A0A077ZKS4_TRITR Loading...

SecM domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZKS4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 147 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
1M49.7Very low56.7Low243 Ų243132.3 Ų132.3100%1.19784%0.837SS**  0107.40-74.6174.4169.600107.8
2V48.3Very low55.6Low144 Ų144130 Ų13087%0.87383%0.828SS**  trans-140.4110171.1178.40000106.5
3A57.4Low54.7Low102 Ų102132.5 Ų132.584%0.84383%0.831SS**  trans-96.8107.1174.300000107.7S5A3-S5 PolarHBondContact O-N 3.43Å
4A71.4Confident53.5Low90 Ų90129.1 Ų129.174%0.74482%0.823SS**  trans-87.698.2171.900000108.4L6A4-L6 PolarHBondContact O-N 3.24Å
5S61.7Low52.4Low116 Ų116125.9 Ų125.981%0.81181%0.812SS**  trans-76.2100.8169.255.80000108.9A3 G7A3-S5 PolarHBondContact O-N 3.43Å; S5-G7 PolarHBondContact O-N 3.2Å
6L65.9Low51.4Low161 Ų161128.8 Ų128.884%0.84381%0.811SS**  trans-69.8109.1161.5-122.181000106.7A4 L8A4-L6 PolarHBondContact O-N 3.24Å; L6-L8 PolarHBondContact O-N 3.02Å
7G54.9Low51.3Low72 Ų72126.4 Ų126.474%0.74280%0.798SS**  trans-58.9107.6178.800000110.5S5S5-G7 PolarHBondContact O-N 3.2Å
8L58.6Low50.3Low158 Ų158127.8 Ų127.883%0.82780%0.799SS**  trans-63.6133.4158.4-91.486.8000107.6L6 A10L6-L8 PolarHBondContact O-N 3.02Å; L8-A10 PolarHBondContact O-N 3.02Å
9P59.1Low49.3Very low117 Ų117125.5 Ų125.576%0.7679%0.793SS**  trans-63.2109.2166.826.5-30.3000107.4L11P9-L11 VanDerWaalsContact C-N 3.34Å; P9-L11 PolarHBondContact O-N 2.67Å
10A50.2Low49.4Very low82 Ų82125.5 Ų125.568%0.67879%0.794SS**  trans-60.2101.2165.800000107.2L8 S12L8-A10 PolarHBondContact O-N 3.02Å; A10-S12 PolarHBondContact O-N 2.97Å
11L46.7Very low48.7Very low170 Ų170124 Ų12489%0.8979%0.794SS**  trans-67.279.2154.8-73.6171.8000106.3P9 N13P9-L11 VanDerWaalsContact C-N 3.34Å; P9-L11 PolarHBondContact O-N 2.67Å; L11-N13 PolarHBondContact O-N 3.05Å
12S43.1Very low48.2Very low105 Ų105122 Ų12273%0.73478%0.778SS**  trans-62.685.8163-69.50000107.7A10A10-S12 PolarHBondContact O-N 2.97Å
13N44.2Very low47.8Very low162 Ų162120.1 Ų120.187%0.86678%0.778SS**  -154.366.1128.3-140.541000108.2L11L11-N13 PolarHBondContact O-N 3.05Å
14A38.2Very low47.2Very low86 Ų86120.9 Ų120.971%0.71177%0.772SS**  trans-62.6129.4158.800000108.6
15A35.8Very low45.8Very low80 Ų80122.7 Ų122.766%0.66177%0.774SS**  trans55.911113100000117.6
16E36.5Very low44.9Very low172 Ų172127.4 Ų127.480%0.80477%0.774SS**  167.515195.8-94.1-68.5102.500110.8
17P50.8Low43.7Very low89 Ų89127.2 Ų127.258%0.57877%0.774SS**  trans-91.4143179.536.1-26000110.8
18N33.5Very low43.5Very low152 Ų152131.6 Ų131.681%0.81378%0.775SS**  trans176.9124.9136.3-112.9-51.4000111.4
19A31.4Very low42.6Very low84 Ų84131 Ų13169%0.69477%0.768SS**  62154.2128.600000120.7
20P49.9Very low42.4Very low124 Ų124131 Ų13181%0.80577%0.768SS**  trans-108.6-175.7-144.341-33.3000114.1
21A34.6Very low42.4Very low96 Ų96131.6 Ų131.679%0.79377%0.767SS**  trans96.596.7158.400000116.8
22K40.1Very low43Very low200 Ų200127.4 Ų127.487%0.8776%0.756SS**  -161.1111.5121.5-139168.6-177.3178.70111.2T24K22-T24 PolarHBondContact O-N 2.87Å; K22-T24 VanDerWaalsContact O-N 3.09Å
23A39.2Very low43.9Very low105 Ų105130.4 Ų130.487%0.86876%0.756SS**  trans-59.9108.316100000108.3
24T45.9Very low44.8Very low117 Ų117127.9 Ų127.972%0.71875%0.746SS**  trans-118.4105157.4-176.20000107K22 R26K22-T24 PolarHBondContact O-N 2.87Å; K22-T24 VanDerWaalsContact O-N 3.09Å; T24-R26 PolarHBondContact O-N 2.84Å
25T41.4Very low46.3Very low128 Ų128128.8 Ų128.879%0.78574%0.739SS**  trans-57.196.7168.151.20000108.3
26R43.6Very low48.1Very low215 Ų215132 Ų13281%0.81174%0.739SS**  trans-109.3110.2165.4-140.7174.2-178.9165.5-0.7106.7T24 H28T24-R26 PolarHBondContact O-N 2.84Å; R26-H28 PolarHBondContact O-N 2.92Å
27N40.9Very low49.7Very low158 Ų158126 Ų12685%0.84572%0.724SS**  trans-56.681.3173.3-60.2-61.1000109.5E29N27-E29 PolarHBondContact O-N 2.83Å
28H48.8Very low50.6Low163 Ų163128.1 Ų128.176%0.75573%0.725SS**  trans-85.397.1153.4-92.1-74.8000105.6R26 P30R26-H28 PolarHBondContact O-N 2.92Å; H28-P30 WeakPolarHBondContact O-CD 3.47Å
29E40.6Very low52.2Low147 Ų147125.8 Ų125.869%0.68771%0.712SS**  trans-37.2108.4158.2-127.7-68159.300108.4N27 S31N27-E29 PolarHBondContact O-N 2.83Å; E29-S31 PolarHBondContact O-N 2.93Å; E29-S31 WeakPolarHBondContact OE2-CB 3.47Å; E29-S31 PolarHBondContact OE2-N 2.68Å
30P54.2Low53.9Low117 Ų117124.7 Ų124.776%0.7670%0.703SS**  trans-81.536.6-178.234.6-33.5000110.5H28 A32H28-P30 WeakPolarHBondContact O-CD 3.47Å; P30-A32 PolarHBondContact O-N 3.28Å
31S51.2Low54.7Low93 Ų93124.6 Ų124.665%0.6570%0.696SS**  trans-85.917.1170.1-169.20000113.3E29 K33E29-S31 PolarHBondContact O-N 2.93Å; E29-S31 WeakPolarHBondContact OE2-CB 3.47Å; E29-S31 PolarHBondContact OE2-N 2.68Å; S31-K33 VanDerWaalsContact C-N 3.34Å; S31-K33 PolarHBondContact O-N 3.42Å
32A58.2Low56.1Low82 Ų82125.2 Ų125.268%0.67869%0.685SS**  trans-91.275158.200000108.6P30 V34P30-A32 PolarHBondContact O-N 3.28Å; A32-V34 PolarHBondContact O-N 3.06Å
33K62.2Low57.2Low169 Ų169122.7 Ų122.774%0.73568%0.676SS**  trans-55.4103.9165.5-68-179-176.4-177.80107.1S31 N35S31-K33 VanDerWaalsContact C-N 3.34Å; S31-K33 PolarHBondContact O-N 3.42Å; K33-N35 VanDerWaalsContact C-N 3.33Å; K33-N35 PolarHBondContact O-N 3.29Å
34V64.8Low58Low108 Ų108120.5 Ų120.566%0.65566%0.658SS**  trans-65.199.7173.3177.80000106.2A32 F36A32-V34 PolarHBondContact O-N 3.06Å; V34-F36 HydrophobicContact CB-CE2 4.38Å; V34-F36 HydrophobicContact CB-CZ 4.41Å; V34-F36 HydrophobicContact CG1-CE1 4.12Å; V34-F36 HydrophobicContact CG1-CE2 4.28Å; V34-F36 HydrophobicContact CG1-CZ 3.98Å; V34-F36 VanDerWaalsContact O-CD2 3.23Å; V34-F36 WeakPolarHBondContact O-CD2 3.27Å; V34-F36 PolarHBondContact O-N 2.86Å
