A0A077Z1H0_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z1H0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 196 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
1M36Very low35.1Very low249 Ų249128.6 Ų128.6100%1.22769%0.691SS**  0134.90-68.9175.9174.500107.9
2G36.3Very low34.5Very low62 Ų62123.8 Ų123.864%0.63970%0.695SS**  trans-80.9161176.900000113.2R4G2-R4 PolarHBondContact O-N 2.97Å
3P34.6Very low34.1Very low115 Ų115122.2 Ų122.275%0.74768%0.683SS**  trans-67.4121.5177.527.5-33.8000111.5N5P3-N5 PolarHBondContact O-N 3.23Å; P3-N5 VanDerWaalsContact O-N 3.1Å
4R36.5Very low33.9Very low183 Ų183118.5 Ų118.569%0.69167%0.669SS**  trans-81.782.2176.5-77.2178.3136.7-117-12.6110.9G2 K6 E16G2-R4 PolarHBondContact O-N 2.97Å; R4-K6 PolarHBondContact O-N 2.89Å; R4-K6 VanDerWaalsContact O-N 3.16Å; R4-E16 IonicContact CZ-OE1 3.3Å; R4-E16 VanDerWaalsContact CZ-OE1 3.3Å; R4-E16 IonicContact NH1-OE1 2.73Å; R4-E16 PolarHBondContact NH1-OE1 3.13Å; R4-E16 IonicContact NH2-OE1 2.96Å; R4-E16 PolarHBondContact NH2-OE1 3.32Å
5N38Very low33.9Very low121 Ų121112 Ų11265%0.64763%0.634SS**  trans-67.4109.1176.6-74.8-13.6000111.4P3 L7P3-N5 PolarHBondContact O-N 3.23Å; P3-N5 VanDerWaalsContact O-N 3.1Å; N5-L7 PolarHBondContact O-N 3.36Å; N5-L7 VanDerWaalsContact O-N 3.08Å
6K37.7Very low33.8Very low160 Ų160109.4 Ų109.470%0.69662%0.615SS**  trans-83.980.5-176.1-166.8-175.6-179.3-171.90111.6R4 T8R4-K6 PolarHBondContact O-N 2.89Å; R4-K6 VanDerWaalsContact O-N 3.16Å; K6-T8 PolarHBondContact O-N 2.97Å; K6-T8 PolarHBondContact O-OG1 2.61Å
7L36.3Very low33.8Very low82 Ų82104.2 Ų104.243%0.42959%0.587SS.*  trans-60.8115.4174.4-75.1164.2000110.7N5 C17N5-L7 PolarHBondContact O-N 3.36Å; N5-L7 VanDerWaalsContact O-N 3.08Å; L7-C17 HydrophobicContact CD1-CB 4.26Å
8T33.7Very low33.9Very low115 Ų115100.8 Ų100.871%0.70657%0.567SS**BIsolated β-bridgetrans-105.1110.3-179.4-53.60000108.4K6K6-T8 PolarHBondContact O-N 2.97Å; K6-T8 PolarHBondContact O-OG1 2.61Å
9W34.7Very low34.1Very low120 Ų120101.1 Ų101.146%0.45557%0.571SS.*  trans-85.1144.1-176-63.883.3000111.1C11 G12W9-C11 PolarHBondContact O-N 3.03Å; W9-G12 PolarHBondContact O-N 3.21Å; W9-G12 VanDerWaalsContact O-N 3.1Å
10P33.4Very low34.2Very low137 Ų137103.7 Ų103.789%0.8957%0.571SS**THydrogen-bonded Turntrans-64.2-15.9-174.125.3-35000114G12P10-G12 VanDerWaalsContact C-N 3.27Å; P10-G12 PolarHBondContact O-N 2.85Å
11C28.7Very low34.2Very low71 Ų71105.7 Ų105.748%0.4858%0.576SS.*THydrogen-bonded Turntrans-83.513.717553.10000114.6W9 L13W9-C11 PolarHBondContact O-N 3.03Å; C11-L13 PolarHBondContact O-N 3.16Å; C11-L13 VanDerWaalsContact O-N 3.12Å
12G27.9Very low34Very low71 Ų7198.7 Ų98.773%0.73255%0.548SS*.SBendtrans72.9-1.5178.800000115.1W9 P10 S14W9-G12 PolarHBondContact O-N 3.21Å; W9-G12 VanDerWaalsContact O-N 3.1Å; P10-G12 VanDerWaalsContact C-N 3.27Å; P10-G12 PolarHBondContact O-N 2.85Å; G12-S14 PolarHBondContact O-N 3.08Å
13L30.4Very low33.8Very low103 Ų103100 Ų10054%0.53954%0.543SS..  trans-76.9106.6177.5-70.4171.7000110.7C11 C15C11-L13 PolarHBondContact O-N 3.16Å; C11-L13 VanDerWaalsContact O-N 3.12Å; L13-C15 PolarHBondContact O-N 3.24Å
14S30.7Very low33.6Very low70 Ų7099.4 Ų99.449%0.4954%0.542SS..BIsolated β-bridgetrans-80.895171.4-1770000110.5G12G12-S14 PolarHBondContact O-N 3.08Å
15C33.2Very low33.6Very low21 Ų2197.5 Ų97.514%0.14255%0.545CS..  trans-87.5127.1173.4-64.80000110.9L13 C17 I31L13-C15 PolarHBondContact O-N 3.24Å; C15-C17 PolarHBondContact O-N 2.92Å; C15-I31 HydrophobicContact CB-CG2 4.43Å
16E32.5Very low33.3Very low71 Ų7194 Ų9433%0.33253%0.527SS..EExtended strand (participates in β ladder)trans-81.697.5160.6-80.2-178.691.600108.2R4 D18 R34R4-E16 IonicContact CZ-OE1 3.3Å; R4-E16 VanDerWaalsContact CZ-OE1 3.3Å; R4-E16 IonicContact NH1-OE1 2.73Å; R4-E16 PolarHBondContact NH1-OE1 3.13Å; R4-E16 IonicContact NH2-OE1 2.96Å; R4-E16 PolarHBondContact NH2-OE1 3.32Å; E16-D18 PolarHBondContact O-N 3.02Å; E16-R34 IonicContact OE2-CZ 3.47Å; E16-R34 IonicContact OE2-NE 3.43Å; E16-R34 PolarHBondContact OE2-NE 2.91Å; E16-R34 IonicContact OE2-NH2 2.71Å; E16-R34 PolarHBondContact OE2-NH2 3.39Å
17C34.4Very low33.2Very low20 Ų2092 Ų9214%0.13552%0.516CS..EExtended strand (participates in β ladder)trans-79111168.3-590000108.6L7 C15L7-C17 HydrophobicContact CD1-CB 4.26Å; C15-C17 PolarHBondContact O-N 2.92Å
18D35.6Very low33Very low44 Ų4493 Ų9324%0.23552%0.516CS..EExtended strand (participates in β ladder)trans-94.696.5176.2-160.816.7000108.3E16 R20E16-D18 PolarHBondContact O-N 3.02Å; D18-R20 PolarHBondContact O-N 3.14Å; D18-R20 IonicContact OD1-NE 3.87Å; D18-R20 IonicContact OD2-CZ 3.23Å; D18-R20 VanDerWaalsContact OD2-CZ 3.23Å; D18-R20 IonicContact OD2-NE 2.76Å; D18-R20 PolarHBondContact OD2-NE 2.7Å; D18-R20 IonicContact OD2-NH2 2.8Å; D18-R20 PolarHBondContact OD2-NH2 3.18Å
19V38.6Very low33.3Very low106 Ų10691.2 Ų91.264%0.64250%0.499SS*.EExtended strand (participates in β ladder)trans-71.3108-179-179.40000108.7
20R35.8Very low33.4Very low152 Ų15289.2 Ų89.257%0.57450%0.496SS*.  trans-127112.4-177.8-68.8-164.8-177.6-127.6-6.2111.8D18 I30D18-R20 PolarHBondContact O-N 3.14Å; D18-R20 IonicContact OD1-NE 3.87Å; D18-R20 IonicContact OD2-CZ 3.23Å; D18-R20 VanDerWaalsContact OD2-CZ 3.23Å; D18-R20 IonicContact OD2-NE 2.76Å; D18-R20 PolarHBondContact OD2-NE 2.7Å; D18-R20 IonicContact OD2-NH2 2.8Å; D18-R20 PolarHBondContact OD2-NH2 3.18Å; R20-I30 HydrophobicContact CB-CD1 4.49Å
21H34.5Very low33.7Very low146 Ų14686.5 Ų86.568%0.67647%0.474SS*.  trans59.8115.8171.4-71.3-100.9000116.1V23H21-V23 HydrophobicContact CB-CG2 4.47Å
