact O-CG 3.43Å; A71-Q74 PolarHBondContact O-N 3.33Å; L72-Q74 VanDerWaalsContact C-N 3.34Å; Q74-N76 PolarHBondContact O-N 3.07Å
75P49.8Very low53.2Low123 Ų123125.6 Ų125.680%0.79966%0.656SS**  trans-63.8100.3-166.922.8-32.4000109.9E73 L77E73-P75 VanDerWaalsContact O-N 3.09Å; P75-L77 PolarHBondContact O-N 3.01Å
76N53.7Low53.5Low110 Ų110123.8 Ų123.859%0.58865%0.654SS**  trans4670.7143.7-145.923.5000113.5Q74 W78 G79Q74-N76 PolarHBondContact O-N 3.07Å; N76-W78 PolarHBondContact O-N 3.5Å; N76-W78 WeakPolarHBondContact OD1-CB 3.42Å; N76-G79 PolarHBondContact O-N 3.44Å
77L53.7Low53.9Low122 Ų122124.5 Ų124.564%0.63966%0.661SS**THydrogen-bonded Turntrans-54.7-18.3161.6-71.6173.3000111.8P75 G79 L80P75-L77 PolarHBondContact O-N 3.01Å; L77-G79 PolarHBondContact O-N 3.3Å; L77-L80 HydrophobicContact CD2-CD1 3.88Å; L77-L80 PolarHBondContact O-N 3.49Å
78W52.2Low54.4Low191 Ų191127.1 Ų127.172%0.72367%0.669SS**Hα-helixtrans-57.5-22.7166.4-106.8-103.7000114.2N76 W81 K82N76-W78 PolarHBondContact O-N 3.5Å; N76-W78 WeakPolarHBondContact OD1-CB 3.42Å; W78-W81 PolarHBondContact O-N 3.3Å; W78-K82 PolarHBondContact O-N 3.02Å
79G54.4Low54.6Low38 Ų38127.8 Ų127.839%0.39268%0.675SS.*Hα-helixtrans-68.9-34.4174.700000113.4N76 L77 W81 K82N76-G79 PolarHBondContact O-N 3.44Å; L77-G79 PolarHBondContact O-N 3.3Å; G79-W81 VanDerWaalsContact C-N 3.31Å; G79-W81 PolarHBondContact O-N 2.87Å; G79-K82 CarbonylContact O-C 3.56Å; G79-K82 PolarHBondContact O-N 2.87Å; G79-K82 VanDerWaalsContact O-N 3.15Å
80L56.3Low55.1Low136 Ų136130.6 Ų130.671%0.71269%0.685SS**Hα-helixtrans-64-37.1174.5-86.2147.4000111.6L77 K82 A83L77-L80 HydrophobicContact CD2-CD1 3.88Å; L77-L80 PolarHBondContact O-N 3.49Å; L80-K82 VanDerWaalsContact C-N 3.3Å; L80-K82 PolarHBondContact O-N 3.36Å; L80-A83 PolarHBondContact O-N 2.88Å
81W55.4Low55.7Low230 Ų230132.8 Ų132.887%0.87169%0.687SS**Hα-helixtrans-75.8-17.8175.5-63.794.7000113.6W78 G79 A83W78-W81 PolarHBondContact O-N 3.3Å; G79-W81 VanDerWaalsContact C-N 3.31Å; G79-W81 PolarHBondContact O-N 2.87Å; W81-A83 VanDerWaalsContact C-N 3.29Å
82K51.1Low55.9Low162 Ų162134.3 Ų134.370%0.70469%0.693SS**THydrogen-bonded Turntrans-93.830.8169.1-75.7-172.6178-178.50112W78 G79 L80 R84W78-K82 PolarHBondContact O-N 3.02Å; G79-K82 CarbonylContact O-C 3.56Å; G79-K82 PolarHBondContact O-N 2.87Å; G79-K82 VanDerWaalsContact O-N 3.15Å; L80-K82 VanDerWaalsContact C-N 3.3Å; L80-K82 PolarHBondContact O-N 3.36Å; K82-R84 PolarHBondContact O-N 2.82Å
83A51.8Low56.4Low75 Ų75131.4 Ų131.462%0.6269%0.689SS**  trans-48.6111.416400000107.8L80 W81 I85L80-A83 PolarHBondContact O-N 2.88Å; W81-A83 VanDerWaalsContact C-N 3.29Å; A83-I85 PolarHBondContact O-N 3.48Å
84R54.8Low56.9Low238 Ų238133.4 Ų133.490%0.89870%0.698SS**  trans-59.9111.8-177.8-76-179.1175.8177.9-1.2106.9K82 P86K82-R84 PolarHBondContact O-N 2.82Å; R84-P86 VanDerWaalsContact O-N 3.16Å
85I62.2Low57.3Low146 Ų146134.2 Ų134.275%0.74970%0.704SS**  trans-52.3123167.9-61.3164.2000105.8A83A83-I85 PolarHBondContact O-N 3.48Å
86P56Low57.6Low103 Ų103131.7 Ų131.767%0.66968%0.682SS**  trans-57.9136.3-179.622.5-31.5000108.6R84 I88R84-P86 VanDerWaalsContact O-N 3.16Å; P86-I88 PolarHBondContact O-N 3.48Å
87P60.5Low57.7Low126 Ų126130.6 Ų130.682%0.81868%0.681SS**  trans-61.3115.7-177.624.6-32.2000108.9
88I63.6Low58.2Low140 Ų140132.9 Ų132.972%0.71869%0.692SS**  trans-60.8127.3171.1-60.3170.3000106.4P86 I90P86-I88 PolarHBondContact O-N 3.48Å; I88-I90 PolarHBondContact O-N 3.22Å
89P57.7Low58.5Low107 Ų107131 Ų13170%0.69570%0.696SS**  trans-60.4116.1177.722.5-30.7000109.3I91P89-I91 PolarHBondContact O-N 3.29Å
90I64.5Low58.2Low161 Ų161137.7 Ų137.783%0.82671%0.711SS**  trans-75.392.1174.5-57.6170.3000106.3I88 P92I88-I90 PolarHBondContact O-N 3.22Å; I90-P92 WeakPolarHBondContact O-CD 3.44Å
91I63.5Low58Low108 Ų108136.5 Ų136.555%0.55471%0.711SS**  trans-71.1121.8168.1-58.6172.8000106.5P89 A93 M95 M96P89-I91 PolarHBondContact O-N 3.29Å; I91-A93 PolarHBondContact O-N 2.97Å; I91-M95 HydrophobicContact CG2-CB 4.28Å; I91-M96 HydrophobicContact CG2-CG 4.28Å