35N69.8Low58.5Low105 Ų105120.6 Ų120.656%0.56165%0.654SS**  trans-77.487.4-175.6-75.4-45.6000109.6K33 G37 Q38K33-N35 VanDerWaalsContact C-N 3.33Å; K33-N35 PolarHBondContact O-N 3.29Å; N35-G37 PolarHBondContact O-N 3.38Å; N35-Q38 HydrophobicContact CB-CG 4.43Å; N35-Q38 PolarHBondContact O-N 3.44Å
36F72.7Confident59.2Low148 Ų148119 Ų11965%0.64964%0.644SS**THydrogen-bonded Turntrans-57.2-18.1172.7-61.5-78.2000113.4V34 Q38 L39 A40V34-F36 HydrophobicContact CB-CE2 4.38Å; V34-F36 HydrophobicContact CB-CZ 4.41Å; V34-F36 HydrophobicContact CG1-CE1 4.12Å; V34-F36 HydrophobicContact CG1-CE2 4.28Å; V34-F36 HydrophobicContact CG1-CZ 3.98Å; V34-F36 VanDerWaalsContact O-CD2 3.23Å; V34-F36 WeakPolarHBondContact O-CD2 3.27Å; V34-F36 PolarHBondContact O-N 2.86Å; F36-Q38 PolarHBondContact O-N 2.77Å; F36-L39 HydrophobicContact CD1-CD1 4.18Å; F36-L39 WeakPolarHBondContact O-CB 3.2Å; F36-L39 PolarHBondContact O-N 2.89Å; F36-L39 VanDerWaalsContact O-N 3.12Å; F36-A40 PolarHBondContact O-N 3.47Å
37G69.2Low59.8Low47 Ų47119.4 Ų119.449%0.48565%0.646SS.*Hα-helixtrans-59.9-26.8172.800000113.8N35 L39 A40 L41N35-G37 PolarHBondContact O-N 3.38Å; G37-L39 VanDerWaalsContact C-N 3.34Å; G37-A40 PolarHBondContact O-N 3.09Å; G37-L41 WeakPolarHBondContact O-CG 3.48Å; G37-L41 PolarHBondContact O-N 3.21Å
38Q69.9Low60.4Low132 Ų132120.1 Ų120.162%0.61764%0.637SS**Hα-helixtrans-70.6-30.8176-64.5-166.4-67.700112.5N35 F36 L41 L42N35-Q38 HydrophobicContact CB-CG 4.43Å; N35-Q38 PolarHBondContact O-N 3.44Å; F36-Q38 PolarHBondContact O-N 2.77Å; Q38-L41 PolarHBondContact O-N 2.9Å; Q38-L42 WeakPolarHBondContact O-CG 3.45Å; Q38-L42 PolarHBondContact O-N 3.17Å
39L68.8Low60.7Low103 Ų103118.3 Ų118.354%0.53964%0.639SS.*Hα-helixtrans-65.8-43.9174.4-60.3178.5000110.5F36 G37 L41 L42 E43F36-L39 HydrophobicContact CD1-CD1 4.18Å; F36-L39 WeakPolarHBondContact O-CB 3.2Å; F36-L39 PolarHBondContact O-N 2.89Å; F36-L39 VanDerWaalsContact O-N 3.12Å; G37-L39 VanDerWaalsContact C-N 3.34Å; L39-L41 VanDerWaalsContact C-N 3.32Å; L39-L41 PolarHBondContact O-N 2.79Å; L39-L42 WeakPolarHBondContact O-CB 3.4Å; L39-L42 PolarHBondContact O-N 2.7Å; L39-E43 PolarHBondContact O-N 3.12Å
40A66.2Low61.2Low61 Ų61116.1 Ų116.150%0.50463%0.633SS.*Hα-helixtrans-63.4-37.3175.500000112.4F36 G37 A44F36-A40 PolarHBondContact O-N 3.47Å; G37-A40 PolarHBondContact O-N 3.09Å; A40-A44 WeakPolarHBondContact O-CB 3.24Å; A40-A44 PolarHBondContact O-N 2.94Å
41L66.5Low61.3Low123 Ų123116 Ų11664%0.64463%0.634SS**Hα-helixtrans-68.2-36.8174-72.1177.4000112.5G37 Q38 L39 A44 N45G37-L41 WeakPolarHBondContact O-CG 3.48Å; G37-L41 PolarHBondContact O-N 3.21Å; Q38-L41 PolarHBondContact O-N 2.9Å; L39-L41 VanDerWaalsContact C-N 3.32Å; L39-L41 PolarHBondContact O-N 2.79Å; L41-A44 PolarHBondContact O-N 3.3Å; L41-N45 WeakPolarHBondContact O-CB 3.33Å; L41-N45 PolarHBondContact O-N 2.85Å
42L64.8Low61.7Low109 Ų109119.4 Ų119.457%0.57165%0.645SS**Hα-helixtrans-62.1-49.1173.5-78.9161.2000110.5Q38 L39 A44 N45 T46Q38-L42 WeakPolarHBondContact O-CG 3.45Å; Q38-L42 PolarHBondContact O-N 3.17Å; L39-L42 WeakPolarHBondContact O-CB 3.4Å; L39-L42 PolarHBondContact O-N 2.7Å; L42-A44 PolarHBondContact O-N 2.94Å; L42-N45 PolarHBondContact O-N 3.25Å; L42-T46 PolarHBondContact O-N 3.08Å; L42-T46 PolarHBondContact O-OG1 3.24Å
43E63.7Low61.8Low146 Ų146125.7 Ų125.768%0.68265%0.653SS**Hα-helixtrans-59.1-44.7175.7-75.7-170.9-124.200112.5L39 N45 T46 R47L39-E43 PolarHBondContact O-N 3.12Å; E43-N45 VanDerWaalsContact C-N 3.31Å; E43-N45 PolarHBondContact O-N 2.94Å; E43-T46 PolarHBondContact O-N 3.23Å; E43-R47 PolarHBondContact O-N 3.46Å; E43-R47 VanDerWaalsContact O-N 3.15Å
44A56Low62Low59 Ų59122.6 Ų122.649%0.48865%0.653SS.*Hα-helixtrans-66.9-33.1177.500000112.5A40 L41 L42 R47 R48A40-A44 WeakPolarHBondContact O-CB 3.24Å; A40-A44 PolarHBondContact O-N 2.94Å; L41-A44 PolarHBondContact O-N 3.3Å; L42-A44 PolarHBondContact O-N 2.94Å; A44-R47 PolarHBondContact O-N 3.01Å; A44-R48 PolarHBondContact O-N 3.43Å
45N55.1Low62.3Low119 Ų119121.3 Ų121.364%0.63665%0.645SS**Hα-helixtrans-73.5-35.3175.7-17276.9000111.9L41 L42 E43 R47 R48L41-N45 WeakPolarHBondContact O-CB 3.33Å; L41-N45 PolarHBondContact O-N 2.85Å; L42-N45 PolarHBondContact O-N 3.25Å; E43-N45 VanDerWaalsContact C-N 3.31Å; E43-N45 PolarHBondContact O-N 2.94Å; N45-R47 PolarHBondContact O-N 3.34Å; N45-R48 PolarHBondContact O-N 3.1Å
46T56Low62.9Low94 Ų94119.6 Ų119.658%0.57764%0.636SS**Hα-helixtrans-60.6-36.7170.8-540000111.2L42 E43L42-T46 PolarHBondContact O-N 3.08Å; L42-T46 PolarHBondContact O-OG1 3.24Å; E43-T46 PolarHBondContact O-N 3.23Å
47R56Low63.6Low224 Ų224121.6 Ų121.685%0.84564%0.64SS**THydrogen-bonded Turntrans-83.7-11.4-178.4-161.1170.9-177.3-172.81.5114.5E43 A44 N45 P49E43-R47 PolarHBondContact O-N 3.46Å; E43-R47 VanDerWaalsContact O-N 3.15Å; A44-R47 PolarHBondContact O-N 3.01Å; N45-R47 PolarHBondContact O-N 3.34Å; R47-P49 WeakPolarHBondContact O-CD 3.21Å
48R54.8Low64.5Low173 Ų173129.7 Ų129.765%0.65366%0.656SS**  trans-81.2116-176-149.1177.9-178.3-165.42.9109.7A44 N45 N50A44-R48 PolarHBondContact O-N 3.43Å; N45-R48 PolarHBondContact O-N 3.1Å; R48-N50 WeakPolarHBondContact CD-ND2 3.49Å; R48-N50 PolarHBondContact O-N 2.98Å
49P55.3Low65.3Low125 Ų125129 Ų12981%0.81265%0.653SS**  trans-80.558.1-173.235.6-35.9000111.1R47R47-P49 WeakPolarHBondContact O-CD 3.21Å
50N50.7Low66.3Low102 Ų102126.4 Ų126.455%0.54564%0.638SS.*  trans-102.3100.9176.7-56.2-3.8000107.4R48R48-N50 WeakPolarHBondContact CD-ND2 3.49Å; R48-N50 PolarHBondContact O-N 2.98Å