22T30.8Very low33.9Very low103 Ų10389.8 Ų89.863%0.63248%0.48SS*.  trans-69.8124.7154.846.90000108.9Y27T22-Y27 HydrophobicContact CG2-CE1 4.39Å
23V31.4Very low34.5Very low89 Ų8994.9 Ų94.954%0.53948%0.482SS..BIsolated β-bridgetrans-130.7112.1167.5-179.60000106.3H21H21-V23 HydrophobicContact CB-CG2 4.47Å
24S31.6Very low34.7Very low103 Ų10398.9 Ų98.972%0.7249%0.49SS*.THydrogen-bonded Turntrans54.266.4176.4-53.90000115.3D26S24-D26 PolarHBondContact O-N 3.09Å
25D35Very low34.7Very low142 Ų142106.2 Ų106.276%0.75951%0.507SS*.THydrogen-bonded Turntrans58.8-14.4176.5-63.1-50.1000117.6Y27D25-Y27 WeakPolarHBondContact O-CD2 3.14Å
26D33.1Very low34.7Very low48 Ų48111.1 Ų111.126%0.25754%0.538SS..BIsolated β-bridgetrans-79.3129.5178.8-74.3-29000112.6S24 F28S24-D26 PolarHBondContact O-N 3.09Å; D26-F28 HydrophobicContact CB-CD2 4.33Å; D26-F28 HydrophobicContact CB-CE2 3.56Å; D26-F28 HydrophobicContact CB-CZ 3.79Å
27Y34.7Very low34.4Very low118 Ų118118 Ų11846%0.46356%0.563SS.*  trans-96.696178.6-75.9-91.7000112.2T22 D25 F29 C82T22-Y27 HydrophobicContact CG2-CE1 4.39Å; D25-Y27 WeakPolarHBondContact O-CD2 3.14Å; Y27-F29 WeakPolarHBondContact O-CD2 3.4Å; Y27-F29 WeakPolarHBondContact O-CE2 3.38Å; Y27-F29 PolarHBondContact O-N 3.47Å; Y27-C82 HydrophobicContact CD2-CB 4.16Å; Y27-C82 HydrophobicContact CE2-CB 4.4Å
28F32.9Very low33.9Very low102 Ų102122.4 Ų122.445%0.44759%0.594SS.*  trans-79.2106.3178.8-64.2-80.4000113D26 I30D26-F28 HydrophobicContact CB-CD2 4.33Å; D26-F28 HydrophobicContact CB-CE2 3.56Å; D26-F28 HydrophobicContact CB-CZ 3.79Å; F28-I30 PolarHBondContact O-N 3.38Å
29F38.9Very low33.4Very low79 Ų79127.3 Ų127.335%0.34662%0.619SS.*EExtended strand (participates in β ladder)trans-9197.4177.7-67.6-82.3000112.7Y27 I31 V80Y27-F29 WeakPolarHBondContact O-CD2 3.4Å; Y27-F29 WeakPolarHBondContact O-CE2 3.38Å; Y27-F29 PolarHBondContact O-N 3.47Å; F29-I31 PolarHBondContact O-N 3.27Å; F29-I31 VanDerWaalsContact O-N 3.08Å; F29-V80 HydrophobicContact CD2-CG2 4.45Å
30I36.6Very low32.8Very low77 Ų77133.9 Ų133.940%0.39563%0.634SS.*EExtended strand (participates in β ladder)trans-78.195.5174-59.8167.1000110.1R20 F28 K32R20-I30 HydrophobicContact CB-CD1 4.49Å; F28-I30 PolarHBondContact O-N 3.38Å; I30-K32 HydrophobicContact CG2-CG 4.28Å; I30-K32 PolarHBondContact O-N 3.23Å
31I40.4Very low32.4Very low81 Ų81130 Ų13042%0.41564%0.635SS.*EExtended strand (participates in β ladder)trans-83.593.7175.9-55176.5000110C15 F29 K33 L78C15-I31 HydrophobicContact CB-CG2 4.43Å; F29-I31 PolarHBondContact O-N 3.27Å; F29-I31 VanDerWaalsContact O-N 3.08Å; I31-K33 PolarHBondContact O-N 2.67Å; I31-L78 HydrophobicContact CD1-CD1 4.12Å
32K34.1Very low32Very low139 Ų139126 Ų12660%0.60462%0.624SS**EExtended strand (participates in β ladder)trans-75.693.3170.2-77.5-174.3176.1176.90110.7I30 R34I30-K32 HydrophobicContact CG2-CG 4.28Å; I30-K32 PolarHBondContact O-N 3.23Å; K32-R34 PolarHBondContact O-N 2.77Å; K32-R34 VanDerWaalsContact O-N 3.14Å
33K39.4Very low32Very low178 Ų178127.2 Ų127.277%0.77463%0.625SS**  trans-56.8115.2170.1-111.3-177.6179.7175.10110.2I31I31-K33 PolarHBondContact O-N 2.67Å
34R34.9Very low31.8Very low187 Ų187129.2 Ų129.271%0.70663%0.633SS**PPolyproline II helixtrans-69.8161.9155.3-70.3-171.7-179-146.32.9108.9E16 K32E16-R34 IonicContact OE2-CZ 3.47Å; E16-R34 IonicContact OE2-NE 3.43Å; E16-R34 PolarHBondContact OE2-NE 2.91Å; E16-R34 IonicContact OE2-NH2 2.71Å; E16-R34 PolarHBondContact OE2-NH2 3.39Å; K32-R34 PolarHBondContact O-N 2.77Å; K32-R34 VanDerWaalsContact O-N 3.14Å
35R29.7Very low31.7Very low225 Ų225128.5 Ų128.585%0.84962%0.621SS**PPolyproline II helixtrans-48.7141.9-164.1-64.9-178.7-180179-0.8113.6Y37R35-Y37 PolarHBondContact O-N 3.21Å
36P33.2Very low31.5Very low124 Ų124128.6 Ų128.681%0.80562%0.615SS**PPolyproline II helixtrans-68.5122.6179.929-34.3000111
37Y26.1Very low31.3Very low214 Ų214131.2 Ų131.284%0.83964%0.637SS**PPolyproline II helixtrans-85.9135.3156-75.6-85.3000108.4R35 L39R35-Y37 PolarHBondContact O-N 3.21Å; Y37-L39 PolarHBondContact O-N 3.05Å; Y37-L39 VanDerWaalsContact O-N 3.14Å
38S24.6Very low30.9Very low113 Ų113130.4 Ų130.479%0.7964%0.644SS**  trans-69.8108.3-173.9-174.80000111.2
39L26.3Very low30.8Very low147 Ų147131.7 Ų131.777%0.7766%0.656SS**  trans-132.2100.6167.1-82.6172.1000109.7Y37 A41Y37-L39 PolarHBondContact O-N 3.05Å; Y37-L39 VanDerWaalsContact O-N 3.14Å; L39-A41 PolarHBondContact O-N 3.42Å
40Y25Very low30.3Very low244 Ų244136.8 Ų136.896%0.95768%0.68SS**  trans-65.480.4153.7-103-108.3000108
41A27Very low30Very low71 Ų71139 Ų13959%0.58769%0.692SS**  trans-93.5131.7169.900000109.1L39 L43L39-A41 PolarHBondContact O-N 3.42Å; A41-L43 PolarHBondContact O-N 3.2Å
42S26.1Very low29.3Very low63 Ų63137.7 Ų137.744%0.44170%0.698SS.*  trans-58.8122.9179.7162.70000110.9N44 D45S42-N44 PolarHBondContact O-N 3.2Å; S42-N44 PolarHBondContact OG-N 3.46Å; S42-D45 WeakPolarHBondContact CB-OD2 3.48Å; S42-D45 PolarHBondContact OG-OD2 3.24Å
43L30.7Very low29.1Very low127 Ų127138.8 Ų138.867%0.66571%0.71SS**THydrogen-bonded Turntrans-69.6-8.8177.3-83.7160.3000113.1A41 M66A41-L43 PolarHBondContact O-N 3.2Å; L43-M66 HydrophobicContact CD2-CE 3.82Å
44N28.2Very low28.5Very low131 Ų131135.6 Ų135.670%0.70170%0.701SS**THydrogen-bonded Turntrans-86.6-14.1-177.4-65.1-7.6000113.6S42 S47S42-N44 PolarHBondContact O-N 3.2Å; S42-N44 PolarHBondContact OG-N 3.46Å; N44-S47 PolarHBondContact O-OG 2.94Å
45D28.2Very low28.3Very low88 Ų88132.8 Ų132.847%0.47171%0.707SS.*SBendtrans-93-7.3-177.8-61.2-80.8000113.1S42 S47 T48 L49S42-D45 WeakPolarHBondContact CB-OD2 3.48Å; S42-D45 PolarHBondContact OG-OD2 3.24Å; D45-S47 VanDerWaalsContact C-N 3.33Å; D45-T48 PolarHBondContact O-OG1 3.33Å; D45-L49 PolarHBondContact O-N 3.15Å
