A0A077Z4U8_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z4U8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 70 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
1M29.1Very low29.7Very low245 Ų245143.9 Ų143.9100%1.20778%0.776SS**  0103.60-76.1178.2-102.100107.7G3M1-G3 PolarHBondContact O-N 2.89Å
2M24.3Very low30.2Very low197 Ų197143.1 Ų143.197%0.9776%0.76SS**  trans-74.697.9178.4-79.5160.8131.200108.5
3G26.4Very low30.8Very low63 Ų63146.4 Ų146.465%0.64977%0.768SS**  trans-82.6111171.400000109.2M1 I5M1-G3 PolarHBondContact O-N 2.89Å; G3-I5 PolarHBondContact O-N 3.43Å
4T27.9Very low31.2Very low117 Ų117143.8 Ų143.872%0.71875%0.748SS**  trans-63.1101177.6-35.70000109.3C6T4-C6 HydrophobicContact CG2-CB 4.28Å; T4-C6 PolarHBondContact O-N 3.38Å
5I28.8Very low31.3Very low129 Ų129141.9 Ų141.966%0.66275%0.752SS**THydrogen-bonded Turntrans-74.562.1174.2-59.3162.5000108.8G3 F9G3-I5 PolarHBondContact O-N 3.43Å; I5-F9 HydrophobicContact CG2-CE2 4.31Å
6C30.6Very low31.2Very low102 Ų102137.1 Ų137.169%0.68973%0.727SS**THydrogen-bonded Turntrans-115-14.8170.3-85.80000112.6T4 R8T4-C6 HydrophobicContact CG2-CB 4.28Å; T4-C6 PolarHBondContact O-N 3.38Å; C6-R8 PolarHBondContact O-N 3.28Å
7E26.7Very low31.4Very low189 Ų189135.4 Ų135.488%0.88373%0.728SS**SBendtrans-80.8-15.9-169.1-70.3-169.9151.600115.9
8R31.3Very low31.3Very low240 Ų240137.4 Ų137.491%0.90673%0.73SS**SBendtrans-113.6-7.1-172-84.1-170.8-179.3-175.11.9117.2C6 C10C6-R8 PolarHBondContact O-N 3.28Å; R8-C10 PolarHBondContact O-N 3.07Å
9F35.1Very low31.4Very low77 Ų77132.8 Ų132.834%0.33872%0.718SS.*  trans-81.578.7163.5-66.1-71.4000106.4I5 C11 L27 V35I5-F9 HydrophobicContact CG2-CE2 4.31Å; F9-C11 VanDerWaalsContact C-N 3.26Å; F9-C11 PolarHBondContact O-N 3.45Å; F9-L27 HydrophobicContact CD1-CD1 3.3Å; F9-L27 HydrophobicContact CE1-CD1 3.27Å; F9-L27 HydrophobicContact CE1-CG 4.15Å; F9-L27 HydrophobicContact CG-CD1 4.39Å; F9-L27 HydrophobicContact CZ-CD1 4.33Å; F9-V35 HydrophobicContact CZ-CG2 4.43Å
10C32.1Very low31.3Very low108 Ų108134.4 Ų134.473%0.7372%0.718SS**  trans-53.8102.2166.3-168.40000105.4R8 K12R8-C10 PolarHBondContact O-N 3.07Å; C10-K12 PolarHBondContact O-N 2.6Å
11C34.8Very low31.3Very low116 Ų116130.7 Ų130.778%0.78470%0.703SS**  trans-57.789.6171-64.50000105.5F9 E13F9-C11 VanDerWaalsContact C-N 3.26Å; F9-C11 PolarHBondContact O-N 3.45Å; C11-E13 VanDerWaalsContact C-N 3.27Å; C11-E13 PolarHBondContact O-N 2.65Å