51S55.4Low67.3Low114 Ų114128.5 Ų128.580%0.79764%0.637SS**SBendtrans76.972.1163.1-164.20000117.8Y53S51-Y53 PolarHBondContact O-N 3.3Å
52N59.5Low68.3Low164 Ų164124.9 Ų124.988%0.87763%0.625SS**SBendtrans471.8131.4-103.7-10.6000125
53Y60.4Low69.4Low214 Ų214123.3 Ų123.384%0.83962%0.617SS**  trans-144.510.4177.9-100.1-85.3000116.1S51 V55S51-Y53 PolarHBondContact O-N 3.3Å; Y53-V55 PolarHBondContact O-N 2.88Å
54S66.6Low70.6Confident105 Ų105123.2 Ų123.273%0.73461%0.61SS**  trans-79.691.1171.7-172.70000108.7D56S54-D56 PolarHBondContact O-N 3.35Å
55V71.4Confident72Confident80 Ų80122.8 Ų122.849%0.48560%0.601SS.*  trans-74115.8176.3-156.70000108.6Y53 Y57 Q60Y53-V55 PolarHBondContact O-N 2.88Å; V55-Y57 PolarHBondContact O-N 2.86Å; V55-Q60 VanDerWaalsContact CB-NE2 3.31Å; V55-Q60 HydrophobicContact CG1-CG 3.64Å
56D81.9Confident73.6Confident70 Ų70119.5 Ų119.537%0.37459%0.585SS.*  trans-62.8105.5-179-66.5-41.3000110.2S54 W58 H59 Q60S54-D56 PolarHBondContact O-N 3.35Å; D56-W58 PolarHBondContact O-N 3.26Å; D56-H59 HydrophobicContact CB-CB 3.7Å; D56-H59 WeakPolarHBondContact O-CA 3.3Å; D56-H59 WeakPolarHBondContact O-CB 3.25Å; D56-H59 PolarHBondContact O-N 2.88Å; D56-Q60 PolarHBondContact O-N 2.93Å
57Y87.4Confident75.1Confident189 Ų189119.6 Ų119.674%0.74158%0.581SS**Hα-helixtrans-57.1-34.7-178.6-73.9-76.2000112.8V55 H61V55-Y57 PolarHBondContact O-N 2.86Å; Y57-H61 VanDerWaalsContact O-CB 3.31Å; Y57-H61 WeakPolarHBondContact O-CB 3.32Å; Y57-H61 PolarHBondContact O-N 2.9Å
58W88.2Confident76.4Confident217 Ų217115.9 Ų115.982%0.82257%0.567SS**Hα-helixtrans-63.6-44.5173.6-102.399.6000112.1D56 H61 A62D56-W58 PolarHBondContact O-N 3.26Å; W58-H61 PolarHBondContact O-N 3.42Å; W58-A62 PolarHBondContact O-N 2.9Å
59H86.6Confident77.7Confident117 Ų117113.4 Ų113.454%0.54256%0.563SS.*Hα-helixtrans-66.3-43.4177.8-168.6-166.3000111D56 H61 A62 I63D56-H59 HydrophobicContact CB-CB 3.7Å; D56-H59 WeakPolarHBondContact O-CA 3.3Å; D56-H59 WeakPolarHBondContact O-CB 3.25Å; D56-H59 PolarHBondContact O-N 2.88Å; H59-H61 VanDerWaalsContact C-N 3.3Å; H59-H61 PolarHBondContact O-N 3.25Å; H59-A62 PolarHBondContact O-N 3.36Å; H59-I63 WeakPolarHBondContact O-CG1 3.41Å; H59-I63 PolarHBondContact O-N 2.94Å
60Q89.8Confident79.2Confident49 Ų49109.6 Ų109.623%0.22954%0.535CS..Hα-helixtrans-59.5-41.3172.8-66.7-174.2-9.100112.1V55 D56 R64V55-Q60 VanDerWaalsContact CB-NE2 3.31Å; V55-Q60 HydrophobicContact CG1-CG 3.64Å; D56-Q60 PolarHBondContact O-N 2.93Å; Q60-R64 WeakPolarHBondContact O-CB 3.28Å; Q60-R64 VanDerWaalsContact O-CG 3.28Å; Q60-R64 WeakPolarHBondContact O-CG 3.33Å; Q60-R64 PolarHBondContact O-N 2.94Å
61H87.1Confident80.8Confident105 Ų105107.7 Ų107.749%0.48653%0.53SS..Hα-helixtrans-64-48.2178176.174000110.9Y57 W58 H59 I63 R64 T65Y57-H61 VanDerWaalsContact O-CB 3.31Å; Y57-H61 WeakPolarHBondContact O-CB 3.32Å; Y57-H61 PolarHBondContact O-N 2.9Å; W58-H61 PolarHBondContact O-N 3.42Å; H59-H61 VanDerWaalsContact C-N 3.3Å; H59-H61 PolarHBondContact O-N 3.25Å; H61-I63 PolarHBondContact O-N 3.49Å; H61-R64 PolarHBondContact O-N 3.46Å; H61-T65 PolarHBondContact CE1-OG1 3.34Å; H61-T65 WeakPolarHBondContact O-CB 3.48Å; H61-T65 PolarHBondContact O-N 2.93Å; H61-T65 PolarHBondContact O-OG1 2.93Å
62A87.7Confident81.7Confident47 Ų47106.8 Ų106.839%0.38851%0.512SS..Hα-helixtrans-56.4-48.8176.700000111.6W58 H59 T65 V66W58-A62 PolarHBondContact O-N 2.9Å; H59-A62 PolarHBondContact O-N 3.36Å; A62-T65 PolarHBondContact O-N 3.26Å; A62-V66 WeakPolarHBondContact O-CG2 3.33Å; A62-V66 PolarHBondContact O-N 2.76Å
63I88.9Confident82.4Confident77 Ų77102.8 Ų102.840%0.39550%0.502SS..Hα-helixtrans-61.4-47.9177.1-66.9167.1000111.1H59 H61 T65 V66 I67H59-I63 WeakPolarHBondContact O-CG1 3.41Å; H59-I63 PolarHBondContact O-N 2.94Å; H61-I63 PolarHBondContact O-N 3.49Å; I63-T65 VanDerWaalsContact C-N 3.29Å; I63-T65 PolarHBondContact O-N 2.97Å; I63-V66 PolarHBondContact O-N 3.43Å; I63-I67 HydrophobicContact CG2-CD1 3.66Å; I63-I67 HydrophobicContact CG2-CG1 4.33Å; I63-I67 WeakPolarHBondContact O-CG1 3.45Å; I63-I67 PolarHBondContact O-N 3.32Å
64R87.4Confident82.9Confident144 Ų14498.2 Ų98.254%0.54349%0.489SS..Hα-helixtrans-58.8-40.8177.8-79.5-174.7-155.4107.61.6112Q60 H61 R68Q60-R64 WeakPolarHBondContact O-CB 3.28Å; Q60-R64 VanDerWaalsContact O-CG 3.28Å; Q60-R64 WeakPolarHBondContact O-CG 3.33Å; Q60-R64 PolarHBondContact O-N 2.94Å; H61-R64 PolarHBondContact O-N 3.46Å; R64-R68 VanDerWaalsContact O-CB 3.24Å; R64-R68 WeakPolarHBondContact O-CB 3.4Å; R64-R68 PolarHBondContact O-N 3.47Å
65T86.3Confident82.9Confident49 Ų4994.8 Ų94.830%0.30147%0.468SS..Hα-helixtrans-66.8-45.8-179.5-63.20000110.9H61 A62 I63 R68 H69H61-T65 PolarHBondContact CE1-OG1 3.34Å; H61-T65 WeakPolarHBondContact O-CB 3.48Å; H61-T65 PolarHBondContact O-N 2.93Å; H61-T65 PolarHBondContact O-OG1 2.93Å; A62-T65 PolarHBondContact O-N 3.26Å; I63-T65 VanDerWaalsContact C-N 3.29Å; I63-T65 PolarHBondContact O-N 2.97Å; T65-R68 PolarHBondContact O-N 2.93Å; T65-H69 PolarHBondContact O-CD2 3.27Å; T65-H69 PolarHBondContact O-N 3.48Å
66V88.8Confident82.2Confident51 Ų5196.9 Ų96.931%0.30948%0.483SS..Hα-helixtrans-59.9-52.51751740000110.3A62 I63 R68 H69 L70 L103A62-V66 WeakPolarHBondContact O-CG2 3.33Å; A62-V66 PolarHBondContact O-N 2.76Å; I63-V66 PolarHBondContact O-N 3.43Å; V66-R68 PolarHBondContact O-N 2.96Å; V66-H69 PolarHBondContact O-N 3.45Å; V66-H69 VanDerWaalsContact O-N 3.1Å; V66-L70 HydrophobicContact CG1-CD1 3.75Å; V66-L70 HydrophobicContact CG1-CG 4.25Å; V66-L70 VanDerWaalsContact O-CG 3.3Å; V66-L70 WeakPolarHBondContact O-CG 3.43Å; V66-L70 PolarHBondContact O-N 2.88Å; V66-L103 HydrophobicContact CG1-CD1 4.25Å