46F30.9Very low28.2Very low144 Ų144130.7 Ų130.763%0.63270%0.701SS**THydrogen-bonded Turntrans-75.5-19178.3-112-83.9000113.9
47S29.4Very low28.1Very low104 Ų104129.5 Ų129.573%0.72769%0.685SS**THydrogen-bonded Turntrans-86.3-8.5177.948.50000113.8N44 D45N44-S47 PolarHBondContact O-OG 2.94Å; D45-S47 VanDerWaalsContact C-N 3.33Å
48T27.4Very low28.1Very low100 Ų100124.8 Ų124.861%0.61368%0.684SS**THydrogen-bonded Turntrans-123.1-9.9-175.149.40000114.1D45 Q50D45-T48 PolarHBondContact O-OG1 3.33Å; T48-Q50 PolarHBondContact O-N 3.23Å
49L28.9Very low28.3Very low130 Ų130123.7 Ų123.768%0.68168%0.681SS**SBendtrans-66.799.4171.1-93.5164.4000110.7D45 I51D45-L49 PolarHBondContact O-N 3.15Å; L49-I51 PolarHBondContact O-N 3.42Å
50Q28.8Very low28.4Very low185 Ų185121.2 Ų121.286%0.86468%0.682SS**  trans-49.2130.4-172.3-65.3177.6-33.100113.3T48 G52T48-Q50 PolarHBondContact O-N 3.23Å; Q50-G52 PolarHBondContact O-N 3.14Å
51I31.4Very low28.6Very low125 Ų125113.9 Ų113.964%0.64167%0.666SS**  trans-74.271.6170.8-54.9175.1000108.7L49 N53L49-I51 PolarHBondContact O-N 3.42Å; I51-N53 PolarHBondContact O-N 2.8Å
52G24.9Very low28.7Very low53 Ų53118.4 Ų118.455%0.54667%0.674SS.*THydrogen-bonded Turntrans-69.7121.7176.800000111.4Q50 L54Q50-G52 PolarHBondContact O-N 3.14Å; G52-L54 PolarHBondContact O-N 2.59Å
53N29Very low28.9Very low161 Ų161120.3 Ų120.386%0.86168%0.683SS**THydrogen-bonded Turntrans65.230.9166.5-59.1-15.9000117.9I51I51-N53 PolarHBondContact O-N 2.8Å
54L28Very low28.9Very low112 Ų112121.5 Ų121.559%0.58669%0.69SS**  trans-118.591.5154.8-79.296.3000110.8G52 Y56 M57G52-L54 PolarHBondContact O-N 2.59Å; L54-Y56 PolarHBondContact O-N 2.83Å; L54-M57 HydrophobicContact CB-CG 4.38Å; L54-M57 HydrophobicContact CD2-CG 4.38Å
55P29.8Very low28.9Very low127 Ų127122.6 Ų122.683%0.82569%0.692SS**THydrogen-bonded Turntrans-76.129-172.133.9-38.2000114.3
56Y27.8Very low29.1Very low181 Ų181125.6 Ų125.671%0.7171%0.705SS**THydrogen-bonded Turntrans-145.57.9-174.5-131.8-97.9000115.1L54L54-Y56 PolarHBondContact O-N 2.83Å
57M30.8Very low29Very low99 Ų99122 Ų12249%0.48870%0.703SS.*SBendtrans-109.411.6-179.8-66.8-81.590.700113.5L54 C61L54-M57 HydrophobicContact CB-CG 4.38Å; L54-M57 HydrophobicContact CD2-CG 4.38Å; M57-C61 PolarHBondContact O-SG 3.25Å
58S27Very low29Very low116 Ų116128.9 Ų128.981%0.81171%0.713SS**SBendtrans-94-6.5-163.5-163.80000116.4
59A29.5Very low29.1Very low89 Ų89126.8 Ų126.874%0.73671%0.706SS**SBendtrans-121.5-32.6-169.700000115.1
60A28.3Very low29Very low95 Ų95124.2 Ų124.279%0.78571%0.71SS**SBendtrans-100.6-5.1-174.400000114.7H62A60-H62 PolarHBondContact O-N 3.12Å
61C28.7Very low29Very low90 Ų90121.4 Ų121.461%0.60870%0.701SS**  trans-80.745.7-173.9-65.90000113.9M57 T63M57-C61 PolarHBondContact O-SG 3.25Å; C61-T63 PolarHBondContact O-N 3.11Å
62H28.2Very low28.8Very low166 Ų166125.5 Ų125.577%0.76972%0.717SS**  trans-76.2121.7174.8-80.6-47.8000111.8A60A60-H62 PolarHBondContact O-N 3.12Å
63T30.6Very low29.1Very low103 Ų103126.2 Ų126.263%0.63272%0.724SS**  trans74.461.6156.5-44.90000116.5C61 M65C61-T63 PolarHBondContact O-N 3.11Å; T63-M65 HydrophobicContact CG2-CE 3.75Å; T63-M65 HydrophobicContact CG2-CG 3.74Å; T63-M65 HydrophobicContact CG2-SD 4.28Å; T63-M65 PolarHBondContact O-N 2.93Å
64L30.2Very low29.1Very low153 Ų153123 Ų12380%0.80171%0.707SS**  trans-68.977.4156.9-80.1170.9000111.1M66L64-M66 PolarHBondContact O-N 3.14Å
65M28.8Very low29.3Very low153 Ų153125 Ų12575%0.75472%0.717SS**  trans-70.897.2171.2-86.5-172.3-71.600110.9T63 A67T63-M65 HydrophobicContact CG2-CE 3.75Å; T63-M65 HydrophobicContact CG2-CG 3.74Å; T63-M65 HydrophobicContact CG2-SD 4.28Å; T63-M65 PolarHBondContact O-N 2.93Å; M65-A67 PolarHBondContact O-N 2.96Å
66M32.4Very low29.7Very low151 Ų151124.3 Ų124.374%0.74471%0.706SS**  trans-70.892.6168.5-74.5-166.5-7500110.6L43 L64 R68L43-M66 HydrophobicContact CD2-CE 3.82Å; L64-M66 PolarHBondContact O-N 3.14Å; M66-R68 PolarHBondContact O-N 3.25Å
67A28.8Very low29.8Very low70 Ų70119.1 Ų119.158%0.57971%0.707SS**  trans-56.6131.2167.200000110.1M65 A69M65-A67 PolarHBondContact O-N 2.96Å; A67-A69 VanDerWaalsContact C-N 3.33Å; A67-A69 PolarHBondContact O-N 3.33Å
68R29.9Very low30.1Very low248 Ų248117.7 Ų117.794%0.93670%0.701SS**  trans-76.182.5-175.1-171.7-179.7-176.2130.4-2.8110.4M66 G70M66-R68 PolarHBondContact O-N 3.25Å; R68-G70 VanDerWaalsContact C-N 3.33Å; R68-G70 PolarHBondContact O-N 3.13Å
69A29.4Very low30.3Very low56 Ų56117.4 Ų117.446%0.46369%0.691SS.*  trans-6189.917600000111.2A67 L71A67-A69 VanDerWaalsContact C-N 3.33Å; A67-A69 PolarHBondContact O-N 3.33Å; A69-L71 VanDerWaalsContact C-N 3.27Å
70G26.9Very low30.6Very low75 Ų75115.8 Ų115.877%0.77367%0.672SS**  trans-81.1-4.6175.500000113.7R68R68-G70 VanDerWaalsContact C-N 3.33Å; R68-G70 PolarHBondContact O-N 3.13Å
71L27.6Very low30.6Very low127 Ų127118 Ų11867%0.66567%0.669SS**SBendtrans-111.1143.2-179.4-69.7167.6000111.9A69 G73A69-L71 VanDerWaalsContact C-N 3.27Å; L71-G73 PolarHBondContact O-N 3.39Å
72Q28.7Very low30.7Very low211 Ų211116.8 Ų116.899%0.98666%0.661SS**THydrogen-bonded Turntrans-82.557.8-170-165.4176.5107.400111.9
73G30.1Very low30.8Very low68 Ų68116.5 Ų116.570%0.70166%0.661SS**THydrogen-bonded Turntrans172.5-8.7179.100000117.5L71 L75L71-G73 PolarHBondContact O-N 3.39Å; G73-L75 PolarHBondContact O-N 3.5Å
74D28.7Very low30.8Very low94 Ų94117.6 Ų117.650%0.50367%0.669SS.*  trans-62.1127.6-168.5-67.7-23.8000113.8L76D74-L76 PolarHBondContact O-N 3.11Å; D74-L76 VanDerWaalsContact O-N 3.16Å