92P57.9Low57.8Low78 Ų78130.7 Ų130.751%0.50669%0.694SS.*  trans-57.2134.7175.9-2233.2000110I90 E94 M95I90-P92 WeakPolarHBondContact O-CD 3.44Å; P92-E94 PolarHBondContact O-N 2.68Å; P92-M95 PolarHBondContact O-N 3.05Å
93A62.2Low57.6Low77 Ų77128.5 Ų128.564%0.63670%0.696SS**G310 helixtrans-54.4-28.3-173.100000113.5I91 M95 M96I91-A93 PolarHBondContact O-N 2.97Å; A93-M95 VanDerWaalsContact C-N 3.3Å; A93-M95 PolarHBondContact O-N 3.33Å; A93-M96 HydrophobicContact CB-CE 4.5Å; A93-M96 WeakPolarHBondContact O-CB 3.49Å; A93-M96 PolarHBondContact O-N 3.01Å
94E62.8Low57.8Low190 Ų190132.3 Ų132.389%0.88871%0.705SS**G310 helixtrans-67.1-26179.9-58.6174.9-159.500113.8P92P92-E94 PolarHBondContact O-N 2.68Å
95M59.8Low57.5Low158 Ų158124.8 Ų124.878%0.77869%0.694SS**G310 helixtrans-92.4-0.9177-83.3-174.5153.800113.1I91 P92 A93I91-M95 HydrophobicContact CG2-CB 4.28Å; P92-M95 PolarHBondContact O-N 3.05Å; A93-M95 VanDerWaalsContact C-N 3.3Å; A93-M95 PolarHBondContact O-N 3.33Å
96M56Low57Low70 Ų70125 Ų12535%0.34570%0.696SS.*SBendtrans-76.3125.4178.5-64.8-155.6-5500109.9I91 A93 I98 Q102I91-M96 HydrophobicContact CG2-CG 4.28Å; A93-M96 HydrophobicContact CB-CE 4.5Å; A93-M96 WeakPolarHBondContact O-CB 3.49Å; A93-M96 PolarHBondContact O-N 3.01Å; M96-I98 PolarHBondContact O-N 3.19Å; M96-I98 VanDerWaalsContact O-N 3.14Å; M96-Q102 PolarHBondContact SD-NE2 3.47Å
97P54.5Low56.6Low87 Ų87129.1 Ų129.157%0.56571%0.706SS**  trans-60123.6175.223.5-30.9000109N99 Y100P97-N99 PolarHBondContact O-N 2.72Å; P97-Y100 HydrophobicContact CG-CD2 4.2Å; P97-Y100 PolarHBondContact O-N 3.45Å
98I64.1Low56.3Low169 Ų169129.5 Ų129.587%0.86770%0.7SS**THydrogen-bonded Turntrans-53.2-21.2-175.9-62.3166.2000112.5M96M96-I98 PolarHBondContact O-N 3.19Å; M96-I98 VanDerWaalsContact O-N 3.14Å
99N58.6Low55.6Low151 Ų151128 Ų12881%0.80770%0.7SS**THydrogen-bonded Turntrans-96.112-178.9-80.3-12.8000115.5P97 P101P97-N99 PolarHBondContact O-N 2.72Å; N99-P101 WeakPolarHBondContact O-CD 3.05Å
100Y48.8Very low55.4Low180 Ų180130.1 Ų130.171%0.70671%0.706SS**  trans-85.3108.4162.8-113.2-90000109.2P97 Q102P97-Y100 HydrophobicContact CG-CD2 4.2Å; P97-Y100 PolarHBondContact O-N 3.45Å; Y100-Q102 PolarHBondContact O-N 3.33Å
101P51.8Low55Low111 Ų111126.9 Ų126.972%0.72170%0.695SS**  trans-63.391.9155.328.4-30.9000105.1N99 P103N99-P101 WeakPolarHBondContact O-CD 3.05Å; P101-P103 VanDerWaalsContact O-CD 3.26Å; P101-P103 WeakPolarHBondContact O-CD 3.4Å
102Q52.3Low54.8Low108 Ų108127.4 Ų127.451%0.50571%0.705SS.*  trans-50.3121.3154.7-75.7-179-21.700103.8M96 Y100 L104M96-Q102 PolarHBondContact SD-NE2 3.47Å; Y100-Q102 PolarHBondContact O-N 3.33Å; Q102-L104 PolarHBondContact O-N 3.19Å
103P47Very low54.5Low115 Ų115126.4 Ų126.475%0.74771%0.709SS**  trans-55109.415524.6-27000101.4P101 A105P101-P103 VanDerWaalsContact O-CD 3.26Å; P101-P103 WeakPolarHBondContact O-CD 3.4Å; P103-A105 PolarHBondContact O-N 2.91Å
104L54.8Low53.9Low156 Ų156131.2 Ų131.282%0.81772%0.718SS**  trans-50.795.5163.6-75.8164.3000101.1Q102 L106Q102-L104 PolarHBondContact O-N 3.19Å; L104-L106 WeakPolarHBondContact O-CA 3.33Å; L104-L106 PolarHBondContact O-N 2.96Å
105A48.2Very low53.6Low79 Ų79131.1 Ų131.165%0.65372%0.715SS**  trans-51.7108.5-179.600000100.2P103 Q107P103-A105 PolarHBondContact O-N 2.91Å; A105-Q107 PolarHBondContact O-N 3.28Å
106L51.3Low53.5Low151 Ų151134.9 Ų134.979%0.79172%0.72SS**  trans-37.5106.4-174.2-88.2139.1000103.2L104 L108L104-L106 WeakPolarHBondContact O-CA 3.33Å; L104-L106 PolarHBondContact O-N 2.96Å; L106-L108 HydrophobicContact CB-CG 4.41Å; L106-L108 PolarHBondContact O-N 3.48Å
107Q48.7Very low53.7Low189 Ų189136 Ų13688%0.88374%0.74SS**  trans-70.777.1170.5-84.4-179.8-14.800100.7A105 P109A105-Q107 PolarHBondContact O-N 3.28Å; Q107-P109 WeakPolarHBondContact O-CD 3.36Å
108L53.3Low54Low134 Ų134136.4 Ų136.470%0.70275%0.745SS**  trans-44.6116.2160.9-72.3170.3000101.2L106 N110L106-L108 HydrophobicContact CB-CG 4.41Å; L106-L108 PolarHBondContact O-N 3.48Å; L108-N110 PolarHBondContact O-N 2.99Å
109P49.6Very low54Low110 Ų110138.2 Ų138.271%0.71475%0.747SS**  trans-48119.8-17617.2-29.9000105.5Q107 P111Q107-P109 WeakPolarHBondContact O-CD 3.36Å; P109-P111 WeakPolarHBondContact O-CD 3.45Å