67I86.9Confident81.1Confident96 Ų9699.2 Ų99.249%0.49249%0.492SS..Hα-helixtrans-56-41.5177.2-67.2170.8000111I63 L70 S71I63-I67 HydrophobicContact CG2-CD1 3.66Å; I63-I67 HydrophobicContact CG2-CG1 4.33Å; I63-I67 WeakPolarHBondContact O-CG1 3.45Å; I63-I67 PolarHBondContact O-N 3.32Å; I67-L70 PolarHBondContact O-N 3.39Å; I67-S71 WeakPolarHBondContact O-CB 3.35Å; I67-S71 PolarHBondContact O-N 3.2Å; I67-S71 PolarHBondContact O-OG 2.88Å
68R83.9Confident79.2Confident145 Ų14596.8 Ų96.855%0.54750%0.497SS..Hα-helixtrans-63.5-44.1178.6-178.758-177.2-97.13.1111.7R64 T65 V66 S71 F72R64-R68 VanDerWaalsContact O-CB 3.24Å; R64-R68 WeakPolarHBondContact O-CB 3.4Å; R64-R68 PolarHBondContact O-N 3.47Å; T65-R68 PolarHBondContact O-N 2.93Å; V66-R68 PolarHBondContact O-N 2.96Å; R68-S71 PolarHBondContact O-N 2.9Å; R68-F72 HydrophobicContact CG-CD2 3.71Å; R68-F72 HydrophobicContact CG-CE2 3.69Å; R68-F72 VanDerWaalsContact CZ-CE2 3.44Å; R68-F72 VanDerWaalsContact CZ-CZ 3.45Å; R68-F72 VanDerWaalsContact NE-CD2 3.31Å; R68-F72 WeakPolarHBondContact O-CB 3.42Å; R68-F72 WeakPolarHBondContact O-CD2 3.31Å; R68-F72 PolarHBondContact O-N 2.96Å
69H82.5Confident77Confident121 Ų12193.2 Ų93.256%0.5649%0.493SS*.Hα-helixtrans-65.4-41.9177.5-75.4-60.3000112.2T65 V66 F72 A73T65-H69 PolarHBondContact O-CD2 3.27Å; T65-H69 PolarHBondContact O-N 3.48Å; V66-H69 PolarHBondContact O-N 3.45Å; V66-H69 VanDerWaalsContact O-N 3.1Å; H69-F72 PolarHBondContact O-N 2.83Å; H69-A73 WeakPolarHBondContact O-CB 3.33Å; H69-A73 PolarHBondContact O-N 2.92Å
70L86.1Confident75.1Confident45 Ų4593.5 Ų93.524%0.23651%0.505CS..Hα-helixtrans-65.9-43175.8-60.3176.3000111.2V66 I67 F72 A73 M74 L96V66-L70 HydrophobicContact CG1-CD1 3.75Å; V66-L70 HydrophobicContact CG1-CG 4.25Å; V66-L70 VanDerWaalsContact O-CG 3.3Å; V66-L70 WeakPolarHBondContact O-CG 3.43Å; V66-L70 PolarHBondContact O-N 2.88Å; I67-L70 PolarHBondContact O-N 3.39Å; L70-F72 VanDerWaalsContact C-N 3.29Å; L70-F72 PolarHBondContact O-N 3.34Å; L70-A73 PolarHBondContact O-N 3.02Å; L70-M74 WeakPolarHBondContact O-CB 3.46Å; L70-M74 WeakPolarHBondContact O-CG 3.32Å; L70-M74 PolarHBondContact O-N 3.22Å; L70-L96 HydrophobicContact CB-CD2 3.64Å; L70-L96 HydrophobicContact CD1-CD2 3.51Å; L70-L96 HydrophobicContact CD2-CD2 3.17Å; L70-L96 HydrophobicContact CG-CD2 3.52Å
71S84.6Confident72.9Confident62 Ų6297 Ų9743%0.43453%0.53SS..Hα-helixtrans-61.9-36.7174.5-58.30000111.8I67 R68 A75I67-S71 WeakPolarHBondContact O-CB 3.35Å; I67-S71 PolarHBondContact O-N 3.2Å; I67-S71 PolarHBondContact O-OG 2.88Å; R68-S71 PolarHBondContact O-N 2.9Å; S71-A75 WeakPolarHBondContact O-CA 3.35Å; S71-A75 VanDerWaalsContact O-CB 3.27Å; S71-A75 WeakPolarHBondContact O-CB 3.49Å; S71-A75 PolarHBondContact O-N 3.43Å
72F74.6Confident70.9Confident95 Ų9595.9 Ų95.942%0.41754%0.538SS..Hα-helixtrans-70.2-37.9173.9-89.5-59.1000112.9R68 H69 L70 M74 A75 Q77R68-F72 HydrophobicContact CG-CD2 3.71Å; R68-F72 HydrophobicContact CG-CE2 3.69Å; R68-F72 VanDerWaalsContact CZ-CE2 3.44Å; R68-F72 VanDerWaalsContact CZ-CZ 3.45Å; R68-F72 VanDerWaalsContact NE-CD2 3.31Å; R68-F72 WeakPolarHBondContact O-CB 3.42Å; R68-F72 WeakPolarHBondContact O-CD2 3.31Å; R68-F72 PolarHBondContact O-N 2.96Å; H69-F72 PolarHBondContact O-N 2.83Å; L70-F72 VanDerWaalsContact C-N 3.29Å; L70-F72 PolarHBondContact O-N 3.34Å; F72-M74 VanDerWaalsContact C-N 3.28Å; F72-A75 PolarHBondContact O-N 2.86Å; F72-Q77 PolarHBondContact O-NE2 2.94Å
73A74.1Confident69.2Low80 Ų80103.1 Ų103.166%0.66156%0.564SS**Hα-helixtrans-67.3-32.3175.200000111.8H69 L70H69-A73 WeakPolarHBondContact O-CB 3.33Å; H69-A73 PolarHBondContact O-N 2.92Å; L70-A73 PolarHBondContact O-N 3.02Å
74M70.3Confident67.1Low118 Ų118108 Ų10858%0.58159%0.585SS**Hα-helixtrans-86.7-19.3175.2-66179.77700113.9L70 F72 L96L70-M74 WeakPolarHBondContact O-CB 3.46Å; L70-M74 WeakPolarHBondContact O-CG 3.32Å; L70-M74 PolarHBondContact O-N 3.22Å; F72-M74 VanDerWaalsContact C-N 3.28Å; M74-L96 HydrophobicContact CE-CD1 4.36Å; M74-L96 HydrophobicContact CG-CD1 4.17Å; M74-L96 HydrophobicContact SD-CD1 3.52Å; M74-L96 VanDerWaalsContact SD-CD1 3.52Å
75A65.7Low65.4Low34 Ų34104.5 Ų104.528%0.28158%0.583SS.*SBendtrans-59.1128178.500000107.8S71 F72 Q77S71-A75 WeakPolarHBondContact O-CA 3.35Å; S71-A75 VanDerWaalsContact O-CB 3.27Å; S71-A75 WeakPolarHBondContact O-CB 3.49Å; S71-A75 PolarHBondContact O-N 3.43Å; F72-A75 PolarHBondContact O-N 2.86Å; A75-Q77 WeakPolarHBondContact O-CG 3.25Å; A75-Q77 PolarHBondContact O-N 3.47Å
76P56.7Low64Low124 Ų124109.3 Ų109.381%0.80561%0.606SS**  trans-65.685.5-179.1-1528.2000108.7T78P76-T78 PolarHBondContact O-N 3.21Å
77Q59.1Low62.5Low119 Ų119111.5 Ų111.556%0.55662%0.621SS**  trans-58.9117.9165.9-40.8-57.29.100103.6F72 A75 L79F72-Q77 PolarHBondContact O-NE2 2.94Å; A75-Q77 WeakPolarHBondContact O-CG 3.25Å; A75-Q77 PolarHBondContact O-N 3.47Å; Q77-L79 PolarHBondContact O-N 2.83Å
78T47.4Very low61.4Low138 Ų138110.9 Ų110.985%0.84762%0.618SS**  trans-64.767.5176.644.30000109.4P76 P80P76-T78 PolarHBondContact O-N 3.21Å; T78-P80 WeakPolarHBondContact O-CD 3.42Å
79L42.4Very low60.9Low141 Ų141110 Ų11074%0.73862%0.621SS**  trans-107.597162.9-80.8176.7000106.2Q77 V81Q77-L79 PolarHBondContact O-N 2.83Å; L79-V81 VanDerWaalsContact C-N 3.32Å; L79-V81 PolarHBondContact O-N 2.78Å
80P47.3Very low60.4Low123 Ų123107 Ų10780%0.79962%0.617SS**  trans-75.390.7171.631.5-29000107.3T78T78-P80 WeakPolarHBondContact O-CD 3.42Å
81V44.1Very low60Low124 Ų124110.9 Ų110.975%0.75263%0.634SS**  trans-139.188164.2-172.80000108.5L79L79-V81 VanDerWaalsContact C-N 3.32Å; L79-V81 PolarHBondContact O-N 2.78Å