75L33.1Very low30.8Very low152 Ų152115.7 Ų115.780%0.79666%0.664SS**  trans-78.897.1-179.9-157.480.4000109.5G73 G77G73-L75 PolarHBondContact O-N 3.5Å; L75-G77 PolarHBondContact O-N 2.61Å
76L37.2Very low30.8Very low114 Ų114112.5 Ų112.560%0.59766%0.662SS**  trans-66.492.6174-73.9171.8000110.5D74 L78D74-L76 PolarHBondContact O-N 3.11Å; D74-L76 VanDerWaalsContact O-N 3.16Å; L76-L78 VanDerWaalsContact C-N 3.35Å; L76-L78 PolarHBondContact O-N 3.39Å
77G31.2Very low30.6Very low71 Ų71111.1 Ų111.173%0.73267%0.665SS**  trans-67.487.5172.200000111.4L75 N79L75-G77 PolarHBondContact O-N 2.61Å; G77-N79 PolarHBondContact O-N 3.38Å
78L36.1Very low30.6Very low69 Ų69116.1 Ų116.136%0.36168%0.681SS.*  trans-71.790169.6-70.6169.8000109.4I31 L76 V80I31-L78 HydrophobicContact CD1-CD1 4.12Å; L76-L78 VanDerWaalsContact C-N 3.35Å; L76-L78 PolarHBondContact O-N 3.39Å; L78-V80 HydrophobicContact CB-CG2 4.21Å; L78-V80 PolarHBondContact O-N 3.34Å
79N32.9Very low30.5Very low111 Ų111107.9 Ų107.959%0.59467%0.673SS**  trans-72.1105.4161.2-175.2-24.8000107.7G77G77-N79 PolarHBondContact O-N 3.38Å
80V34.9Very low30.5Very low55 Ų55109.5 Ų109.533%0.33369%0.686SS.*  trans-106.599173.9-170.80000107.4F29 L78 C82F29-V80 HydrophobicContact CD2-CG2 4.45Å; L78-V80 HydrophobicContact CB-CG2 4.21Å; L78-V80 PolarHBondContact O-N 3.34Å; V80-C82 PolarHBondContact O-N 3.46Å
81L27.9Very low30.5Very low140 Ų140113 Ų11373%0.73369%0.686SS**  trans-72.970.2179.5-157.282.8000110.9Q83L81-Q83 PolarHBondContact O-N 3.36Å
82C32Very low30.5Very low65 Ų65114.9 Ų114.944%0.43970%0.697SS.*  trans-70.392.4176.9-80.10000110.3Y27 V80Y27-C82 HydrophobicContact CD2-CB 4.16Å; Y27-C82 HydrophobicContact CE2-CB 4.4Å; V80-C82 PolarHBondContact O-N 3.46Å
83Q28.8Very low30.5Very low161 Ų161108.1 Ų108.175%0.75268%0.684SS**  trans-53.8133163-78.2-167.2-7.300109.5L81 T85L81-Q83 PolarHBondContact O-N 3.36Å; Q83-T85 VanDerWaalsContact C-N 3.31Å; Q83-T85 PolarHBondContact O-N 3.34Å; Q83-T85 PolarHBondContact O-OG1 3.21Å
84P30.3Very low30.4Very low126 Ų126113.5 Ų113.582%0.81870%0.696SS**  trans-72.583.3-172.728.7-35.5000111.3
85T31.5Very low30.3Very low112 Ų112114.2 Ų114.269%0.68771%0.709SS**PPolyproline II helixtrans-70132.4167.721.50000109.2Q83Q83-T85 VanDerWaalsContact C-N 3.31Å; Q83-T85 PolarHBondContact O-N 3.34Å; Q83-T85 PolarHBondContact O-OG1 3.21Å
86A27.4Very low30.5Very low86 Ų86112.8 Ų112.871%0.71171%0.708SS**PPolyproline II helixtrans-57.7152.3-163.800000114L88A86-L88 PolarHBondContact O-N 3.39Å
87P29.5Very low30.4Very low123 Ų123112.7 Ų112.780%0.79972%0.715SS**PPolyproline II helixtrans-53.6139.1-17920.8-33.8000112.7G89P87-G89 VanDerWaalsContact C-N 3.33Å; P87-G89 PolarHBondContact O-N 2.99Å
88L28.4Very low30.6Very low175 Ų175117.4 Ų117.492%0.91672%0.723SS**SBendtrans-60.283.2-177.2-76.1148.5000112.5A86A86-L88 PolarHBondContact O-N 3.39Å
89G28.1Very low30.9Very low75 Ų75123.2 Ų123.277%0.77375%0.748SS**  trans-153.5-0.6179.500000115.8P87P87-G89 VanDerWaalsContact C-N 3.33Å; P87-G89 PolarHBondContact O-N 2.99Å
90A28.2Very low31.1Very low90 Ų90127.2 Ų127.274%0.74476%0.763SS**  trans-128.731-172.800000114.2N92A90-N92 PolarHBondContact O-N 3.11Å
91L28.7Very low31Very low148 Ų148130.2 Ų130.278%0.77579%0.787SS**  trans-73.473.5171.8-79169.7000111
92N27.4Very low31.3Very low166 Ų166129.3 Ų129.389%0.88879%0.792SS**SBendtrans-153.187.1171.4-115-17.3000112.1A90A90-N92 PolarHBondContact O-N 3.11Å
93G27.3Very low31.2Very low70 Ų70132.3 Ų132.372%0.72281%0.814SS**  trans97171.2167.700000116.4
94L28.2Very low31.4Very low181 Ų181129.2 Ų129.295%0.94882%0.815SS**  trans71.6111.7-179.9-48.5-176.5000115.4
95S27.7Very low31.3Very low109 Ų109127 Ų12776%0.76282%0.815SS**PPolyproline II helixtrans-69.4155.7174.1-50.60000112
96P36.9Very low31.3Very low122 Ų122127.2 Ų127.279%0.79282%0.822SS**PPolyproline II helixtrans-65138.5169.728.7-34.8000111
97P35.4Very low31.3Very low112 Ų112128 Ų12873%0.72782%0.822SS**PPolyproline II helixtrans-77.2159.6163.534-33.7000110.9
98D34.6Very low31.4Very low169 Ų169126.2 Ų126.290%0.90482%0.818SS**PPolyproline II helixtrans-61.1136.1176.2-66.8-91.9000112.8
99E42.7Very low31.6Very low191 Ų191123.5 Ų123.589%0.89381%0.808SS**PPolyproline II helixtrans-94.1122.3173.1-65.1-154.2110.700111.4
100E37.4Very low31.9Very low196 Ų196125.4 Ų125.492%0.91681%0.807SS**PPolyproline II helixtrans-79.1145.9177.9-166.3166.683.400111.7S102E100-S102 PolarHBondContact O-N 2.7Å
101S33.3Very low32.3Very low118 Ų118128.3 Ų128.383%0.82581%0.809SS**PPolyproline II helixtrans-69.3130.1-165.1-68.40000114.4
102S33.9Very low32.4Very low121 Ų121126.5 Ų126.585%0.84680%0.8SS**  trans-137.994164.4-81.60000111.4E100 A104E100-S102 PolarHBondContact O-N 2.7Å; S102-A104 PolarHBondContact O-N 3.43Å
103S29.3Very low32.8Very low128 Ų128125.8 Ų125.890%0.89580%0.795SS**  trans-83.4100.5-179-173.10000111.5
104A33.8Very low33.2Very low95 Ų95128.5 Ų128.579%0.78580%0.798SS**  trans-96.597.9171.500000110.4S102 S106S102-A104 PolarHBondContact O-N 3.43Å; A104-S106 PolarHBondContact O-N 2.87Å
105G28.2Very low33.3Very low79 Ų79129.4 Ų129.481%0.81479%0.789SS**  trans-69.591-178.400000113.4S107G105-S107 PolarHBondContact O-N 3.33Å
106S31.1Very low33.6Very low118 Ų118127.7 Ų127.783%0.82578%0.782SS**  trans-75.4111.4176.6-169.40000111.6A104A104-S106 PolarHBondContact O-N 2.87Å
107S27.2Very low33.6Very low102 Ų102128.2 Ų128.271%0.71379%0.785SS**  trans-87.6112.7176.7-169.30000110.7G105 V109G105-S107 PolarHBondContact O-N 3.33Å; S107-V109 VanDerWaalsContact C-N 3.3Å; S107-V109 PolarHBondContact O-N 2.93Å
108A31.9Very low33.6Very low86 Ų86128.5 Ų128.571%0.71179%0.785SS**  trans-76.975.7179.200000112