110N52.9Low54.6Low151 Ų151138 Ų13881%0.80775%0.745SS**  trans-42.7117.1175.7-95.9-29.8000105.3L108L108-N110 PolarHBondContact O-N 2.99Å
111P57.2Low56.1Low92 Ų92135 Ų13560%0.59775%0.748SS**  trans-51.5124.7-17116.7-29.7000106.5P109 G113P109-P111 WeakPolarHBondContact O-CD 3.45Å; P111-G113 CarbonylContact O-C 3.4Å; P111-G113 PolarHBondContact O-N 2.98Å
112P58.2Low57.6Low120 Ų120137.9 Ų137.978%0.77975%0.753SS**SBendtrans-57.299.2-158.919.1-33000109.9
113G51.8Low59.1Low56 Ų56135.7 Ų135.758%0.57775%0.749SS**  trans56.3123.3-174.500000111.9P111 K115P111-G113 CarbonylContact O-C 3.4Å; P111-G113 PolarHBondContact O-N 2.98Å; G113-K115 PolarHBondContact O-N 3.34Å
114H49.4Very low61.2Low178 Ų178133.6 Ų133.682%0.82473%0.734SS**  trans-55.588.7131.4-85.634.8000106.1R116H114-R116 VanDerWaalsContact C-N 3.26Å; H114-R116 PolarHBondContact O-N 3.48Å
115K56.4Low62.9Low189 Ų189130 Ų13082%0.82273%0.726SS**  trans-47.4108.1160.9-71.2-176.8-179.5-178.90101.9G113 A117G113-K115 PolarHBondContact O-N 3.34Å; K115-A117 PolarHBondContact O-N 2.91Å
116R58.2Low64.9Low237 Ų237132 Ų13289%0.89473%0.725SS**  trans-35.7115.1179.4-74175179.3160.2-0.2105H114 S118H114-R116 VanDerWaalsContact C-N 3.26Å; H114-R116 PolarHBondContact O-N 3.48Å; R116-S118 WeakPolarHBondContact O-CA 3.39Å; R116-S118 PolarHBondContact O-N 2.74Å
117A60.4Low66.8Low92 Ų92128.3 Ų128.376%0.7671%0.706SS**  trans-36.3110.9-175.900000105.9K115 K119K115-A117 PolarHBondContact O-N 2.91Å; A117-K119 PolarHBondContact O-N 2.9Å
118S60Low69Low96 Ų96125.4 Ų125.467%0.67169%0.688SS**  trans-48.8117.1-175.749.60000103.8R116 L120R116-S118 WeakPolarHBondContact O-CA 3.39Å; R116-S118 PolarHBondContact O-N 2.74Å; S118-L120 PolarHBondContact O-N 3.4Å
119K64.5Low70.9Confident208 Ų208123.5 Ų123.590%0.90468%0.681SS**  trans-5696-176.2-69.1178.3-179.2-177.90105A117A117-K119 PolarHBondContact O-N 2.9Å
120L72.2Confident73.1Confident146 Ų146124 Ų12476%0.76468%0.675SS**PPolyproline II helixtrans-57.9132.9171.9-74.2167.8000103.6S118 M122S118-L120 PolarHBondContact O-N 3.4Å; L120-M122 PolarHBondContact O-N 2.83Å; L120-M122 VanDerWaalsContact O-N 3.14Å
121P80.6Confident75.1Confident118 Ų118120.9 Ų120.977%0.76666%0.659SS**PPolyproline II helixtrans-52.2129.6176.822.5-31.7000107.4
122M81.7Confident76.9Confident170 Ų170121.1 Ų121.184%0.83766%0.655SS**PPolyproline II helixtrans-60.3128.2178.1-173163.3165.300107.1L120 T124L120-M122 PolarHBondContact O-N 2.83Å; L120-M122 VanDerWaalsContact O-N 3.14Å; M122-T124 PolarHBondContact O-N 3.24Å
123P85.5Confident78.7Confident63 Ų63119.8 Ų119.841%0.40964%0.644SS.*PPolyproline II helixtrans-56.3130.2-17820.6-32.1000109.8D127 Y128P123-D127 HydrophobicContact CB-CB 4.18Å; P123-Y128 HydrophobicContact CB-CE2 3.97Å; P123-Y128 HydrophobicContact CG-CE2 4.06Å; P123-Y128 WeakPolarHBondContact CG-OH 3.07Å
124T89.8Confident80.8Confident71 Ų71123.6 Ų123.644%0.43664%0.642SS.*PPolyproline II helixtrans-79.5164.4178.8650000110.6M122 I126 D127 Y128M122-T124 PolarHBondContact O-N 3.24Å; T124-I126 PolarHBondContact O-N 3.2Å; T124-I126 VanDerWaalsContact O-N 3.17Å; T124-I126 PolarHBondContact OG1-N 3.47Å; T124-D127 WeakPolarHBondContact CB-OD2 3.34Å; T124-D127 PolarHBondContact N-OD2 2.85Å; T124-D127 WeakPolarHBondContact O-CB 3.39Å; T124-D127 PolarHBondContact O-N 3.46Å; T124-D127 VanDerWaalsContact OG1-CG 3.27Å; T124-D127 PolarHBondContact OG1-N 3.44Å; T124-D127 PolarHBondContact OG1-OD2 3.43Å; T124-Y128 WeakPolarHBondContact O-CD2 3.47Å; T124-Y128 PolarHBondContact O-N 2.88Å
125A90Very high83Confident79 Ų79118.8 Ų118.865%0.65362%0.621SS**Hα-helixtrans-55.6-31.8172.200000112.4Y128 V129A125-Y128 PolarHBondContact O-N 3.48Å; A125-V129 WeakPolarHBondContact O-CG2 3.48Å; A125-V129 PolarHBondContact O-N 3.23Å
126I91.5Very high84.9Confident123 Ų123113.2 Ų113.263%0.63160%0.604SS**Hα-helixtrans-65.9-40.9176.8-61.8166.8000110.7T124 Y128 V129 M130T124-I126 PolarHBondContact O-N 3.2Å; T124-I126 VanDerWaalsContact O-N 3.17Å; T124-I126 PolarHBondContact OG1-N 3.47Å; I126-Y128 VanDerWaalsContact C-N 3.31Å; I126-Y128 PolarHBondContact O-N 2.9Å; I126-V129 PolarHBondContact O-N 2.91Å; I126-M130 WeakPolarHBondContact O-CB 3.36Å; I126-M130 PolarHBondContact O-N 3.39Å