82A44.1Very low59.6Low80 Ų80112.8 Ų112.866%0.66164%0.636SS**  trans45.9103.5141.800000119.2E84A82-E84 VanDerWaalsContact C-N 3.34Å; A82-E84 PolarHBondContact O-N 3.34Å
83E51.4Low60Low199 Ų199112.9 Ų112.993%0.9364%0.64SS**SBend48.527118.5-64.4-82.7138.500120.3
84E46Very low60.2Low181 Ų181111.6 Ų111.685%0.84663%0.629SS**  trans-136.410.9174.4-128159.6171.400116.3A82A82-E84 VanDerWaalsContact C-N 3.34Å; A82-E84 PolarHBondContact O-N 3.34Å
85S50.8Low60.8Low70 Ų70110.3 Ų110.349%0.4962%0.624SS.*  trans-108.422.2-172.1680000116.4L88 Q89S85-L88 PolarHBondContact O-N 3.37Å; S85-Q89 PolarHBondContact O-N 3.01Å
86L56.7Low61.6Low149 Ų149110.3 Ų110.378%0.7862%0.619SS**Hα-helixtrans-58.7-41.9174.8-140.1160.7000113.4
87P57.2Low62.5Low98 Ų98110 Ų11064%0.63661%0.611SS**Hα-helixtrans-72.7-30.9175.127.5-33.6000113.1A90 Q91P87-A90 PolarHBondContact O-N 3.43Å; P87-Q91 PolarHBondContact O-N 2.99Å; P87-Q91 VanDerWaalsContact O-N 3.12Å
88L65.1Low63.4Low82 Ų82108.2 Ų108.243%0.42961%0.608SS.*Hα-helixtrans-70.1-37.5-179-167.974.5000111.5S85 Q91 H92S85-L88 PolarHBondContact O-N 3.37Å; L88-Q91 WeakPolarHBondContact O-CB 3.19Å; L88-Q91 PolarHBondContact O-N 3.26Å; L88-H92 PolarHBondContact O-CD2 3.02Å; L88-H92 VanDerWaalsContact O-CG 3.27Å; L88-H92 PolarHBondContact O-N 2.81Å
89Q72Confident64.9Low127 Ų127104.8 Ų104.859%0.59358%0.584SS**Hα-helixtrans-66-38.9177-171.1168.816.400112.4S85 Q91 H92 L93S85-Q89 PolarHBondContact O-N 3.01Å; Q89-Q91 VanDerWaalsContact C-N 3.33Å; Q89-H92 PolarHBondContact O-N 3.07Å; Q89-L93 PolarHBondContact O-N 3.03Å
90A73.1Confident66.5Low59 Ų59101.2 Ų101.249%0.48857%0.571SS.*Hα-helixtrans-63.8-39.9173.300000111.5P87 L93 A94P87-A90 PolarHBondContact O-N 3.43Å; A90-L93 PolarHBondContact O-N 2.85Å; A90-A94 WeakPolarHBondContact O-CB 3.29Å; A90-A94 PolarHBondContact O-N 2.74Å
91Q77Confident67.6Low126 Ų12696.8 Ų96.859%0.58955%0.545SS*.Hα-helixtrans-64.9-40.5174.1-176.1178.1-700112P87 L88 Q89 A94 L95P87-Q91 PolarHBondContact O-N 2.99Å; P87-Q91 VanDerWaalsContact O-N 3.12Å; L88-Q91 WeakPolarHBondContact O-CB 3.19Å; L88-Q91 PolarHBondContact O-N 3.26Å; Q89-Q91 VanDerWaalsContact C-N 3.33Å; Q91-A94 PolarHBondContact O-N 3.17Å; Q91-L95 WeakPolarHBondContact O-CB 3.23Å; Q91-L95 PolarHBondContact O-N 3.37Å
92H76.9Confident69.1Low102 Ų10295.5 Ų95.547%0.47253%0.533SS..Hα-helixtrans-61.7-45.2174.9-69.7-175.1000110.8L88 Q89 L95 L96L88-H92 PolarHBondContact O-CD2 3.02Å; L88-H92 VanDerWaalsContact O-CG 3.27Å; L88-H92 PolarHBondContact O-N 2.81Å; Q89-H92 PolarHBondContact O-N 3.07Å; H92-L95 PolarHBondContact O-N 2.87Å; H92-L96 VanDerWaalsContact O-CG 3.25Å; H92-L96 WeakPolarHBondContact O-CG 3.33Å; H92-L96 PolarHBondContact O-N 3.47Å
93L82.2Confident70.4Confident97 Ų9796.1 Ų96.151%0.50853%0.525SS..Hα-helixtrans-61.4-43.6175-78.7171.1000112.5Q89 A90 L95 L96 D97Q89-L93 PolarHBondContact O-N 3.03Å; A90-L93 PolarHBondContact O-N 2.85Å; L93-L95 VanDerWaalsContact C-N 3.3Å; L93-L95 PolarHBondContact O-N 2.89Å; L93-L96 HydrophobicContact CD2-CD1 4.42Å; L93-L96 PolarHBondContact O-N 3.42Å; L93-D97 WeakPolarHBondContact O-CB 3.42Å; L93-D97 PolarHBondContact O-N 2.97Å
94A77.9Confident71.1Confident52 Ų5291 Ų9143%0.4351%0.507SS..Hα-helixtrans-63-36.6176.100000112.3A90 Q91 D97 T98A90-A94 WeakPolarHBondContact O-CB 3.29Å; A90-A94 PolarHBondContact O-N 2.74Å; Q91-A94 PolarHBondContact O-N 3.17Å; A94-D97 PolarHBondContact O-N 3.19Å; A94-T98 WeakPolarHBondContact O-CB 3.44Å; A94-T98 VanDerWaalsContact O-CG2 3.25Å; A94-T98 WeakPolarHBondContact O-CG2 3.09Å; A94-T98 PolarHBondContact O-N 3.37Å; A94-T98 PolarHBondContact O-OG1 3.18Å
95L83.4Confident71.8Confident91 Ų9188.3 Ų88.348%0.47650%0.495SS..Hα-helixtrans-66.5-42.9175.3-171.8152.5000111.2Q91 H92 L93 D97 T98 L99Q91-L95 WeakPolarHBondContact O-CB 3.23Å; Q91-L95 PolarHBondContact O-N 3.37Å; H92-L95 PolarHBondContact O-N 2.87Å; L93-L95 VanDerWaalsContact C-N 3.3Å; L93-L95 PolarHBondContact O-N 2.89Å; L95-D97 VanDerWaalsContact C-N 3.34Å; L95-D97 PolarHBondContact O-N 3.43Å; L95-T98 WeakPolarHBondContact CA-OG1 3.44Å; L95-T98 PolarHBondContact O-N 3Å; L95-T98 PolarHBondContact O-OG1 3.05Å; L95-L99 HydrophobicContact CD2-CD1 3.48Å; L95-L99 VanDerWaalsContact CD2-CD1 3.48Å; L95-L99 HydrophobicContact CD2-CG 4.03Å; L95-L99 WeakPolarHBondContact O-CB 3.35Å; L95-L99 WeakPolarHBondContact O-CG 3.46Å; L95-L99 PolarHBondContact O-N 3.06Å
96L82Confident72Confident34 Ų3491.3 Ų91.318%0.17850%0.501CS..Hα-helixtrans-60.9-44.6175.4-65.7172.5000111.7L70 M74 H92 L93 L99 S100L70-L96 HydrophobicContact CB-CD2 3.64Å; L70-L96 HydrophobicContact CD1-CD2 3.51Å; L70-L96 HydrophobicContact CD2-CD2 3.17Å; L70-L96 HydrophobicContact CG-CD2 3.52Å; M74-L96 HydrophobicContact CE-CD1 4.36Å; M74-L96 HydrophobicContact CG-CD1 4.17Å; M74-L96 HydrophobicContact SD-CD1 3.52Å; M74-L96 VanDerWaalsContact SD-CD1 3.52Å; H92-L96 VanDerWaalsContact O-CG 3.25Å; H92-L96 WeakPolarHBondContact O-CG 3.33Å; H92-L96 PolarHBondContact O-N 3.47Å; L93-L96 HydrophobicContact CD2-CD1 4.42Å; L93-L96 PolarHBondContact O-N 3.42Å; L96-L99 PolarHBondContact O-N 3.12Å; L96-S100 VanDerWaalsContact O-CB 3.32Å; L96-S100 WeakPolarHBondContact O-CB 3.49Å; L96-S100 PolarHBondContact O-N 3.25Å
97D77Confident71.9Confident118 Ų11886.9 Ų86.963%0.63149%0.491SS*.Hα-helixtrans-66.6-43.1-179.5-163.834.5000111.6L93 A94 L95 S100 A101L93-D97 WeakPolarHBondContact O-CB 3.42Å; L93-D97 PolarHBondContact O-N 2.97Å; A94-D97 PolarHBondContact O-N 3.19Å; L95-D97 VanDerWaalsContact C-N 3.34Å; L95-D97 PolarHBondContact O-N 3.43Å; D97-S100 WeakPolarHBondContact O-CB 3.26Å; D97-S100 PolarHBondContact O-N 2.86Å; D97-A101 WeakPolarHBondContact O-CB 3.45Å; D97-A101 PolarHBondContact O-N 2.83Å