12K35.9Very low31.6Very low134 Ų134127.9 Ų127.958%0.58368%0.684SS**  trans-65.9102.1167.2-78.6-174.9178.4177.90104.5C10 F14C10-K12 PolarHBondContact O-N 2.6Å; K12-F14 VanDerWaalsContact C-N 3.28Å; K12-F14 HydrophobicContact CB-CD2 3.92Å; K12-F14 HydrophobicContact CB-CE1 4.27Å; K12-F14 HydrophobicContact CB-CE2 3.39Å; K12-F14 HydrophobicContact CB-CZ 3.59Å; K12-F14 HydrophobicContact CD-CE1 4.26Å; K12-F14 HydrophobicContact CD-CE2 4.25Å; K12-F14 HydrophobicContact CD-CZ 3.65Å; K12-F14 HydrophobicContact CG-CE2 4.46Å; K12-F14 HydrophobicContact CG-CZ 4.28Å; K12-F14 WeakPolarHBondContact O-CD2 3.45Å; K12-F14 PolarHBondContact O-N 3.11Å
13E37Very low32.3Very low186 Ų186121.6 Ų121.687%0.86966%0.657SS**  trans-60.499164.1-72-172.6163.800106.7C11 S15C11-E13 VanDerWaalsContact C-N 3.27Å; C11-E13 PolarHBondContact O-N 2.65Å; E13-S15 PolarHBondContact O-N 3.2Å
14F36.9Very low32.8Very low110 Ų110122.7 Ų122.748%0.48265%0.651SS.*  trans-83.491.5172.7-69.4-79.2000107.9K12 V23 D25K12-F14 VanDerWaalsContact C-N 3.28Å; K12-F14 HydrophobicContact CB-CD2 3.92Å; K12-F14 HydrophobicContact CB-CE1 4.27Å; K12-F14 HydrophobicContact CB-CE2 3.39Å; K12-F14 HydrophobicContact CB-CZ 3.59Å; K12-F14 HydrophobicContact CD-CE1 4.26Å; K12-F14 HydrophobicContact CD-CE2 4.25Å; K12-F14 HydrophobicContact CD-CZ 3.65Å; K12-F14 HydrophobicContact CG-CE2 4.46Å; K12-F14 HydrophobicContact CG-CZ 4.28Å; K12-F14 WeakPolarHBondContact O-CD2 3.45Å; K12-F14 PolarHBondContact O-N 3.11Å; F14-V23 HydrophobicContact CB-CG1 4.49Å; F14-V23 HydrophobicContact CB-CG2 4.14Å; F14-V23 HydrophobicContact CD1-CG1 4.08Å; F14-V23 HydrophobicContact CD2-CG1 3.79Å; F14-V23 HydrophobicContact CE1-CG1 4.21Å; F14-V23 HydrophobicContact CE2-CG1 3.92Å; F14-V23 HydrophobicContact CG-CG1 3.87Å; F14-V23 HydrophobicContact CG-CG2 4.34Å; F14-V23 HydrophobicContact CZ-CG1 4.13Å; F14-D25 HydrophobicContact CE2-CB 4.32Å; F14-D25 VanDerWaalsContact CE2-OD2 3.31Å; F14-D25 WeakPolarHBondContact CE2-OD2 3.16Å; F14-D25 HydrophobicContact CZ-CB 4.35Å; F14-D25 WeakPolarHBondContact CZ-OD2 3.26Å
15S33.5Very low33.5Very low115 Ų115120.8 Ų120.880%0.80464%0.636SS**  trans-82114.1163.960.70000108.6E13E13-S15 PolarHBondContact O-N 3.2Å