127D91.9Very high86.7Confident73 Ų73104.5 Ų104.539%0.3958%0.579SS.*Hα-helixtrans-61.7-40.8177.1-59.3-46.3000111.2P123 T124 M130 L131P123-D127 HydrophobicContact CB-CB 4.18Å; T124-D127 WeakPolarHBondContact CB-OD2 3.34Å; T124-D127 PolarHBondContact N-OD2 2.85Å; T124-D127 WeakPolarHBondContact O-CB 3.39Å; T124-D127 PolarHBondContact O-N 3.46Å; T124-D127 VanDerWaalsContact OG1-CG 3.27Å; T124-D127 PolarHBondContact OG1-N 3.44Å; T124-D127 PolarHBondContact OG1-OD2 3.43Å; D127-M130 PolarHBondContact O-N 3.01Å; D127-L131 VanDerWaalsContact O-CB 3.26Å; D127-L131 WeakPolarHBondContact O-CB 3.4Å; D127-L131 PolarHBondContact O-N 2.81Å
128Y93.6Very high88.4Confident128 Ų128104 Ų10450%0.50256%0.559SS.*Hα-helixtrans-67-40.1175.1-70.8-71.4000112.9P123 T124 A125 I126 L131 N132P123-Y128 HydrophobicContact CB-CE2 3.97Å; P123-Y128 HydrophobicContact CG-CE2 4.06Å; P123-Y128 WeakPolarHBondContact CG-OH 3.07Å; T124-Y128 WeakPolarHBondContact O-CD2 3.47Å; T124-Y128 PolarHBondContact O-N 2.88Å; A125-Y128 PolarHBondContact O-N 3.48Å; I126-Y128 VanDerWaalsContact C-N 3.31Å; I126-Y128 PolarHBondContact O-N 2.9Å; Y128-L131 PolarHBondContact O-N 3.34Å; Y128-N132 WeakPolarHBondContact O-CB 3.4Å; Y128-N132 PolarHBondContact O-N 2.91Å; Y128-N132 PolarHBondContact O-ND2 3.03Å
129V94.1Very high90.1Very high93 Ų93104.4 Ų104.456%0.56455%0.553SS**Hα-helixtrans-63.7-45.9175.7171.50000110.4A125 I126 L131 N132 V133A125-V129 WeakPolarHBondContact O-CG2 3.48Å; A125-V129 PolarHBondContact O-N 3.23Å; I126-V129 PolarHBondContact O-N 2.91Å; V129-L131 VanDerWaalsContact C-N 3.33Å; V129-L131 PolarHBondContact O-N 3.5Å; V129-N132 PolarHBondContact O-N 3.08Å; V129-V133 WeakPolarHBondContact O-CG2 3.41Å; V129-V133 PolarHBondContact O-N 3.33Å
130M95.4Very high91.6Very high120 Ų120100.7 Ų100.759%0.59154%0.54SS*.Hα-helixtrans-61.4-43.4177.7-168.7-170.9-42.200111.5I126 D127 N132 V133 Y134I126-M130 WeakPolarHBondContact O-CB 3.36Å; I126-M130 PolarHBondContact O-N 3.39Å; D127-M130 PolarHBondContact O-N 3.01Å; M130-N132 VanDerWaalsContact C-N 3.33Å; M130-N132 PolarHBondContact O-N 2.74Å; M130-V133 PolarHBondContact O-N 3.48Å; M130-Y134 WeakPolarHBondContact O-CB 3.28Å; M130-Y134 PolarHBondContact O-N 3.27Å
131L95.5Very high92.7Very high87 Ų8797.2 Ų97.246%0.45552%0.519SS..Hα-helixtrans-61-43175.3-175.267.5000111.4D127 Y128 V129 Y134 I135D127-L131 VanDerWaalsContact O-CB 3.26Å; D127-L131 WeakPolarHBondContact O-CB 3.4Å; D127-L131 PolarHBondContact O-N 2.81Å; Y128-L131 PolarHBondContact O-N 3.34Å; V129-L131 VanDerWaalsContact C-N 3.33Å; V129-L131 PolarHBondContact O-N 3.5Å; L131-Y134 PolarHBondContact O-N 3.26Å; L131-I135 HydrophobicContact CD1-CD1 4.22Å; L131-I135 HydrophobicContact CD2-CD1 4.4Å; L131-I135 HydrophobicContact CG-CD1 3.82Å; L131-I135 HydrophobicContact CG-CG1 4.46Å; L131-I135 WeakPolarHBondContact O-CB 3.44Å; L131-I135 VanDerWaalsContact O-CG1 3.25Å; L131-I135 WeakPolarHBondContact O-CG1 3.25Å; L131-I135 PolarHBondContact O-N 2.93Å
132N94.4Very high93.4Very high96 Ų9696 Ų9651%0.51351%0.506SS..Hα-helixtrans-64.6-42.5177.2-74.7-17.6000112.2Y128 V129 M130 Y134 I135 T136Y128-N132 WeakPolarHBondContact O-CB 3.4Å; Y128-N132 PolarHBondContact O-N 2.91Å; Y128-N132 PolarHBondContact O-ND2 3.03Å; V129-N132 PolarHBondContact O-N 3.08Å; M130-N132 VanDerWaalsContact C-N 3.33Å; M130-N132 PolarHBondContact O-N 2.74Å; N132-Y134 VanDerWaalsContact C-N 3.31Å; N132-Y134 PolarHBondContact O-N 2.85Å; N132-I135 PolarHBondContact O-N 2.77Å; N132-T136 WeakPolarHBondContact O-CB 3.47Å; N132-T136 VanDerWaalsContact O-CG2 3.31Å; N132-T136 WeakPolarHBondContact O-CG2 3.31Å; N132-T136 PolarHBondContact O-N 2.72Å; N132-T136 PolarHBondContact O-OG1 2.87Å