98T77.2Confident71.5Confident81 Ų8186.7 Ų86.750%0.49749%0.489SS..Hα-helixtrans-65.2-40.8175.151.20000113A94 L95 A101 L102A94-T98 WeakPolarHBondContact O-CB 3.44Å; A94-T98 VanDerWaalsContact O-CG2 3.25Å; A94-T98 WeakPolarHBondContact O-CG2 3.09Å; A94-T98 PolarHBondContact O-N 3.37Å; A94-T98 PolarHBondContact O-OG1 3.18Å; L95-T98 WeakPolarHBondContact CA-OG1 3.44Å; L95-T98 PolarHBondContact O-N 3Å; L95-T98 PolarHBondContact O-OG1 3.05Å; T98-A101 PolarHBondContact O-N 2.91Å; T98-L102 WeakPolarHBondContact O-CB 3.5Å; T98-L102 WeakPolarHBondContact O-CG 3.23Å; T98-L102 PolarHBondContact O-N 3.45Å
99L79.8Confident70.8Confident67 Ų6788.3 Ų88.335%0.35150%0.504SS..Hα-helixtrans-65.6-39.9174.4-74.4-178.1000112L95 L96 A101 L102 L103L95-L99 HydrophobicContact CD2-CD1 3.48Å; L95-L99 VanDerWaalsContact CD2-CD1 3.48Å; L95-L99 HydrophobicContact CD2-CG 4.03Å; L95-L99 WeakPolarHBondContact O-CB 3.35Å; L95-L99 WeakPolarHBondContact O-CG 3.46Å; L95-L99 PolarHBondContact O-N 3.06Å; L96-L99 PolarHBondContact O-N 3.12Å; L99-A101 VanDerWaalsContact C-N 3.34Å; L99-L102 PolarHBondContact O-N 2.97Å; L99-L103 WeakPolarHBondContact O-CB 3.15Å; L99-L103 VanDerWaalsContact O-CG 3.29Å; L99-L103 WeakPolarHBondContact O-CG 3.48Å; L99-L103 PolarHBondContact O-N 3.43Å
100S76.1Confident69.6Low66 Ų6686.5 Ų86.546%0.46251%0.505SS..Hα-helixtrans-61.9-43.9173.7-174.80000111.2L96 D97 L103 T104L96-S100 VanDerWaalsContact O-CB 3.32Å; L96-S100 WeakPolarHBondContact O-CB 3.49Å; L96-S100 PolarHBondContact O-N 3.25Å; D97-S100 WeakPolarHBondContact O-CB 3.26Å; D97-S100 PolarHBondContact O-N 2.86Å; S100-L103 PolarHBondContact O-N 3.41Å; S100-T104 WeakPolarHBondContact O-CB 3.14Å; S100-T104 WeakPolarHBondContact O-CG2 3.13Å; S100-T104 PolarHBondContact O-N 3.46Å; S100-T104 PolarHBondContact O-OG1 3.48Å
101A70.8Confident68.4Low29 Ų2992.8 Ų92.824%0.2453%0.525CS..Hα-helixtrans-63.2-42.8175.300000111.9D97 T98 L99 T104 Q105D97-A101 WeakPolarHBondContact O-CB 3.45Å; D97-A101 PolarHBondContact O-N 2.83Å; T98-A101 PolarHBondContact O-N 2.91Å; L99-A101 VanDerWaalsContact C-N 3.34Å; A101-T104 WeakPolarHBondContact CA-OG1 2.93Å; A101-T104 PolarHBondContact O-N 3.36Å; A101-T104 PolarHBondContact O-OG1 3.15Å; A101-T104 VanDerWaalsContact O-OG1 3.07Å; A101-Q105 WeakPolarHBondContact O-CB 3.08Å; A101-Q105 WeakPolarHBondContact O-CG 3.45Å; A101-Q105 PolarHBondContact O-N 2.62Å
102L74.3Confident67.1Low98 Ų9895 Ų9551%0.51353%0.532SS..Hα-helixtrans-62.4-50.7176-74.9173.6000111T98 L99 T104 Q105 E106T98-L102 WeakPolarHBondContact O-CB 3.5Å; T98-L102 WeakPolarHBondContact O-CG 3.23Å; T98-L102 PolarHBondContact O-N 3.45Å; L99-L102 PolarHBondContact O-N 2.97Å; L102-T104 PolarHBondContact O-N 2.8Å; L102-Q105 PolarHBondContact O-N 2.93Å; L102-E106 VanDerWaalsContact O-CB 3.26Å; L102-E106 WeakPolarHBondContact O-CB 3.32Å; L102-E106 WeakPolarHBondContact O-CG 3.35Å; L102-E106 PolarHBondContact O-N 2.95Å; L102-E106 VanDerWaalsContact O-OE1 3.08Å
103L70.9Confident65.7Low92 Ų9293.5 Ų93.548%0.48254%0.544SS..Hα-helixtrans-61.4-31.2-179.8-70.7170.1000113.4V66 L99 S100 E106V66-L103 HydrophobicContact CG1-CD1 4.25Å; L99-L103 WeakPolarHBondContact O-CB 3.15Å; L99-L103 VanDerWaalsContact O-CG 3.29Å; L99-L103 WeakPolarHBondContact O-CG 3.48Å; L99-L103 PolarHBondContact O-N 3.43Å; S100-L103 PolarHBondContact O-N 3.41Å; L103-E106 VanDerWaalsContact CA-OE1 3.23Å; L103-E106 WeakPolarHBondContact CA-OE1 3.38Å; L103-E106 PolarHBondContact N-OE1 3.34Å
104T67.9Low64.3Low92 Ų9299 Ų9956%0.56456%0.56SS**Hα-helixtrans-84.1-34.5176.2520000113S100 A101 L102S100-T104 WeakPolarHBondContact O-CB 3.14Å; S100-T104 WeakPolarHBondContact O-CG2 3.13Å; S100-T104 PolarHBondContact O-N 3.46Å; S100-T104 PolarHBondContact O-OG1 3.48Å; A101-T104 WeakPolarHBondContact CA-OG1 2.93Å; A101-T104 PolarHBondContact O-N 3.36Å; A101-T104 PolarHBondContact O-OG1 3.15Å; A101-T104 VanDerWaalsContact O-OG1 3.07Å; L102-T104 PolarHBondContact O-N 2.8Å
105Q58.9Low63Low124 Ų124106.3 Ų106.358%0.57958%0.577SS**Hα-helixtrans-81.9-37.8179.4-70.3176.128.600112.9A101 L102 G107 T108A101-Q105 WeakPolarHBondContact O-CB 3.08Å; A101-Q105 WeakPolarHBondContact O-CG 3.45Å; A101-Q105 PolarHBondContact O-N 2.62Å; L102-Q105 PolarHBondContact O-N 2.93Å; Q105-G107 PolarHBondContact O-N 3.31Å; Q105-T108 WeakPolarHBondContact O-CB 3.43Å; Q105-T108 PolarHBondContact O-N 2.75Å; Q105-T108 PolarHBondContact O-OG1 3.05Å
106E56.2Low61.8Low133 Ų133107.7 Ų107.762%0.62158%0.583SS**THydrogen-bonded Turntrans-66.1-24.9174.375.9-167.699.200111.6L102 L103 T108L102-E106 VanDerWaalsContact O-CB 3.26Å; L102-E106 WeakPolarHBondContact O-CB 3.32Å; L102-E106 WeakPolarHBondContact O-CG 3.35Å; L102-E106 PolarHBondContact O-N 2.95Å; L102-E106 VanDerWaalsContact O-OE1 3.08Å; L103-E106 VanDerWaalsContact CA-OE1 3.23Å; L103-E106 WeakPolarHBondContact CA-OE1 3.38Å; L103-E106 PolarHBondContact N-OE1 3.34Å; E106-T108 VanDerWaalsContact C-N 3.28Å
107G53.8Low60.3Low56 Ų56111.4 Ų111.458%0.57760%0.603SS**THydrogen-bonded Turntrans-72.6-13.5168.800000114.5Q105 P109Q105-G107 PolarHBondContact O-N 3.31Å; G107-P109 WeakPolarHBondContact O-CD 3.43Å
108T49Very low59.5Low95 Ų95115.4 Ų115.458%0.58361%0.611SS**SBendtrans-80.9104.816258.10000106.9Q105 E106 S110Q105-T108 WeakPolarHBondContact O-CB 3.43Å; Q105-T108 PolarHBondContact O-N 2.75Å; Q105-T108 PolarHBondContact O-OG1 3.05Å; E106-T108 VanDerWaalsContact C-N 3.28Å; T108-S110 VanDerWaalsContact C-N 3.29Å; T108-S110 PolarHBondContact O-N 3.25Å