16N28.7Very low34.2Very low66 Ų66118.9 Ų118.935%0.35363%0.631SS.*  trans-110.8125.6167.4152.1-66.5000107.4F18 G19 S21N16-F18 VanDerWaalsContact C-N 3.25Å; N16-F18 PolarHBondContact O-N 2.91Å; N16-F18 WeakPolarHBondContact OD1-CA 3.5Å; N16-F18 PolarHBondContact OD1-N 2.91Å; N16-F18 PolarHBondContact OD1-O 3Å; N16-F18 VanDerWaalsContact OD1-O 3.11Å; N16-G19 PolarHBondContact OD1-N 3.01Å; N16-S21 VanDerWaalsContact CB-CB 3.42Å; N16-S21 WeakPolarHBondContact CB-OG 3.2Å; N16-S21 VanDerWaalsContact ND2-CB 3.26Å; N16-S21 WeakPolarHBondContact ND2-CB 3.16Å
17S34.4Very low35.3Very low108 Ų108116.2 Ų116.276%0.75561%0.609SS**SBendtrans-84.45.1-178.7-34.40000113.5
18F30.7Very low36.5Very low171 Ų171115.3 Ų115.375%0.7561%0.605SS**SBendtrans-137.271.1-167.7-67.8-77.2000110.8N16 F20N16-F18 VanDerWaalsContact C-N 3.25Å; N16-F18 PolarHBondContact O-N 2.91Å; N16-F18 WeakPolarHBondContact OD1-CA 3.5Å; N16-F18 PolarHBondContact OD1-N 2.91Å; N16-F18 PolarHBondContact OD1-O 3Å; N16-F18 VanDerWaalsContact OD1-O 3.11Å; F18-F20 PolarHBondContact O-N 3.21Å
19G32.9Very low37.6Very low50 Ų50104.9 Ų104.952%0.51557%0.567SS.*SBendtrans52.4-14.2150.200000120.9N16 R68N16-G19 PolarHBondContact OD1-N 3.01Å; G19-R68 PolarHBondContact O-NH2 3.01Å
20F30Very low38.4Very low164 Ų164104.3 Ų104.372%0.71957%0.571SS**  trans-170.270.6-168.1-61.5-85.4000109.3F18 K22F18-F20 PolarHBondContact O-N 3.21Å; F20-K22 PolarHBondContact O-N 2.9Å
21S30.5Very low39.9Very low57 Ų57104 Ų10440%0.39957%0.57SS.*  trans-85.3108.5163.438.60000110N16 V23N16-S21 VanDerWaalsContact CB-CB 3.42Å; N16-S21 WeakPolarHBondContact CB-OG 3.2Å; N16-S21 VanDerWaalsContact ND2-CB 3.26Å; N16-S21 WeakPolarHBondContact ND2-CB 3.16Å; S21-V23 PolarHBondContact O-N 2.72Å
22K35.3Very low41Very low186 Ų186104.5 Ų104.581%0.80957%0.565SS**  trans-6687.3154.8-173.9-174179.6177.10107.6F20 V24F20-K22 PolarHBondContact O-N 2.9Å; K22-V24 HydrophobicContact CD-CG2 4.2Å; K22-V24 HydrophobicContact CG-CG2 3.89Å; K22-V24 PolarHBondContact O-N 3.29Å
23V38.9Very low41.9Very low65 Ų6599.4 Ų99.439%0.39455%0.548SS..  trans-79.799.3172.3-175.70000107F14 S21 D25F14-V23 HydrophobicContact CB-CG1 4.49Å; F14-V23 HydrophobicContact CB-CG2 4.14Å; F14-V23 HydrophobicContact CD1-CG1 4.08Å; F14-V23 HydrophobicContact CD2-CG1 3.79Å; F14-V23 HydrophobicContact CE1-CG1 4.21Å; F14-V23 HydrophobicContact CE2-CG1 3.92Å; F14-V23 HydrophobicContact CG-CG1 3.87Å; F14-V23 HydrophobicContact CG-CG2 4.34Å; F14-V23 HydrophobicContact CZ-CG1 4.13Å; S21-V23 PolarHBondContact O-N 2.72Å; V23-D25 HydrophobicContact CG1-CB 4.28Å; V23-D25 PolarHBondContact O-N 2.79Å