109V31.7Very low33.7Very low117 Ų117123.1 Ų123.171%0.70977%0.769SS**  trans-77.3125.4168.5-178.30000108.9S107S107-V109 VanDerWaalsContact C-N 3.3Å; S107-V109 PolarHBondContact O-N 2.93Å
110P35.7Very low33.4Very low115 Ų115120.2 Ų120.275%0.74777%0.766SS**  trans-67.2139.7176.827.9-34.2000111.2D112P110-D112 PolarHBondContact O-N 3.4Å; P110-D112 VanDerWaalsContact O-N 3.14Å
111L35.5Very low33.2Very low151 Ų151117.2 Ų117.279%0.79176%0.762SS**  trans-74.6102-178.8-168.375.8000110.6L113L111-L113 HydrophobicContact CD2-CD2 3.88Å; L111-L113 HydrophobicContact CD2-CG 4.27Å; L111-L113 HydrophobicContact CG-CD2 4.33Å; L111-L113 HydrophobicContact CG-CG 4.47Å; L111-L113 PolarHBondContact O-N 2.89Å
112D30.2Very low33.4Very low110 Ų110117.4 Ų117.459%0.58876%0.76SS**  trans-7591.5178-176.49.6000111.8P110 T114P110-D112 PolarHBondContact O-N 3.4Å; P110-D112 VanDerWaalsContact O-N 3.14Å; D112-T114 PolarHBondContact O-N 2.82Å; D112-T114 WeakPolarHBondContact OD1-CB 3.49Å; D112-T114 PolarHBondContact OD1-N 2.95Å; D112-T114 PolarHBondContact OD1-OG1 3.31Å
113L36.8Very low33.5Very low151 Ų151115.6 Ų115.679%0.79175%0.752SS**THydrogen-bonded Turntrans-73.6-3.1176.2-67.5170.9000113.7L111 R115L111-L113 HydrophobicContact CD2-CD2 3.88Å; L111-L113 HydrophobicContact CD2-CG 4.27Å; L111-L113 HydrophobicContact CG-CD2 4.33Å; L111-L113 HydrophobicContact CG-CG 4.47Å; L111-L113 PolarHBondContact O-N 2.89Å; L113-R115 PolarHBondContact O-N 3.47Å
114T36.3Very low33.8Very low127 Ų127115.6 Ų115.678%0.77975%0.747SS**THydrogen-bonded Turntrans-73-16.5179.3-29.10000112.2D112 A116D112-T114 PolarHBondContact O-N 2.82Å; D112-T114 WeakPolarHBondContact OD1-CB 3.49Å; D112-T114 PolarHBondContact OD1-N 2.95Å; D112-T114 PolarHBondContact OD1-OG1 3.31Å; T114-A116 PolarHBondContact O-N 3.16Å; T114-A116 VanDerWaalsContact O-N 3.13Å
115R30.6Very low34Very low201 Ų201116.9 Ų116.976%0.75875%0.745SS**  trans-84.485.6-178.1-166.3173.2-169.7155.82.8112.1L113L113-R115 PolarHBondContact O-N 3.47Å
116A32.1Very low34.4Very low73 Ų73118 Ų11860%0.60374%0.741SS**  trans-50.6138165.700000110.8T114 T118T114-A116 PolarHBondContact O-N 3.16Å; T114-A116 VanDerWaalsContact O-N 3.13Å; A116-T118 PolarHBondContact O-N 3.36Å; A116-T118 PolarHBondContact O-OG1 2.97Å
117P37.1Very low34.7Very low132 Ų132117.5 Ų117.586%0.85774%0.737SS**  trans-63.5104-173.725.1-34.1000110.2G119P117-G119 PolarHBondContact O-N 2.78Å
118T35.3Very low35.2Very low119 Ų119119 Ų11973%0.7374%0.743SS**  trans-77.491.8-175.4-24.70000108.6A116A116-T118 PolarHBondContact O-N 3.36Å; A116-T118 PolarHBondContact O-OG1 2.97Å
119G37.8Very low35.5Very low55 Ų55119.5 Ų119.557%0.56774%0.741SS**  trans-55.4152.617200000111.3P117P117-G119 PolarHBondContact O-N 2.78Å
120P36.4Very low35.7Very low130 Ų130119.1 Ų119.184%0.84474%0.743SS**  trans-62.3140-170.623-32.7000113.6
121T32.4Very low35.9Very low133 Ų133120.9 Ų120.982%0.81675%0.746SS**  trans-34158.6164.217.50000115.4
122P38.6Very low36.1Very low123 Ų123120.7 Ų120.780%0.79974%0.741SS**  cis-146.8-16636.143-22.4000117.7
123A35.8Very low36.5Very low82 Ų82123.1 Ų123.168%0.67875%0.749SS**  trans105.6100.4158.500000118.6
124T35.8Very low36.6Very low128 Ų128124.6 Ų124.679%0.78575%0.751SS**  trans28.9132.3132.7580000119.4
125T38Very low36.6Very low122 Ų122124.8 Ų124.875%0.74875%0.752SS**  -163152.257.243.40000114.8
126S36.1Very low37.1Very low102 Ų102120.8 Ų120.871%0.71375%0.752SS**  trans54118143.7-51.60000120.6
127S37.4Very low37.5Very low108 Ų108127 Ų12776%0.75577%0.766SS**  65.9131.891.8-49.20000114.1
128T36.6Very low37.8Very low135 Ų135125.7 Ų125.783%0.82876%0.76SS**  cis-167.3-18012.3-3.20000108.2
129S39.3Very low38.1Very low95 Ų95125.9 Ų125.966%0.66476%0.763SS**  cis-164.2145.72.341.50000112.2
130S36.4Very low37.8Very low110 Ų110126.7 Ų126.777%0.76977%0.771SS**  34.4127.9129.6-41.30000123.2
131L39.1Very low37.8Very low152 Ų152132 Ų13280%0.79678%0.775SS**  trans-177.2104.9139.3-96.6164000107.8
132Q39Very low38.4Very low147 Ų147129.4 Ų129.469%0.68776%0.762SS**  66.6111102.1-65.6-162.1-74.800115.1
133E39.2Very low38.7Very low161 Ų161127.5 Ų127.575%0.75276%0.757SS**  77.6144.4102-70.3168.183.500113
134E38.2Very low39.1Very low182 Ų182130.5 Ų130.585%0.8576%0.761SS**  cis-146.8-17728.1-153.2-176.9111.400111.8
135T36.7Very low39.8Very low130 Ų130131 Ų13180%0.79876%0.755SS**  trans-118.3-165.1-168.8-21.10000113.6
136P41.8Very low40.5Very low117 Ų117129.7 Ų129.776%0.7674%0.74SS**  -115.7167.8-125.641.6-26.3000116.8
137K41.3Very low41.2Very low204 Ų204129.5 Ų129.589%0.88773%0.728SS**  trans-150.396.2166.4-146.8157.4-1721680116.5
138S41.6Very low41.2Very low105 Ų105127.6 Ų127.673%0.73471%0.714SS**  trans10.6153.7131.6-153.80000120.3
139P41.8Very low41.7Very low122 Ų122129.4 Ų129.479%0.79271%0.705SS**  cis-138.2158-42.438.1-23.3000113.8
140G32.9Very low42.3Very low72 Ų72132.7 Ų132.774%0.74270%0.703SS**  trans153125.5154.300000119.1
141R36.7Very low42.7Very low242 Ų242135.7 Ų135.791%0.91370%0.698SS**SBendtrans68.9138.3159-61.4179.5170.9177.1-4.3118.1A143R141-A143 PolarHBondContact O-N 3.16Å
142S43.7Very low42.8Very low79 Ų79135.2 Ų135.255%0.55269%0.691SS**  trans5036.316262.10000119.6D144S142-D144 VanDerWaalsContact C-N 3.34Å
143A44.9Very low43.1Very low83 Ų83132.6 Ų132.669%0.68669%0.689SS**Hα-helixtrans-63.7-37171.300000113.3R141 E147R141-A143 PolarHBondContact O-N 3.16Å; A143-E147 PolarHBondContact O-N 2.98Å
144D45.4Very low43.3Very low145 Ų145130.1 Ų130.178%0.77569%0.685SS**Hα-helixtrans-69-43.3-173-149.9-102.9000112.9S142 E146 C148S142-D144 VanDerWaalsContact C-N 3.34Å; D144-E146 PolarHBondContact O-N 3.03Å; D144-C148 PolarHBondContact O-N 2.94Å; D144-C148 VanDerWaalsContact O-N 3.11Å