109P50.7Low58.6Low116 Ų116115.8 Ų115.875%0.75362%0.622SS**  trans-60.6103.917326.3-32.2000105.4G107 E111G107-P109 WeakPolarHBondContact O-CD 3.43Å; P109-E111 PolarHBondContact O-N 2.7Å
110S47.1Very low57.6Low88 Ų88121.2 Ų121.262%0.61565%0.645SS**  trans-53.3113172.4-1640000104.8T108 K112T108-S110 VanDerWaalsContact C-N 3.29Å; T108-S110 PolarHBondContact O-N 3.25Å; S110-K112 PolarHBondContact O-N 2.84Å
111E48Very low56.9Low192 Ų192125.8 Ų125.890%0.89766%0.657SS**  trans-65.634.7-178.4-162.6-171161.500111P109 G113P109-E111 PolarHBondContact O-N 2.7Å; E111-G113 PolarHBondContact O-N 2.83Å
112K48.1Very low56.5Low171 Ų171129.9 Ų129.974%0.74368%0.679SS**  trans-78.978.8159.7-64.1-175.3-174.6176.60105S110 Y114S110-K112 PolarHBondContact O-N 2.84Å; K112-Y114 VanDerWaalsContact C-N 3.29Å; K112-Y114 PolarHBondContact O-N 2.8Å
113G48.1Very low55.9Low71 Ų71130.4 Ų130.473%0.73269%0.688SS**  trans-48.298.6170.600000108.6E111 R115E111-G113 PolarHBondContact O-N 2.83Å; G113-R115 PolarHBondContact O-N 3.4Å
114Y52.7Low55.5Low214 Ų214134 Ų13484%0.83970%0.703SS**  trans-64.495.2157.5-116.8-88.4000103.7K112 I116K112-Y114 VanDerWaalsContact C-N 3.29Å; K112-Y114 PolarHBondContact O-N 2.8Å; Y114-I116 PolarHBondContact O-N 3.26Å
115R51.6Low55.5Low205 Ų205133.8 Ų133.877%0.77471%0.711SS**  trans-61.489161.6-178.1179.4174.2156.64.1104.5G113 D117G113-R115 PolarHBondContact O-N 3.4Å; R115-D117 WeakPolarHBondContact CD-OD1 3.47Å; R115-D117 WeakPolarHBondContact CG-OD1 3.3Å; R115-D117 IonicContact CZ-OD1 3.72Å; R115-D117 IonicContact NE-OD1 2.82Å; R115-D117 PolarHBondContact NE-OD1 3.26Å; R115-D117 IonicContact NH2-OD1 3.85Å; R115-D117 PolarHBondContact O-N 2.93Å
116I57.4Low56.1Low120 Ų120137.3 Ų137.362%0.61572%0.724SS**  trans-68.192.5163.8-58.5-162.2000103.2Y114 Y118Y114-I116 PolarHBondContact O-N 3.26Å; I116-Y118 VanDerWaalsContact C-N 3.3Å; I116-Y118 WeakPolarHBondContact O-CD2 3.29Å; I116-Y118 PolarHBondContact O-N 3.33Å
117D50.9Low57.1Low111 Ų111138.5 Ų138.559%0.59473%0.727SS**  trans-57.6107.4162.9-73.3-37.3000104.5R115 A119R115-D117 WeakPolarHBondContact CD-OD1 3.47Å; R115-D117 WeakPolarHBondContact CG-OD1 3.3Å; R115-D117 IonicContact CZ-OD1 3.72Å; R115-D117 IonicContact NE-OD1 2.82Å; R115-D117 PolarHBondContact NE-OD1 3.26Å; R115-D117 IonicContact NH2-OD1 3.85Å; R115-D117 PolarHBondContact O-N 2.93Å; D117-A119 PolarHBondContact O-N 3.06Å
118Y60.6Low58.3Low202 Ų202138.1 Ų138.179%0.79272%0.716SS**  trans-59.688.2170.1-66.6-91.9000105.7I116 H120I116-Y118 VanDerWaalsContact C-N 3.3Å; I116-Y118 WeakPolarHBondContact O-CD2 3.29Å; I116-Y118 PolarHBondContact O-N 3.33Å; Y118-H120 PolarHBondContact O-N 3.41Å
119A58Low59.8Low89 Ų89137.7 Ų137.774%0.73671%0.713SS**  trans-51.6111.9165.100000104.3D117 F121D117-A119 PolarHBondContact O-N 3.06Å; A119-F121 VanDerWaalsContact C-N 3.34Å; A119-F121 PolarHBondContact O-N 2.75Å
120H59.6Low61Low181 Ų181135.6 Ų135.684%0.83870%0.7SS**  trans-48.9101.4-170.7-69.9-84000108.6Y118 T122Y118-H120 PolarHBondContact O-N 3.41Å; H120-T122 PolarHBondContact O-N 3.04Å
121F60.3Low62.6Low163 Ų163135.2 Ų135.272%0.71569%0.693SS**  trans-68.495.7174.2-175.7-95.6000104.9A119 P123A119-F121 VanDerWaalsContact C-N 3.34Å; A119-F121 PolarHBondContact O-N 2.75Å; F121-P123 WeakPolarHBondContact O-CD 3.27Å
122T62Low64.2Low115 Ų115132.9 Ų132.971%0.70668%0.677SS**  trans-55.2115.9169.253.20000105.4H120 Q124H120-T122 PolarHBondContact O-N 3.04Å; T122-Q124 PolarHBondContact O-N 3.17Å
123P62.6Low65.6Low108 Ų108128.1 Ų128.170%0.70166%0.659SS**  trans-58.2107.4-176.7-21.531.6000107.7F121 A125F121-P123 WeakPolarHBondContact O-CD 3.27Å; P123-A125 PolarHBondContact O-N 2.97Å
124Q61.4Low67.1Low168 Ų168127.2 Ų127.279%0.78564%0.641SS**  trans-55.1129.2175.6-170.4172.93.900106.9T122 K126T122-Q124 PolarHBondContact O-N 3.17Å; Q124-K126 PolarHBondContact O-N 2.78Å
125A68Low68.3Low88 Ų88124.1 Ų124.173%0.72763%0.634SS**  trans-22.8120.8-167.300000114.7P123 F127P123-A125 PolarHBondContact O-N 2.97Å; A125-F127 PolarHBondContact O-N 2.99Å
126K73Confident69.6Low198 Ų198117.8 Ų117.886%0.86163%0.625SS**  trans-46.1113.5174.2-68.4178.5-178.8177.30109.2Q124 S128Q124-K126 PolarHBondContact O-N 2.78Å; K126-S128 PolarHBondContact O-N 3.14Å
127F76.5Confident70.4Confident157 Ų157118.3 Ų118.369%0.68963%0.626SS**  trans-59.2121.9173.5175.8-95.8000108.5A125 T129 W132A125-F127 PolarHBondContact O-N 2.99Å; F127-T129 HydrophobicContact CE1-CG2 4.11Å; F127-W132 HydrophobicContact CE2-CB 3.76Å; F127-W132 AromaticContact CE2-CG 3.88Å; F127-W132 HydrophobicContact CE2-CG 3.88Å; F127-W132 HydrophobicContact CZ-CB 4.01Å; F127-W132 HydrophobicContact CZ-CD2 4.41Å; F127-W132 HydrophobicContact CZ-CG 4.1Å
128S78.9Confident71.1Confident49 Ų49115.8 Ų115.834%0.34363%0.626SS.*  trans-126.8124.8177.6-176.20000108.2K126 P130 V131 W132K126-S128 PolarHBondContact O-N 3.14Å; S128-P130 VanDerWaalsContact OG-CD 3.25Å; S128-P130 WeakPolarHBondContact OG-CD 3.34Å; S128-P130 VanDerWaalsContact OG-CG 3.3Å; S128-P130 WeakPolarHBondContact OG-CG 3.49Å; S128-V131 WeakPolarHBondContact O-CB 3.25Å; S128-V131 PolarHBondContact O-N 3.36Å; S128-W132 PolarHBondContact O-N 3.17Å
129T79.7Confident71.3Confident85 Ų85111 Ų11152%0.52161%0.612SS.*Hα-helixtrans-52.3-42.9-179.247.10000113.8F127 V131 W132 I133F127-T129 HydrophobicContact CE1-CG2 4.11Å; T129-V131 VanDerWaalsContact C-N 3.33Å; T129-V131 PolarHBondContact O-N 2.97Å; T129-W132 PolarHBondContact O-N 3.03Å; T129-I133 VanDerWaalsContact O-CG1 3.27Å; T129-I133 WeakPolarHBondContact O-CG1 3.46Å; T129-I133 PolarHBondContact O-N 2.96Å