24V37.6Very low42.8Very low87 Ų8797 Ų9753%0.52753%0.532SS..  trans-90.986.6167.2-172.50000106.5K22K22-V24 HydrophobicContact CD-CG2 4.2Å; K22-V24 HydrophobicContact CG-CG2 3.89Å; K22-V24 PolarHBondContact O-N 3.29Å
25D41.9Very low44Very low77 Ų7793 Ų9341%0.41252%0.517SS..  trans-98142165.7-151.1-15.4000109.5F14 V23F14-D25 HydrophobicContact CE2-CB 4.32Å; F14-D25 VanDerWaalsContact CE2-OD2 3.31Å; F14-D25 WeakPolarHBondContact CE2-OD2 3.16Å; F14-D25 HydrophobicContact CZ-CB 4.35Å; F14-D25 WeakPolarHBondContact CZ-OD2 3.26Å; V23-D25 HydrophobicContact CG1-CB 4.28Å; V23-D25 PolarHBondContact O-N 2.79Å
26T44.3Very low45.2Very low88 Ų8891.3 Ų91.354%0.5450%0.502SS..  trans-96.2101177.8-61.70000108.3Q28T26-Q28 PolarHBondContact O-N 2.77Å
27L52.8Low47Very low47 Ų4790.6 Ų90.625%0.24650%0.495CS..  trans-86.5108.9173.6-173.371.8000109.6F9 I29 V35F9-L27 HydrophobicContact CD1-CD1 3.3Å; F9-L27 HydrophobicContact CE1-CD1 3.27Å; F9-L27 HydrophobicContact CE1-CG 4.15Å; F9-L27 HydrophobicContact CG-CD1 4.39Å; F9-L27 HydrophobicContact CZ-CD1 4.33Å; L27-I29 HydrophobicContact CD2-CD1 3.99Å; L27-I29 HydrophobicContact CD2-CG1 3.97Å; L27-I29 HydrophobicContact CG-CG1 3.98Å; L27-I29 PolarHBondContact O-N 2.95Å; L27-V35 HydrophobicContact CD2-CB 3.77Å; L27-V35 HydrophobicContact CD2-CG1 3.66Å; L27-V35 HydrophobicContact CD2-CG2 3.92Å
28Q51.3Low48.2Very low169 Ų16988.4 Ų88.479%0.7948%0.48SS*.  trans-84.6108.7172.7-169.4172.1300109.5T26T26-Q28 PolarHBondContact O-N 2.77Å
29I55Low49.7Very low22 Ų2282.7 Ų82.711%0.11346%0.457CS..PPolyproline II helixtrans-97124.7177.3-52.9178.2000107.8L27 A33 V35 V51 I62L27-I29 HydrophobicContact CD2-CD1 3.99Å; L27-I29 HydrophobicContact CD2-CG1 3.97Å; L27-I29 HydrophobicContact CG-CG1 3.98Å; L27-I29 PolarHBondContact O-N 2.95Å; I29-A33 HydrophobicContact CG2-CB 3.67Å; I29-A33 WeakPolarHBondContact CG2-O 3.16Å; I29-V35 HydrophobicContact CD1-CB 3.9Å; I29-V35 HydrophobicContact CD1-CG2 3.79Å; I29-V35 HydrophobicContact CG1-CB 4.37Å; I29-V35 HydrophobicContact CG1-CG2 3.72Å; I29-V35 HydrophobicContact CG2-CG2 4.23Å; I29-V51 HydrophobicContact CD1-CB 4.33Å; I29-V51 HydrophobicContact CD1-CG1 4.08Å; I29-I62 HydrophobicContact CD1-CD1 4.14Å
30P52Low50.7Low65 Ų6586.1 Ų86.142%0.42246%0.459SS..PPolyproline II helixtrans-57.2153.4174.5-23.332.4000112N32 A33 S53P30-N32 PolarHBondContact O-N 3.03Å; P30-A33 HydrophobicContact CB-CB 4.15Å; P30-A33 HydrophobicContact CG-CB 4.36Å; P30-A33 VanDerWaalsContact O-CB 3.28Å; P30-A33 WeakPolarHBondContact O-CB 3.17Å; P30-A33 PolarHBondContact O-N 2.64Å; P30-S53 PolarHBondContact O-OG 3.41Å