133V95.1Very high94Very high92 Ų9293.9 Ų93.956%0.55849%0.494SS*.Hα-helixtrans-61.2-42.4174.1172.50000110.6V129 M130 T136 S137V129-V133 WeakPolarHBondContact O-CG2 3.41Å; V129-V133 PolarHBondContact O-N 3.33Å; M130-V133 PolarHBondContact O-N 3.48Å; V133-T136 WeakPolarHBondContact CA-OG1 3.37Å; V133-T136 PolarHBondContact O-OG1 3.17Å; V133-S137 WeakPolarHBondContact O-CB 3.35Å; V133-S137 PolarHBondContact O-N 3.38Å; V133-S137 PolarHBondContact O-OG 3.47Å
134Y96.6Very high94.4Very high137 Ų13795.8 Ų95.854%0.53750%0.498SS..Hα-helixtrans-63.1-49.5176.4177.6-101000112.1M130 L131 N132 T136 S137 K138M130-Y134 WeakPolarHBondContact O-CB 3.28Å; M130-Y134 PolarHBondContact O-N 3.27Å; L131-Y134 PolarHBondContact O-N 3.26Å; N132-Y134 VanDerWaalsContact C-N 3.31Å; N132-Y134 PolarHBondContact O-N 2.85Å; Y134-T136 PolarHBondContact O-N 3.01Å; Y134-S137 PolarHBondContact O-N 3.32Å; Y134-S137 PolarHBondContact O-OG 3.32Å; Y134-K138 HydrophobicContact CE1-CG 4.12Å; Y134-K138 HydrophobicContact CE2-CG 4.17Å; Y134-K138 WeakPolarHBondContact O-CG 3.28Å; Y134-K138 PolarHBondContact O-N 2.88Å
135I96.4Very high94.6Very high76 Ų7698.7 Ų98.739%0.3950%0.501SS..Hα-helixtrans-60.4-47179.5-69.5167.2000110.7L131 N132 S137 K138 L139L131-I135 HydrophobicContact CD1-CD1 4.22Å; L131-I135 HydrophobicContact CD2-CD1 4.4Å; L131-I135 HydrophobicContact CG-CD1 3.82Å; L131-I135 HydrophobicContact CG-CG1 4.46Å; L131-I135 WeakPolarHBondContact O-CB 3.44Å; L131-I135 VanDerWaalsContact O-CG1 3.25Å; L131-I135 WeakPolarHBondContact O-CG1 3.25Å; L131-I135 PolarHBondContact O-N 2.93Å; N132-I135 PolarHBondContact O-N 2.77Å; I135-S137 PolarHBondContact O-N 3.36Å; I135-K138 PolarHBondContact O-N 3.46Å; I135-L139 HydrophobicContact CG2-CD1 4.06Å; I135-L139 HydrophobicContact CG2-CG 4.44Å; I135-L139 WeakPolarHBondContact O-CG 3.43Å; I135-L139 PolarHBondContact O-N 3.42Å
136T95Very high94.8Very high73 Ų7399.2 Ų99.245%0.44849%0.493SS..Hα-helixtrans-62.1-4317948.20000111.9N132 V133 Y134 K138 L139 E140N132-T136 WeakPolarHBondContact O-CB 3.47Å; N132-T136 VanDerWaalsContact O-CG2 3.31Å; N132-T136 WeakPolarHBondContact O-CG2 3.31Å; N132-T136 PolarHBondContact O-N 2.72Å; N132-T136 PolarHBondContact O-OG1 2.87Å; V133-T136 WeakPolarHBondContact CA-OG1 3.37Å; V133-T136 PolarHBondContact O-OG1 3.17Å; Y134-T136 PolarHBondContact O-N 3.01Å; T136-K138 VanDerWaalsContact C-N 3.3Å; T136-K138 PolarHBondContact O-N 2.82Å; T136-L139 PolarHBondContact O-N 2.98Å; T136-E140 PolarHBondContact O-N 3.25Å
137S95.9Very high94.9Very high53 Ų5397.5 Ų97.537%0.37148%0.484SS..Hα-helixtrans-60.3-37.7174.876.90000113.1V133 Y134 I135 E141V133-S137 WeakPolarHBondContact O-CB 3.35Å; V133-S137 PolarHBondContact O-N 3.38Å; V133-S137 PolarHBondContact O-OG 3.47Å; Y134-S137 PolarHBondContact O-N 3.32Å; Y134-S137 PolarHBondContact O-OG 3.32Å; I135-S137 PolarHBondContact O-N 3.36Å; S137-E141 PolarHBondContact O-N 2.81Å
138K97.2Very high94.9Very high81 Ų81101.8 Ų101.835%0.35250%0.495SS..Hα-helixtrans-71.7-35.1177.8-73.5-72.2159.8-159.40112.3Y134 I135 T136 E141 L142Y134-K138 HydrophobicContact CE1-CG 4.12Å; Y134-K138 HydrophobicContact CE2-CG 4.17Å; Y134-K138 WeakPolarHBondContact O-CG 3.28Å; Y134-K138 PolarHBondContact O-N 2.88Å; I135-K138 PolarHBondContact O-N 3.46Å; T136-K138 VanDerWaalsContact C-N 3.3Å; T136-K138 PolarHBondContact O-N 2.82Å; K138-E141 IonicContact NZ-OE2 3.33Å; K138-E141 PolarHBondContact NZ-OE2 3.14Å; K138-E141 PolarHBondContact O-N 3.47Å; K138-L142 WeakPolarHBondContact O-CB 3.39Å; K138-L142 WeakPolarHBondContact O-CG 3.43Å; K138-L142 PolarHBondContact O-N 3.06Å
139L95.9Very high94.8Very high105 Ų105101 Ų10155%0.5550%0.498SS..Hα-helixtrans-66.1-43.5174.4-72173.2000111.6I135 T136 E141 L142 Q143I135-L139 HydrophobicContact CG2-CD1 4.06Å; I135-L139 HydrophobicContact CG2-CG 4.44Å; I135-L139 WeakPolarHBondContact O-CG 3.43Å; I135-L139 PolarHBondContact O-N 3.42Å; T136-L139 PolarHBondContact O-N 2.98Å; L139-E141 PolarHBondContact O-N 2.59Å; L139-L142 PolarHBondContact O-N 2.74Å; L139-Q143 WeakPolarHBondContact O-CB 3.27Å; L139-Q143 PolarHBondContact O-N 2.72Å