145E50.4Low43.5Very low137 Ų137127 Ų12764%0.6468%0.679SS**Hα-helixtrans-69-34.7179.3-62.4-178.696.800112.5R149E145-R149 PolarHBondContact O-N 3.06Å; E145-R149 VanDerWaalsContact O-N 3.13Å
146E51.8Low43.5Very low95 Ų95129.3 Ų129.344%0.44468%0.681SS.*Hα-helixtrans-71-40.4179-17072.1177.700111.4D144 R149 R150D144-E146 PolarHBondContact O-N 3.03Å; E146-R149 PolarHBondContact O-N 3.49Å; E146-R150 WeakPolarHBondContact O-CG 3.22Å; E146-R150 PolarHBondContact O-N 3.27Å
147E51.5Low43Very low99 Ų99131.5 Ų131.546%0.46368%0.681SS.*Hα-helixtrans-67.9-37.6174.4-170.3171.9144.800111.8A143 R149 R150 R151A143-E147 PolarHBondContact O-N 2.98Å; E147-R149 VanDerWaalsContact C-N 3.32Å; E147-R149 PolarHBondContact O-N 2.91Å; E147-R150 PolarHBondContact O-N 3.25Å; E147-R151 HydrophobicContact CG-CG 4.3Å; E147-R151 WeakPolarHBondContact O-CB 3.31Å; E147-R151 WeakPolarHBondContact O-CG 3.41Å; E147-R151 PolarHBondContact O-N 3.05Å; E147-R151 IonicContact OE1-CZ 3.14Å; E147-R151 IonicContact OE1-NE 2.77Å; E147-R151 PolarHBondContact OE1-NE 3.21Å; E147-R151 IonicContact OE1-NH2 2.67Å; E147-R151 PolarHBondContact OE1-NH2 3Å
148C37.5Very low42.8Very low67 Ų67127.6 Ų127.645%0.45368%0.676SS.*Hα-helixtrans-60.6-40.6174.9-164.50000111.9D144 Q152D144-C148 PolarHBondContact O-N 2.94Å; D144-C148 VanDerWaalsContact O-N 3.11Å; C148-Q152 WeakPolarHBondContact O-CG 3.42Å; C148-Q152 PolarHBondContact O-N 2.91Å
149R45.9Very low42.7Very low174 Ų174128.8 Ų128.866%0.65768%0.679SS**Hα-helixtrans-61.4-50170.4-83.8-166.9178.5112.94.3112.7E145 E146 E147 R151 Q152 S153E145-R149 PolarHBondContact O-N 3.06Å; E145-R149 VanDerWaalsContact O-N 3.13Å; E146-R149 PolarHBondContact O-N 3.49Å; E147-R149 VanDerWaalsContact C-N 3.32Å; E147-R149 PolarHBondContact O-N 2.91Å; R149-R151 VanDerWaalsContact C-N 3.32Å; R149-R151 PolarHBondContact O-N 2.79Å; R149-Q152 PolarHBondContact O-N 3.44Å; R149-Q152 VanDerWaalsContact O-N 3.14Å; R149-S153 PolarHBondContact O-N 3.29Å; R149-S153 PolarHBondContact O-OG 3.34Å
150R52.4Low42.4Very low163 Ų163126.1 Ų126.162%0.61567%0.673SS**Hα-helixtrans-59.7-41.5-178.8-73.2-177.4-176-170.12.1112.4E146 E147 Q152 S153 T154E146-R150 WeakPolarHBondContact O-CG 3.22Å; E146-R150 PolarHBondContact O-N 3.27Å; E147-R150 PolarHBondContact O-N 3.25Å; R150-Q152 VanDerWaalsContact C-N 3.34Å; R150-Q152 PolarHBondContact O-N 3.3Å; R150-S153 PolarHBondContact O-N 3.48Å; R150-S153 PolarHBondContact O-OG 3.08Å; R150-T154 PolarHBondContact O-N 3.22Å; R150-T154 PolarHBondContact O-OG1 3.31Å
151R45.1Very low42.5Very low174 Ų174131 Ų13166%0.65768%0.677SS**Hα-helixtrans-61.3-39.9176-73.3175176.8-112.34.4111.9E147 R149 T155E147-R151 HydrophobicContact CG-CG 4.3Å; E147-R151 WeakPolarHBondContact O-CB 3.31Å; E147-R151 WeakPolarHBondContact O-CG 3.41Å; E147-R151 PolarHBondContact O-N 3.05Å; E147-R151 IonicContact OE1-CZ 3.14Å; E147-R151 IonicContact OE1-NE 2.77Å; E147-R151 PolarHBondContact OE1-NE 3.21Å; E147-R151 IonicContact OE1-NH2 2.67Å; E147-R151 PolarHBondContact OE1-NH2 3Å; R149-R151 VanDerWaalsContact C-N 3.32Å; R149-R151 PolarHBondContact O-N 2.79Å; R151-T155 PolarHBondContact O-OG1 2.76Å; R151-T155 VanDerWaalsContact O-OG1 3.12Å
152Q41.6Very low42.9Very low141 Ų141124.3 Ų124.366%0.65967%0.665SS**Hα-helixtrans-67.7-49.1174.2-68.7-179.615.300112C148 R149 R150 T154 T155C148-Q152 WeakPolarHBondContact O-CG 3.42Å; C148-Q152 PolarHBondContact O-N 2.91Å; R149-Q152 PolarHBondContact O-N 3.44Å; R149-Q152 VanDerWaalsContact O-N 3.14Å; R150-Q152 VanDerWaalsContact C-N 3.34Å; R150-Q152 PolarHBondContact O-N 3.3Å; Q152-T154 PolarHBondContact O-N 3.16Å; Q152-T154 VanDerWaalsContact O-N 3.09Å; Q152-T155 WeakPolarHBondContact O-CB 3.49Å; Q152-T155 PolarHBondContact O-N 2.8Å; Q152-T155 VanDerWaalsContact O-N 3.11Å; Q152-T155 PolarHBondContact O-OG1 3.18Å
153S44.2Very low42.5Very low92 Ų92129.7 Ų129.764%0.64368%0.681SS**Hα-helixtrans-69.2-7-176.562.10000115.3R149 R150R149-S153 PolarHBondContact O-N 3.29Å; R149-S153 PolarHBondContact O-OG 3.34Å; R150-S153 PolarHBondContact O-N 3.48Å; R150-S153 PolarHBondContact O-OG 3.08Å
154T43.6Very low42.6Very low109 Ų109130.8 Ų130.867%0.66968%0.679SS**THydrogen-bonded Turntrans-90.9-1.8174.9-46.70000112.4R150 Q152R150-T154 PolarHBondContact O-N 3.22Å; R150-T154 PolarHBondContact O-OG1 3.31Å; Q152-T154 PolarHBondContact O-N 3.16Å; Q152-T154 VanDerWaalsContact O-N 3.09Å
155T42Very low43Very low116 Ų116128.9 Ų128.971%0.71268%0.678SS**THydrogen-bonded Turntrans-93.410.1-170.1-47.40000114.1R151 Q152R151-T155 PolarHBondContact O-OG1 2.76Å; R151-T155 VanDerWaalsContact O-OG1 3.12Å; Q152-T155 WeakPolarHBondContact O-CB 3.49Å; Q152-T155 PolarHBondContact O-N 2.8Å; Q152-T155 VanDerWaalsContact O-N 3.11Å; Q152-T155 PolarHBondContact O-OG1 3.18Å
156E38.2Very low42.6Very low180 Ų180128.7 Ų128.784%0.84167%0.671SS**THydrogen-bonded Turntrans-118.110.6-176.5-65.5-161.1106.900115.4P158E156-P158 WeakPolarHBondContact O-CD 3.38Å
157Q31.3Very low42.7Very low163 Ų163126.8 Ų126.876%0.76267%0.668SS**  trans-83.7121.1171.2-164.2176.55200110.6V159Q157-V159 PolarHBondContact O-N 3.46Å
158P35.8Very low42.5Very low122 Ų122129 Ų12979%0.79268%0.676SS**  trans-73.291.7175.829.8-34000110E156 G160E156-P158 WeakPolarHBondContact O-CD 3.38Å; P158-G160 PolarHBondContact O-N 3.27Å
159V39.3Very low43.2Very low129 Ų129131.5 Ų131.578%0.78268%0.682SS**  trans-58.4122.7169.3179.10000108Q157 Q161Q157-V159 PolarHBondContact O-N 3.46Å; V159-Q161 PolarHBondContact O-N 3.14Å; V159-Q161 VanDerWaalsContact O-N 3.08Å
160G36.4Very low43.5Very low66 Ų66127.6 Ų127.668%0.6867%0.671SS**  trans-56.4115.1-17400000111.6P158P158-G160 PolarHBondContact O-N 3.27Å