31S62.7Low51.8Low102 Ų10282.4 Ų82.471%0.71345%0.447SS*.THydrogen-bonded Turntrans-54.3135.4175.5-164.60000110.7A33 S53S31-A33 PolarHBondContact O-N 2.98Å; S31-S53 WeakPolarHBondContact CA-OG 3.31Å
32N59Low53.4Low126 Ų12686.6 Ų86.667%0.67447%0.465SS*.THydrogen-bonded Turntrans62.514.9-175.8-50.1-26.5000115.1P30 S53P30-N32 PolarHBondContact O-N 3.03Å; N32-S53 PolarHBondContact N-OG 3.26Å
33A54.3Low54.6Low27 Ų2783.3 Ų83.322%0.22347%0.466CS..  trans-94.9161.2168.700000110.7I29 P30 S31 S53I29-A33 HydrophobicContact CG2-CB 3.67Å; I29-A33 WeakPolarHBondContact CG2-O 3.16Å; P30-A33 HydrophobicContact CB-CB 4.15Å; P30-A33 HydrophobicContact CG-CB 4.36Å; P30-A33 VanDerWaalsContact O-CB 3.28Å; P30-A33 WeakPolarHBondContact O-CB 3.17Å; P30-A33 PolarHBondContact O-N 2.64Å; S31-A33 PolarHBondContact O-N 2.98Å; A33-S53 PolarHBondContact O-N 3.01Å
34Y57.2Low55.2Low134 Ų13487.5 Ų87.553%0.52548%0.478SS..EExtended strand (participates in β ladder)trans-127.4151.1169.565.6-87.4000109.5R50 V51Y34-R50 VanDerWaalsContact CD1-NH2 3.27Å; Y34-R50 HydrophobicContact CD2-CG 4.12Å; Y34-R50 VanDerWaalsContact CD2-NE 3.34Å; Y34-V51 CarbonylContact C-O 3.55Å; Y34-V51 WeakPolarHBondContact CA-O 3.5Å; Y34-V51 WeakPolarHBondContact CB-O 3.16Å
35V60.7Low56.4Low28 Ų2886.7 Ų86.717%0.1747%0.474CS..EExtended strand (participates in β ladder)trans-122137.5168.9178.50000108.8F9 L27 I29 R50 V51F9-V35 HydrophobicContact CZ-CG2 4.43Å; L27-V35 HydrophobicContact CD2-CB 3.77Å; L27-V35 HydrophobicContact CD2-CG1 3.66Å; L27-V35 HydrophobicContact CD2-CG2 3.92Å; I29-V35 HydrophobicContact CD1-CB 3.9Å; I29-V35 HydrophobicContact CD1-CG2 3.79Å; I29-V35 HydrophobicContact CG1-CB 4.37Å; I29-V35 HydrophobicContact CG1-CG2 3.72Å; I29-V35 HydrophobicContact CG2-CG2 4.23Å; V35-R50 WeakPolarHBondContact O-CA 3.44Å; V35-V51 PolarHBondContact N-O 2.92Å; V35-V51 PolarHBondContact O-N 3.37Å
36T60Low57.2Low79 Ų7989.7 Ų89.749%0.48548%0.483SS..EExtended strand (participates in β ladder)trans-110.8128.2174.1-55.10000108.1F49T36-F49 VanDerWaalsContact CA-O 3.29Å; T36-F49 WeakPolarHBondContact CA-O 3.28Å