140E95Very high94.7Very high131 Ų131101.6 Ų101.661%0.61250%0.495SS*.Hα-helixtrans-61.3-43.8174.7-71.2177.617700111.7T136 L142 Q143 M144T136-E140 PolarHBondContact O-N 3.25Å; E140-L142 VanDerWaalsContact C-N 3.35Å; E140-L142 PolarHBondContact O-N 3.28Å; E140-Q143 PolarHBondContact O-N 3.26Å; E140-M144 WeakPolarHBondContact O-CG 3.21Å; E140-M144 PolarHBondContact O-N 2.85Å
141E94.9Very high94.4Very high72 Ų7299.3 Ų99.334%0.33649%0.485SS..Hα-helixtrans-58.8-46175.9-170.2-171.716500111.5S137 K138 L139 M144 R145S137-E141 PolarHBondContact O-N 2.81Å; K138-E141 IonicContact NZ-OE2 3.33Å; K138-E141 PolarHBondContact NZ-OE2 3.14Å; K138-E141 PolarHBondContact O-N 3.47Å; L139-E141 PolarHBondContact O-N 2.59Å; E141-M144 PolarHBondContact O-N 2.79Å; E141-R145 WeakPolarHBondContact O-CG 3.27Å; E141-R145 PolarHBondContact O-N 3.22Å; E141-R145 IonicContact OE1-CZ 2.77Å; E141-R145 IonicContact OE1-NE 2.67Å; E141-R145 PolarHBondContact OE1-NE 3.03Å; E141-R145 IonicContact OE1-NH2 3.32Å; E141-R145 PolarHBondContact OE1-NH2 3.19Å
142L96.1Very high94.1Very high94 Ų94102 Ų10249%0.49249%0.493SS..Hα-helixtrans-65.6-41177.8-75.7172.1000112K138 L139 E140 M144 R145 I146K138-L142 WeakPolarHBondContact O-CB 3.39Å; K138-L142 WeakPolarHBondContact O-CG 3.43Å; K138-L142 PolarHBondContact O-N 3.06Å; L139-L142 PolarHBondContact O-N 2.74Å; E140-L142 VanDerWaalsContact C-N 3.35Å; E140-L142 PolarHBondContact O-N 3.28Å; L142-M144 VanDerWaalsContact C-N 3.33Å; L142-M144 PolarHBondContact O-N 3.19Å; L142-R145 WeakPolarHBondContact O-CB 3.42Å; L142-R145 PolarHBondContact O-N 3.24Å; L142-R145 VanDerWaalsContact O-N 3.14Å; L142-I146 WeakPolarHBondContact O-CG1 3.5Å; L142-I146 PolarHBondContact O-N 3.23Å
143Q94.6Very high93.7Very high125 Ų125101.9 Ų101.958%0.58449%0.492SS*.Hα-helixtrans-61.5-42.3177.4-172.7175.90.300111.4L139 E140 R145 I146 L147L139-Q143 WeakPolarHBondContact O-CB 3.27Å; L139-Q143 PolarHBondContact O-N 2.72Å; E140-Q143 PolarHBondContact O-N 3.26Å; Q143-R145 VanDerWaalsContact C-N 3.32Å; Q143-R145 PolarHBondContact O-N 3.32Å; Q143-I146 PolarHBondContact O-N 2.63Å; Q143-L147 WeakPolarHBondContact O-CG 3.26Å; Q143-L147 PolarHBondContact O-N 3.32Å
144M93.3Very high93.1Very high102 Ų102103.5 Ų103.550%0.50249%0.493SS..Hα-helixtrans-65.9-34.1174.8-70.4-57.3-59.800112.9E140 E141 L142 L147 R148E140-M144 WeakPolarHBondContact O-CG 3.21Å; E140-M144 PolarHBondContact O-N 2.85Å; E141-M144 PolarHBondContact O-N 2.79Å; L142-M144 VanDerWaalsContact C-N 3.33Å; L142-M144 PolarHBondContact O-N 3.19Å; M144-L147 HydrophobicContact SD-CD1 4.13Å; M144-R148 VanDerWaalsContact O-CG 3.28Å; M144-R148 WeakPolarHBondContact O-CG 3.37Å; M144-R148 PolarHBondContact O-N 2.8Å
145R93.8Very high92.3Very high132 Ų132102.8 Ų102.850%0.49849%0.493SS..Hα-helixtrans-67.7-43174.2-72.8171.9-179-1432.4111.4E141 L142 Q143 R148 I149E141-R145 WeakPolarHBondContact O-CG 3.27Å; E141-R145 PolarHBondContact O-N 3.22Å; E141-R145 IonicContact OE1-CZ 2.77Å; E141-R145 IonicContact OE1-NE 2.67Å; E141-R145 PolarHBondContact OE1-NE 3.03Å; E141-R145 IonicContact OE1-NH2 3.32Å; E141-R145 PolarHBondContact OE1-NH2 3.19Å; L142-R145 WeakPolarHBondContact O-CB 3.42Å; L142-R145 PolarHBondContact O-N 3.24Å; L142-R145 VanDerWaalsContact O-N 3.14Å; Q143-R145 VanDerWaalsContact C-N 3.32Å; Q143-R145 PolarHBondContact O-N 3.32Å; R145-R148 WeakPolarHBondContact O-CB 3.37Å; R145-R148 PolarHBondContact O-N 2.81Å; R145-I149 VanDerWaalsContact O-CG1 3.31Å; R145-I149 WeakPolarHBondContact O-CG1 3.49Å; R145-I149 PolarHBondContact O-N 2.88Å
146I94.9Very high91.4Very high91 Ų91105.9 Ų105.947%0.46751%0.51SS..Hα-helixtrans-60.7-49.1176.4-70.2163.6000110.1L142 Q143 R148 I149 E150L142-I146 WeakPolarHBondContact O-CG1 3.5Å; L142-I146 PolarHBondContact O-N 3.23Å; Q143-I146 PolarHBondContact O-N 2.63Å; I146-R148 PolarHBondContact O-N 2.76Å; I146-I149 CarbonylContact O-C 3.52Å; I146-I149 WeakPolarHBondContact O-CA 3.34Å; I146-I149 WeakPolarHBondContact O-CB 3.3Å; I146-I149 PolarHBondContact O-N 2.66Å; I146-E150 HydrophobicContact CG2-CG 4.2Å; I146-E150 WeakPolarHBondContact O-CG 3.38Å; I146-E150 PolarHBondContact O-N 2.74Å