161Q36Very low43.4Very low174 Ų174125.1 Ų125.181%0.81367%0.666SS**  trans-58.3124.7-179.4-177.5-179.91.300109.6V159 Q163V159-Q161 PolarHBondContact O-N 3.14Å; V159-Q161 VanDerWaalsContact O-N 3.08Å; Q161-Q163 PolarHBondContact O-N 3.32Å; Q161-Q163 VanDerWaalsContact O-N 3.16Å
162P43.9Very low43.7Very low102 Ų102122.9 Ų122.966%0.66266%0.661SS**  trans-63.1120.8173.525.7-32.6000108.8T164P162-T164 PolarHBondContact O-N 2.79Å
163Q36.3Very low43.9Very low193 Ų193121.9 Ų121.990%0.90266%0.655SS**  trans-71.479.6172.7-79.3-160.8-90.900110.4Q161 S165Q161-Q163 PolarHBondContact O-N 3.32Å; Q161-Q163 VanDerWaalsContact O-N 3.16Å; Q163-S165 PolarHBondContact O-N 3.48Å
164T45.5Very low43.8Very low105 Ų105121.7 Ų121.764%0.64464%0.644SS**  trans-71.7104.8157.444.20000107.6P162 W166P162-T164 PolarHBondContact O-N 2.79Å; T164-W166 PolarHBondContact O-N 3.14Å
165S53.5Low43.9Very low106 Ų106121 Ų12174%0.74164%0.639SS**  trans-74.338.9-175.7650000113.8Q163Q163-S165 PolarHBondContact O-N 3.48Å
166W43.8Very low43.8Very low133 Ų133117 Ų11750%0.50462%0.621SS.*  trans-122.6122.1-173.1-69.366.4000107.9T164 E170 Q174T164-W166 PolarHBondContact O-N 3.14Å; W166-E170 HydrophobicContact CE3-CB 4.1Å; W166-Q174 VanDerWaalsContact CZ3-OE1 3.32Å
167S52.4Low44Very low55 Ų55118.5 Ų118.539%0.38562%0.619SS.*  trans-67.7154.8172.268.80000110.6E169 E170 Q171S167-E169 PolarHBondContact O-N 3.28Å; S167-E169 VanDerWaalsContact O-N 3.11Å; S167-E170 WeakPolarHBondContact CB-OE2 3.29Å; S167-E170 PolarHBondContact N-OE2 3.32Å; S167-E170 PolarHBondContact O-N 2.93Å; S167-E170 WeakPolarHBondContact OG-CG 3.5Å; S167-E170 PolarHBondContact OG-N 3.35Å; S167-E170 PolarHBondContact OG-OE2 3.36Å; S167-Q171 PolarHBondContact O-N 2.96Å
168F48.3Very low44.7Very low144 Ų144117.9 Ų117.963%0.63262%0.616SS**Hα-helixtrans-50.6-35.4172.3177.2-89.7000112.1F172F168-F172 HydrophobicContact CD1-CD2 4.38Å; F168-F172 HydrophobicContact CD2-CE2 4.23Å; F168-F172 HydrophobicContact CE1-CD2 4.04Å; F168-F172 AromaticContact CE1-CE2 3.93Å; F168-F172 HydrophobicContact CE1-CE2 3.93Å; F168-F172 HydrophobicContact CE2-CD2 4.3Å; F168-F172 AromaticContact CE2-CE2 3.58Å; F168-F172 HydrophobicContact CE2-CE2 3.58Å; F168-F172 HydrophobicContact CE2-CZ 4.38Å; F168-F172 AromaticContact CZ-CD2 3.99Å; F168-F172 HydrophobicContact CZ-CD2 3.99Å; F168-F172 AromaticContact CZ-CE2 3.4Å; F168-F172 HydrophobicContact CZ-CE2 3.4Å; F168-F172 VanDerWaalsContact CZ-CE2 3.4Å; F168-F172 AromaticContact CZ-CZ 3.99Å; F168-F172 HydrophobicContact CZ-CZ 3.99Å; F168-F172 WeakPolarHBondContact O-CD2 3.47Å
169E51.1Low45.1Very low121 Ų121116.9 Ų116.957%0.56561%0.608SS**Hα-helixtrans-72.7-28.1-179.7-161.2176.6117.600113.2S167 K173S167-E169 PolarHBondContact O-N 3.28Å; S167-E169 VanDerWaalsContact O-N 3.11Å; E169-K173 HydrophobicContact CG-CD 4.48Å; E169-K173 WeakPolarHBondContact O-CD 3.49Å; E169-K173 VanDerWaalsContact O-CG 3.29Å; E169-K173 WeakPolarHBondContact O-CG 3.39Å; E169-K173 PolarHBondContact O-N 2.73Å; E169-K173 WeakPolarHBondContact OE1-CE 3.49Å; E169-K173 IonicContact OE1-NZ 2.61Å; E169-K173 PolarHBondContact OE1-NZ 3.1Å
170E53.2Low45Very low92 Ų92113.6 Ų113.643%0.4360%0.6SS.*Hα-helixtrans-75.2-38.7177.6-73.7160.3122.600112.2W166 S167 F172 K173 Q174W166-E170 HydrophobicContact CE3-CB 4.1Å; S167-E170 WeakPolarHBondContact CB-OE2 3.29Å; S167-E170 PolarHBondContact N-OE2 3.32Å; S167-E170 PolarHBondContact O-N 2.93Å; S167-E170 WeakPolarHBondContact OG-CG 3.5Å; S167-E170 PolarHBondContact OG-N 3.35Å; S167-E170 PolarHBondContact OG-OE2 3.36Å; E170-F172 VanDerWaalsContact C-N 3.34Å; E170-F172 PolarHBondContact O-N 3.34Å; E170-K173 PolarHBondContact O-N 2.68Å; E170-Q174 PolarHBondContact O-N 3.18Å; E170-Q174 VanDerWaalsContact O-N 3.14Å
171Q51.1Low45.3Very low111 Ų111112.5 Ų112.552%0.51959%0.585SS.*Hα-helixtrans-58.6-45174.7-67.8-172.4-59.400111.7S167 Q174 V175S167-Q171 PolarHBondContact O-N 2.96Å; Q171-Q174 PolarHBondContact O-N 2.71Å; Q171-V175 PolarHBondContact O-N 3.46Å
172F51.3Low45.5Very low126 Ų126110.4 Ų110.455%0.55358%0.58SS**Hα-helixtrans-69.7-32.3178.2-83.2-97.1000113.2F168 E170 Q174 G176F168-F172 HydrophobicContact CD1-CD2 4.38Å; F168-F172 HydrophobicContact CD2-CE2 4.23Å; F168-F172 HydrophobicContact CE1-CD2 4.04Å; F168-F172 AromaticContact CE1-CE2 3.93Å; F168-F172 HydrophobicContact CE1-CE2 3.93Å; F168-F172 HydrophobicContact CE2-CD2 4.3Å; F168-F172 AromaticContact CE2-CE2 3.58Å; F168-F172 HydrophobicContact CE2-CE2 3.58Å; F168-F172 HydrophobicContact CE2-CZ 4.38Å; F168-F172 AromaticContact CZ-CD2 3.99Å; F168-F172 HydrophobicContact CZ-CD2 3.99Å; F168-F172 AromaticContact CZ-CE2 3.4Å; F168-F172 HydrophobicContact CZ-CE2 3.4Å; F168-F172 VanDerWaalsContact CZ-CE2 3.4Å; F168-F172 AromaticContact CZ-CZ 3.99Å; F168-F172 HydrophobicContact CZ-CZ 3.99Å; F168-F172 WeakPolarHBondContact O-CD2 3.47Å; E170-F172 VanDerWaalsContact C-N 3.34Å; E170-F172 PolarHBondContact O-N 3.34Å; F172-Q174 VanDerWaalsContact C-N 3.3Å; F172-Q174 PolarHBondContact O-N 3.43Å; F172-G176 PolarHBondContact O-N 3.27Å
173K45.1Very low45.6Very low121 Ų121113.7 Ų113.753%0.52659%0.586SS.*Hα-helixtrans-67.8-27.9175.1-78.3169.7-177.3166.30113.2E169 E170E169-K173 HydrophobicContact CG-CD 4.48Å; E169-K173 WeakPolarHBondContact O-CD 3.49Å; E169-K173 VanDerWaalsContact O-CG 3.29Å; E169-K173 WeakPolarHBondContact O-CG 3.39Å; E169-K173 PolarHBondContact O-N 2.73Å; E169-K173 WeakPolarHBondContact OE1-CE 3.49Å; E169-K173 IonicContact OE1-NZ 2.61Å; E169-K173 PolarHBondContact OE1-NZ 3.1Å; E170-K173 PolarHBondContact O-N 2.68Å