130P77.5Confident71.5Confident72 Ų72118 Ų11847%0.46862%0.62SS.*Hα-helixtrans-64.4-34.4175.924.4-36.7000113.3S128 S134S128-P130 VanDerWaalsContact OG-CD 3.25Å; S128-P130 WeakPolarHBondContact OG-CD 3.34Å; S128-P130 VanDerWaalsContact OG-CG 3.3Å; S128-P130 WeakPolarHBondContact OG-CG 3.49Å; P130-S134 WeakPolarHBondContact O-CB 3.3Å; P130-S134 PolarHBondContact O-N 3Å; P130-S134 PolarHBondContact O-OG 2.8Å
131V80.2Confident71.8Confident80 Ų80113.5 Ų113.549%0.48561%0.614SS.*Hα-helixtrans-68.4-42.8177.2177.60000110.2S128 T129 S134 Q135S128-V131 WeakPolarHBondContact O-CB 3.25Å; S128-V131 PolarHBondContact O-N 3.36Å; T129-V131 VanDerWaalsContact C-N 3.33Å; T129-V131 PolarHBondContact O-N 2.97Å; V131-S134 PolarHBondContact O-N 3.23Å; V131-Q135 WeakPolarHBondContact O-CG 3.19Å; V131-Q135 PolarHBondContact O-N 2.73Å
132W80.4Confident71.8Confident144 Ų144108.6 Ų108.655%0.54561%0.609SS.*Hα-helixtrans-63.5-43.1176.1176.867000112.2F127 S128 T129 Q135 A136F127-W132 HydrophobicContact CE2-CB 3.76Å; F127-W132 AromaticContact CE2-CG 3.88Å; F127-W132 HydrophobicContact CE2-CG 3.88Å; F127-W132 HydrophobicContact CZ-CB 4.01Å; F127-W132 HydrophobicContact CZ-CD2 4.41Å; F127-W132 HydrophobicContact CZ-CG 4.1Å; S128-W132 PolarHBondContact O-N 3.17Å; T129-W132 PolarHBondContact O-N 3.03Å; W132-Q135 PolarHBondContact O-N 2.98Å; W132-A136 VanDerWaalsContact O-CB 3.3Å; W132-A136 WeakPolarHBondContact O-CB 3.44Å; W132-A136 PolarHBondContact O-N 2.7Å
133I78.9Confident71.5Confident71 Ų71109 Ų10936%0.36461%0.614SS.*Hα-helixtrans-62-44.9176.1-67.6167.2000110.5T129 Q135 A136 Q137T129-I133 VanDerWaalsContact O-CG1 3.27Å; T129-I133 WeakPolarHBondContact O-CG1 3.46Å; T129-I133 PolarHBondContact O-N 2.96Å; I133-Q135 VanDerWaalsContact C-N 3.31Å; I133-Q135 PolarHBondContact O-N 3.39Å; I133-A136 PolarHBondContact O-N 2.88Å; I133-Q137 VanDerWaalsContact CG2-CD 3.49Å; I133-Q137 HydrophobicContact CG2-CG 4.06Å; I133-Q137 VanDerWaalsContact O-CB 3.29Å; I133-Q137 WeakPolarHBondContact O-CB 3.42Å; I133-Q137 WeakPolarHBondContact O-CG 3.49Å; I133-Q137 PolarHBondContact O-N 3.39Å
134S78.5Confident71.3Confident52 Ų52112.1 Ų112.136%0.36462%0.619SS.*Hα-helixtrans-62.1-37.3176.4-62.60000112.8P130 V131 G138 I139P130-S134 WeakPolarHBondContact O-CB 3.3Å; P130-S134 PolarHBondContact O-N 3Å; P130-S134 PolarHBondContact O-OG 2.8Å; V131-S134 PolarHBondContact O-N 3.23Å; S134-G138 PolarHBondContact O-N 2.92Å; S134-I139 PolarHBondContact O-N 3.21Å
135Q78.4Confident70.8Confident148 Ų148114.4 Ų114.469%0.69262%0.62SS**Hα-helixtrans-68.5-43.8173.9-74176.2-2.500112.2V131 W132 I133V131-Q135 WeakPolarHBondContact O-CG 3.19Å; V131-Q135 PolarHBondContact O-N 2.73Å; W132-Q135 PolarHBondContact O-N 2.98Å; I133-Q135 VanDerWaalsContact C-N 3.31Å; I133-Q135 PolarHBondContact O-N 3.39Å
136A78.1Confident70.4Confident72 Ų72117.4 Ų117.460%0.59562%0.624SS**Hα-helixtrans-74.3-37.7-177.100000113.1W132 I133W132-A136 VanDerWaalsContact O-CB 3.3Å; W132-A136 WeakPolarHBondContact O-CB 3.44Å; W132-A136 PolarHBondContact O-N 2.7Å; I133-A136 PolarHBondContact O-N 2.88Å
137Q74.5Confident69.8Low132 Ų132117.3 Ų117.362%0.61764%0.64SS**Hα-helixtrans-89.4-5.5-179.4-64.6-175.6-13.900113.1I133 I139I133-Q137 VanDerWaalsContact CG2-CD 3.49Å; I133-Q137 HydrophobicContact CG2-CG 4.06Å; I133-Q137 VanDerWaalsContact O-CB 3.29Å; I133-Q137 WeakPolarHBondContact O-CB 3.42Å; I133-Q137 WeakPolarHBondContact O-CG 3.49Å; I133-Q137 PolarHBondContact O-N 3.39Å; Q137-I139 HydrophobicContact CB-CD1 4.2Å; Q137-I139 HydrophobicContact CB-CG1 3.92Å; Q137-I139 PolarHBondContact O-N 2.83Å; Q137-I139 VanDerWaalsContact O-N 3.14Å
138G67.2Low69.5Low58 Ų58115.4 Ų115.460%0.59864%0.637SS**  trans6611.5-178.300000114.3S134 R140S134-G138 PolarHBondContact O-N 2.92Å; G138-R140 PolarHBondContact O-N 2.83Å
139I63.3Low69Low100 Ų100118.8 Ų118.851%0.51365%0.653SS.*  trans-78.588.5178.7-53.9-174.4000107.5S134 Q137 A141S134-I139 PolarHBondContact O-N 3.21Å; Q137-I139 HydrophobicContact CB-CD1 4.2Å; Q137-I139 HydrophobicContact CB-CG1 3.92Å; Q137-I139 PolarHBondContact O-N 2.83Å; Q137-I139 VanDerWaalsContact O-N 3.14Å; I139-A141 PolarHBondContact O-N 2.87Å
140R63.4Low68.4Low238 Ų238120.7 Ų120.790%0.89866%0.66SS**  trans-62.7105.9163.3-75.3-170.9176.7-138.31.2107.2G138 G142G138-R140 PolarHBondContact O-N 2.83Å; R140-G142 PolarHBondContact O-N 2.82Å
141A65.7Low67.8Low86 Ų86123.6 Ų123.671%0.71167%0.672SS**PPolyproline II helixtrans-49.6126.8172.200000109.4I139I139-A141 PolarHBondContact O-N 2.87Å
142G60.1Low67Low59 Ų59126.3 Ų126.361%0.60868%0.683SS**PPolyproline II helixtrans-60168.9178.100000112.7R140 Q144R140-G142 PolarHBondContact O-N 2.82Å; G142-Q144 PolarHBondContact O-N 3.13Å; G142-Q144 VanDerWaalsContact O-N 3.13Å
143P56.5Low66.2Low125 Ų125125.1 Ų125.181%0.81269%0.693SS**PPolyproline II helixtrans-59.1118.8-166.822.4-32.2000112R145P143-R145 VanDerWaalsContact C-N 3.33Å; P143-R145 PolarHBondContact O-N 2.95Å
144Q57.2Low65.2Low172 Ų172129 Ų12980%0.80472%0.716SS**  trans-69.990.8171.1-170.8158.9-28.900108.3G142 L146G142-Q144 PolarHBondContact O-N 3.13Å; G142-Q144 VanDerWaalsContact O-N 3.13Å; Q144-L146 PolarHBondContact O-N 3.35Å
145R51.8Low64.2Low216 Ų216134.9 Ų134.982%0.81574%0.743SS**  trans-67.7117.7164.1-71.7-170.5176.6-100.91.2107.9P143P143-R145 VanDerWaalsContact C-N 3.33Å; P143-R145 PolarHBondContact O-N 2.95Å
146L57.9Low63.1Low152 Ų152133.8 Ų133.880%0.79675%0.747SS**  trans-116.6107.6150.1-66.6177.7000105.6Q144Q144-L146 PolarHBondContact O-N 3.35Å
147T61.1Low61.7Low196 Ų196139.5 Ų139.5100%1.20276%0.761SS**  trans-94.80159.6-54.10000106.6

Retrieved 147 of 147 residues in 32 ms (Link to these results)