147L93.7Very high90.3Very high87 Ų87109.1 Ų109.146%0.45552%0.52SS..Hα-helixtrans-56.7-37.8176.7-72.9171.1000112.8Q143 M144 D151Q143-L147 WeakPolarHBondContact O-CG 3.26Å; Q143-L147 PolarHBondContact O-N 3.32Å; M144-L147 HydrophobicContact SD-CD1 4.13Å; L147-D151 WeakPolarHBondContact O-CB 3.48Å; L147-D151 PolarHBondContact O-N 3.26Å
148R91.4Very high88.7Confident163 Ų163112.7 Ų112.762%0.61553%0.531SS*.Hα-helixtrans-68.9-33.1174.5-71.8172.4-172.8-177.73.5112.8M144 R145 I146 K152M144-R148 VanDerWaalsContact O-CG 3.28Å; M144-R148 WeakPolarHBondContact O-CG 3.37Å; M144-R148 PolarHBondContact O-N 2.8Å; R145-R148 WeakPolarHBondContact O-CB 3.37Å; R145-R148 PolarHBondContact O-N 2.81Å; I146-R148 PolarHBondContact O-N 2.76Å; R148-K152 WeakPolarHBondContact O-CB 3.39Å; R148-K152 VanDerWaalsContact O-CG 3.27Å; R148-K152 WeakPolarHBondContact O-CG 3.39Å; R148-K152 PolarHBondContact O-N 3.5Å
149I92.2Very high86.8Confident111 Ų111112.8 Ų112.857%0.56954%0.539SS*.Hα-helixtrans-72.5-43.2176.4-68164.5000109.5R145 I146 K152 L153R145-I149 VanDerWaalsContact O-CG1 3.31Å; R145-I149 WeakPolarHBondContact O-CG1 3.49Å; R145-I149 PolarHBondContact O-N 2.88Å; I146-I149 CarbonylContact O-C 3.52Å; I146-I149 WeakPolarHBondContact O-CA 3.34Å; I146-I149 WeakPolarHBondContact O-CB 3.3Å; I146-I149 PolarHBondContact O-N 2.66Å; I149-K152 PolarHBondContact O-N 3.15Å; I149-L153 WeakPolarHBondContact O-CB 3.44Å; I149-L153 PolarHBondContact O-N 3.47Å
150E91.2Very high85Confident106 Ų106111.3 Ų111.350%0.49554%0.542SS..Hα-helixtrans-59.7-47.8176-70.4175.5168.600111.4I146 K152 L153 E154I146-E150 HydrophobicContact CG2-CG 4.2Å; I146-E150 WeakPolarHBondContact O-CG 3.38Å; I146-E150 PolarHBondContact O-N 2.74Å; E150-K152 VanDerWaalsContact C-N 3.29Å; E150-K152 PolarHBondContact O-N 3.48Å; E150-L153 PolarHBondContact O-N 3.31Å; E150-L153 VanDerWaalsContact O-N 3.12Å; E150-E154 WeakPolarHBondContact O-CB 3.02Å; E150-E154 PolarHBondContact O-N 2.99Å
151D89.6Confident83Confident72 Ų72114 Ų11439%0.38555%0.552SS.*Hα-helixtrans-60.4-36.7175170.673.4000112.6L147 K155L147-D151 WeakPolarHBondContact O-CB 3.48Å; L147-D151 PolarHBondContact O-N 3.26Å; D151-K155 VanDerWaalsContact CG-NZ 3.33Å; D151-K155 WeakPolarHBondContact O-CD 3.49Å; D151-K155 VanDerWaalsContact O-CG 3.31Å; D151-K155 WeakPolarHBondContact O-CG 3.47Å; D151-K155 PolarHBondContact O-N 2.88Å; D151-K155 WeakPolarHBondContact OD1-CE 3.48Å; D151-K155 IonicContact OD1-NZ 3.22Å; D151-K155 PolarHBondContact OD1-NZ 2.7Å; D151-K155 IonicContact OD2-NZ 2.69Å; D151-K155 PolarHBondContact OD2-NZ 2.75Å
152K88.7Confident81Confident143 Ų143118 Ų11862%0.62258%0.575SS**Hα-helixtrans-70.6-38.8174.4-76.6178.5178.8-171.20112.2R148 I149 E150 K155 L156R148-K152 WeakPolarHBondContact O-CB 3.39Å; R148-K152 VanDerWaalsContact O-CG 3.27Å; R148-K152 WeakPolarHBondContact O-CG 3.39Å; R148-K152 PolarHBondContact O-N 3.5Å; I149-K152 PolarHBondContact O-N 3.15Å; E150-K152 VanDerWaalsContact C-N 3.29Å; E150-K152 PolarHBondContact O-N 3.48Å; K152-K155 PolarHBondContact O-N 2.63Å; K152-L156 WeakPolarHBondContact O-CG 3.05Å; K152-L156 PolarHBondContact O-N 2.6Å; K152-L156 VanDerWaalsContact O-N 3.14Å
153L87.4Confident78.8Confident93 Ų93118.1 Ų118.149%0.48758%0.584SS.*Hα-helixtrans-65.9-44.9178-171.669.8000110.1I149 E150 K155 L156 E157I149-L153 WeakPolarHBondContact O-CB 3.44Å; I149-L153 PolarHBondContact O-N 3.47Å; E150-L153 PolarHBondContact O-N 3.31Å; E150-L153 VanDerWaalsContact O-N 3.12Å; L153-K155 VanDerWaalsContact C-N 3.27Å; L153-K155 PolarHBondContact O-N 2.67Å; L153-L156 CarbonylContact O-C 3.56Å; L153-L156 WeakPolarHBondContact O-CA 3.26Å; L153-L156 PolarHBondContact O-N 3.03Å; L153-E157 HydrophobicContact CG-CG 4.43Å; L153-E157 WeakPolarHBondContact O-CG 3.49Å; L153-E157 PolarHBondContact O-N 2.87Å
154E82.4Confident76.6Confident126 Ų126122.7 Ų122.759%0.58960%0.596SS**Hα-helixtrans-61-36.6177.8-161.7176.3-159.700111.6E150 L156 Q158E150-E154 WeakPolarHBondContact O-CB 3.02Å; E150-E154 PolarHBondContact O-N 2.99Å; E154-L156 VanDerWaalsContact C-N 3.35Å; E154-Q158 WeakPolarHBondContact O-CG 3.48Å; E154-Q158 PolarHBondContact O-N 3.12Å; E154-Q158 VanDerWaalsContact O-N 3.16Å