174Q42.8Very low45.8Very low87 Ų87107.3 Ų107.341%0.40757%0.566SS.*Hα-helixtrans-74-45.2176.5-175.4163.7-17.300112W166 E170 Q171 F172 G176 R177 E178W166-Q174 VanDerWaalsContact CZ3-OE1 3.32Å; E170-Q174 PolarHBondContact O-N 3.18Å; E170-Q174 VanDerWaalsContact O-N 3.14Å; Q171-Q174 PolarHBondContact O-N 2.71Å; F172-Q174 VanDerWaalsContact C-N 3.3Å; F172-Q174 PolarHBondContact O-N 3.43Å; Q174-G176 PolarHBondContact O-N 3.31Å; Q174-R177 PolarHBondContact O-N 3.08Å; Q174-E178 VanDerWaalsContact CG-OE2 3.31Å; Q174-E178 WeakPolarHBondContact CG-OE2 3.49Å; Q174-E178 PolarHBondContact NE2-OE2 3.22Å; Q174-E178 PolarHBondContact O-N 3.05Å; Q174-E178 VanDerWaalsContact O-N 3.15Å
175V45.4Very low45.6Very low94 Ų94108 Ų10857%0.5757%0.565SS**Hα-helixtrans-55.4-39.5175.4178.20000111.8Q171 R177 T179Q171-V175 PolarHBondContact O-N 3.46Å; V175-R177 VanDerWaalsContact C-N 3.29Å; V175-R177 PolarHBondContact O-N 3.12Å; V175-T179 WeakPolarHBondContact O-CG2 3.18Å; V175-T179 PolarHBondContact O-N 3.4Å; V175-T179 PolarHBondContact O-OG1 3.45Å
176G39.2Very low44.9Very low33 Ų33108.2 Ų108.234%0.3456%0.558SS.*Hα-helixtrans-68.5-19.7176.500000115.4F172 Q174F172-G176 PolarHBondContact O-N 3.27Å; Q174-G176 PolarHBondContact O-N 3.31Å
177R41.9Very low44.7Very low212 Ų212108.4 Ų108.480%0.857%0.568SS**Hα-helixtrans-89.5-36.8176.4-80.6-177.1166.6174.9-3.1113.2Q174 V175 T179Q174-R177 PolarHBondContact O-N 3.08Å; V175-R177 VanDerWaalsContact C-N 3.29Å; V175-R177 PolarHBondContact O-N 3.12Å; R177-T179 VanDerWaalsContact C-N 3.27Å; R177-T179 PolarHBondContact O-N 3.1Å
178E46.6Very low44.1Very low149 Ų149111.9 Ų111.970%0.69658%0.582SS**Hα-helixtrans-75.8-16.4178.4-67.1-177.481.100112.8Q174Q174-E178 VanDerWaalsContact CG-OE2 3.31Å; Q174-E178 WeakPolarHBondContact CG-OE2 3.49Å; Q174-E178 PolarHBondContact NE2-OE2 3.22Å; Q174-E178 PolarHBondContact O-N 3.05Å; Q174-E178 VanDerWaalsContact O-N 3.15Å
179T45Very low43.7Very low101 Ų101109.5 Ų109.562%0.6258%0.583SS**THydrogen-bonded Turntrans-98.14.4177.651.40000114.8V175 R177 A181V175-T179 WeakPolarHBondContact O-CG2 3.18Å; V175-T179 PolarHBondContact O-N 3.4Å; V175-T179 PolarHBondContact O-OG1 3.45Å; R177-T179 VanDerWaalsContact C-N 3.27Å; R177-T179 PolarHBondContact O-N 3.1Å; T179-A181 PolarHBondContact O-N 2.99Å
180G35.7Very low43.2Very low60 Ų60110.5 Ų110.562%0.61959%0.592SS**THydrogen-bonded Turntrans69.224173.100000115.7D182G180-D182 PolarHBondContact O-N 3.16Å
181A42.6Very low42.5Very low44 Ų44109.7 Ų109.736%0.36461%0.608SS.*THydrogen-bonded Turntrans-74.616.2-167.300000116.6T179 E183 A184T179-A181 PolarHBondContact O-N 2.99Å; A181-E183 VanDerWaalsContact C-N 3.33Å; A181-E183 PolarHBondContact O-N 3.29Å; A181-A184 WeakPolarHBondContact O-CB 3.07Å; A181-A184 PolarHBondContact O-N 2.77Å; A181-A184 VanDerWaalsContact O-N 3.16Å
182D41.9Very low42.2Very low130 Ų130110 Ų11070%0.69562%0.622SS**Hα-helixtrans-64.2-30.8-176.9-105.9-88.3000113.4G180 A184G180-D182 PolarHBondContact O-N 3.16Å; D182-A184 VanDerWaalsContact C-N 3.34Å; D182-A184 PolarHBondContact O-N 2.86Å
183E44.7Very low41.4Very low171 Ų171109.9 Ų109.980%0.79964%0.637SS**Hα-helixtrans-66.9-32.5174-79.3-161.985.100113.2A181 L185 N186A181-E183 VanDerWaalsContact C-N 3.33Å; A181-E183 PolarHBondContact O-N 3.29Å; E183-L185 VanDerWaalsContact C-N 3.26Å; E183-L185 PolarHBondContact O-N 3.18Å; E183-N186 PolarHBondContact O-N 3.47Å
184A41.4Very low40.9Very low58 Ų58108.1 Ų108.148%0.47965%0.654SS.*Hα-helixtrans-67.9-25-172.800000113.3A181 D182A181-A184 WeakPolarHBondContact O-CB 3.07Å; A181-A184 PolarHBondContact O-N 2.77Å; A181-A184 VanDerWaalsContact O-N 3.16Å; D182-A184 VanDerWaalsContact C-N 3.34Å; D182-A184 PolarHBondContact O-N 2.86Å
185L40.9Very low40.4Very low119 Ų119109 Ų10962%0.62368%0.676SS**Hα-helixtrans-78.7-24.7179.2-77168.6000113.4E183E183-L185 VanDerWaalsContact C-N 3.26Å; E183-L185 PolarHBondContact O-N 3.18Å
186N38.3Very low39.9Very low111 Ų111113.1 Ų113.159%0.59472%0.72SS**Hα-helixtrans-69.3-37.3177.2-93.2-52.2000112.6E183 L188 S189E183-N186 PolarHBondContact O-N 3.47Å; N186-L188 VanDerWaalsContact C-N 3.26Å; N186-L188 PolarHBondContact O-N 3.41Å; N186-S189 PolarHBondContact O-N 2.82Å; N186-S189 VanDerWaalsContact O-N 3.16Å
187L40.3Very low40Very low137 Ų137117.2 Ų117.272%0.71774%0.739SS**Hα-helixtrans-65.6-27.4180-67.3176.4000113.1S189L187-S189 VanDerWaalsContact C-N 3.34Å
188L39.3Very low39.9Very low129 Ų129112.2 Ų112.268%0.67574%0.735SS**Hα-helixtrans-75.8-20176.7-73.2166.5000113.4N186N186-L188 VanDerWaalsContact C-N 3.26Å; N186-L188 PolarHBondContact O-N 3.41Å
189S40.8Very low39.5Very low93 Ų93110.1 Ų110.165%0.6574%0.738SS**Hα-helixtrans-84.8-17.1178.8-65.30000114.1N186 L187N186-S189 PolarHBondContact O-N 2.82Å; N186-S189 VanDerWaalsContact O-N 3.16Å; L187-S189 VanDerWaalsContact C-N 3.34Å
190L39.4Very low39.2Very low143 Ų143110.6 Ų110.675%0.74974%0.744SS**SBendtrans-92.3-12.1-175.7-78.4158.8000114.4S192L190-S192 VanDerWaalsContact C-N 3.33Å; L190-S192 PolarHBondContact O-N 2.88Å
191G39.6Very low39.4Very low75 Ų75113.8 Ų113.877%0.77375%0.752SS**SBendtrans-82.910.4-174.900000116.7
192S43.1Very low39.2Very low117 Ų117118.5 Ų118.582%0.81878%0.778SS**  trans-11435.4-168.3-168.20000114.8L190L190-S192 VanDerWaalsContact C-N 3.33Å; L190-S192 PolarHBondContact O-N 2.88Å
193S36.3Very low39Very low123 Ų123117.6 Ų117.686%0.8678%0.784SS**  trans-135.1109.7171.3-170.50000110
194G33.5Very low38.5Very low85 Ų85113.5 Ų113.588%0.87678%0.783SS**  trans161.840.1-170.700000114.7
195A32.8Very low38.3Very low106 Ų106118.2 Ų118.288%0.87681%0.808SS**  trans-122.4109.2171.400000108.9
196A35.1Very low38Very low180 Ų180118.1 Ų118.1100%1.48883%0.825SS**  trans-150.80175.600000108.3

Retrieved 196 of 196 residues in 371.1 ms (Link to these results)