155K80Confident74.6Confident122 Ų122129 Ų12953%0.5361%0.614SS.*Hα-helixtrans-68.2-29.4172.3-75168-176.3160.30114.1D151 K152 L153D151-K155 VanDerWaalsContact CG-NZ 3.33Å; D151-K155 WeakPolarHBondContact O-CD 3.49Å; D151-K155 VanDerWaalsContact O-CG 3.31Å; D151-K155 WeakPolarHBondContact O-CG 3.47Å; D151-K155 PolarHBondContact O-N 2.88Å; D151-K155 WeakPolarHBondContact OD1-CE 3.48Å; D151-K155 IonicContact OD1-NZ 3.22Å; D151-K155 PolarHBondContact OD1-NZ 2.7Å; D151-K155 IonicContact OD2-NZ 2.69Å; D151-K155 PolarHBondContact OD2-NZ 2.75Å; K152-K155 PolarHBondContact O-N 2.63Å; L153-K155 VanDerWaalsContact C-N 3.27Å; L153-K155 PolarHBondContact O-N 2.67Å
156L76.2Confident72.5Confident142 Ų142129.1 Ų129.174%0.74362%0.624SS**Hα-helixtrans-84.5-31.8176.9-70.2171.2000112K152 L153 E154 Q158K152-L156 WeakPolarHBondContact O-CG 3.05Å; K152-L156 PolarHBondContact O-N 2.6Å; K152-L156 VanDerWaalsContact O-N 3.14Å; L153-L156 CarbonylContact O-C 3.56Å; L153-L156 WeakPolarHBondContact O-CA 3.26Å; L153-L156 PolarHBondContact O-N 3.03Å; E154-L156 VanDerWaalsContact C-N 3.35Å; L156-Q158 PolarHBondContact O-N 2.78Å
157E72.1Confident70.3Confident140 Ų140128.8 Ų128.865%0.65464%0.643SS**Hα-helixtrans-69.3-24173.3-76.7-172.6167.800112.1L153 P159L153-E157 HydrophobicContact CG-CG 4.43Å; L153-E157 WeakPolarHBondContact O-CG 3.49Å; L153-E157 PolarHBondContact O-N 2.87Å; E157-P159 WeakPolarHBondContact O-CD 3.39Å
158Q62.1Low68.1Low129 Ų129135 Ų13560%0.60366%0.661SS**SBendtrans-58.1112.7164.2-74.117528.500108.3E154 L156 A160E154-Q158 WeakPolarHBondContact O-CG 3.48Å; E154-Q158 PolarHBondContact O-N 3.12Å; E154-Q158 VanDerWaalsContact O-N 3.16Å; L156-Q158 PolarHBondContact O-N 2.78Å; Q158-A160 PolarHBondContact O-N 3.05Å
159P58.6Low66Low83 Ų83133.6 Ų133.654%0.53967%0.671SS.*  trans-63109.8-170.523.9-32.8000109.3E157 F161 L162E157-P159 WeakPolarHBondContact O-CD 3.39Å; P159-F161 HydrophobicContact CB-CB 4.26Å; P159-F161 PolarHBondContact O-N 3.03Å; P159-L162 PolarHBondContact O-N 3Å
160A57.9Low63.8Low73 Ų73139.8 Ų139.860%0.60371%0.705SS**G310 helixtrans-55.8-11.4168.900000112.6Q158 L162 S163Q158-A160 PolarHBondContact O-N 3.05Å; A160-L162 PolarHBondContact O-N 3.4Å; A160-S163 PolarHBondContact O-N 2.9Å; A160-S163 PolarHBondContact O-OG 3.14Å
161F52.3Low62.4Low187 Ų187141.5 Ų141.582%0.8272%0.716SS**G310 helixtrans-57.7-21.3173.2-90.1-83.7000115.4P159P159-F161 HydrophobicContact CB-CB 4.26Å; P159-F161 PolarHBondContact O-N 3.03Å
162L51.8Low61Low156 Ų156145.2 Ų145.282%0.81773%0.733SS**G310 helixtrans-90.40.2177.2-66.3178.8000114.6P159 A160P159-L162 PolarHBondContact O-N 3Å; A160-L162 PolarHBondContact O-N 3.4Å
163S51.6Low59.5Low97 Ų97145.3 Ų145.368%0.67874%0.739SS**SBendtrans-101.5-6.2178.170.10000114.9A160 R165A160-S163 PolarHBondContact O-N 2.9Å; A160-S163 PolarHBondContact O-OG 3.14Å; S163-R165 PolarHBondContact O-N 3.4Å
164W48.3Very low57.8Low221 Ų221148.4 Ų148.484%0.83775%0.754SS**  trans-70.582.1154.7-79.768000106.6D166W164-D166 VanDerWaalsContact C-N 3.25Å; W164-D166 PolarHBondContact O-N 2.98Å
165R49.9Very low56.3Low235 Ų235149.8 Ų149.889%0.88776%0.764SS**  trans-55.3105155-96.8-169.8-176.4-157.32.2104.9S163 G167S163-R165 PolarHBondContact O-N 3.4Å; R165-G167 PolarHBondContact O-N 2.99Å
166D50.6Low54.7Low134 Ų134151.6 Ų151.672%0.71778%0.78SS**  trans-44.9110.9165.5-75.5-46.6000107.9W164 R168W164-D166 VanDerWaalsContact C-N 3.25Å; W164-D166 PolarHBondContact O-N 2.98Å; D166-R168 PolarHBondContact O-N 3.23Å
167G49.2Very low53.2Low84 Ų84152.3 Ų152.387%0.86678%0.782SS**  trans-70.853.4170.700000110.6R165R165-G167 PolarHBondContact O-N 2.99Å
168R47Very low51.7Low218 Ų218153.2 Ų153.282%0.82379%0.792SS**  trans-137.889.7176.7-71.4-169.5-164.6179.16.3109D166D166-R168 PolarHBondContact O-N 3.23Å
169T46.6Very low50.9Low133 Ų133155.3 Ų155.382%0.81681%0.808SS**  trans-172.782.4140.930.30000108
170N46.7Very low50.2Low242 Ų242161.8 Ų161.8100%1.29483%0.833SS**  trans171.90131.2-82.7-15.4000109.4

Retrieved 170 of 170 residues in 66.3 ms (Link to these results)