37F66.2Low57.8Low51 Ų5186.4 Ų86.422%0.22447%0.467CS..EExtended strand (participates in β ladder)trans-129.8143.1171.559.1-89.2000110.6I39 F49 V51 F64 F66F37-I39 HydrophobicContact CD2-CG1 4.36Å; F37-I39 HydrophobicContact CE2-CG1 4.44Å; F37-F49 HydrophobicContact CD1-CB 4.4Å; F37-F49 HydrophobicContact CD2-CB 4.14Å; F37-F49 HydrophobicContact CD2-CD2 4.25Å; F37-F49 HydrophobicContact CE1-CB 3.88Å; F37-F49 HydrophobicContact CE2-CB 3.58Å; F37-F49 AromaticContact CE2-CD2 3.74Å; F37-F49 HydrophobicContact CE2-CD2 3.74Å; F37-F49 AromaticContact CE2-CG 3.84Å; F37-F49 HydrophobicContact CE2-CG 3.84Å; F37-F49 HydrophobicContact CZ-CB 3.43Å; F37-F49 VanDerWaalsContact CZ-CB 3.43Å; F37-F49 HydrophobicContact CZ-CD2 4.38Å; F37-F49 HydrophobicContact CZ-CG 4.01Å; F37-F49 PolarHBondContact N-O 2.92Å; F37-F49 PolarHBondContact O-N 3.36Å; F37-V51 HydrophobicContact CE1-CG2 4.17Å; F37-F64 HydrophobicContact CE1-CD1 4.36Å; F37-F64 HydrophobicContact CE1-CD2 4.37Å; F37-F64 AromaticContact CE1-CE1 3.76Å; F37-F64 HydrophobicContact CE1-CE1 3.76Å; F37-F64 AromaticContact CE1-CE2 3.77Å; F37-F64 HydrophobicContact CE1-CE2 3.77Å; F37-F64 AromaticContact CE1-CZ 3.42Å; F37-F64 HydrophobicContact CE1-CZ 3.42Å; F37-F64 VanDerWaalsContact CE1-CZ 3.42Å; F37-F64 AromaticContact CZ-CD1 3.66Å; F37-F64 HydrophobicContact CZ-CD1 3.66Å; F37-F64 HydrophobicContact CZ-CD2 4.03Å; F37-F64 AromaticContact CZ-CE1 3.47Å; F37-F64 HydrophobicContact CZ-CE1 3.47Å; F37-F64 VanDerWaalsContact CZ-CE1 3.47Å; F37-F64 AromaticContact CZ-CE2 3.86Å; F37-F64 HydrophobicContact CZ-CE2 3.86Å; F37-F64 AromaticContact CZ-CG 3.93Å; F37-F64 HydrophobicContact CZ-CG 3.93Å; F37-F64 AromaticContact CZ-CZ 3.58Å; F37-F64 HydrophobicContact CZ-CZ 3.58Å; F37-F66 HydrophobicContact CE2-CE1 4.46Å; F37-F66 AromaticContact CE2-CZ 3.95Å; F37-F66 HydrophobicContact CE2-CZ 3.95Å
38S59.1Low58.1Low62 Ų6289.5 Ų89.543%0.43448%0.484SS..EExtended strand (participates in β ladder)trans-106.1130.7178.1-59.10000108.8G47 N48S38-G47 WeakPolarHBondContact CA-O 3.07Å; S38-N48 WeakPolarHBondContact CB-OD1 3.41Å; S38-N48 PolarHBondContact OG-OD1 3.47Å
39I61.8Low58.5Low50 Ų5085.3 Ų85.326%0.25646%0.463SS..EExtended strand (participates in β ladder)trans-92116.1173.8-56.7179.6000107.4F37 T45 F46 G47 F49 F66F37-I39 HydrophobicContact CD2-CG1 4.36Å; F37-I39 HydrophobicContact CE2-CG1 4.44Å; I39-T45 CarbonylContact O-C 3.59Å; I39-T45 WeakPolarHBondContact O-CA 3.43Å; I39-F46 PolarHBondContact O-N 3.47Å; I39-G47 PolarHBondContact N-O 2.82Å; I39-F49 HydrophobicContact CD1-CD2 3.84Å; I39-F49 HydrophobicContact CD1-CE2 3.32Å; I39-F49 HydrophobicContact CD1-CZ 4.13Å; I39-F49 HydrophobicContact CG1-CD2 4.04Å; I39-F49 HydrophobicContact CG1-CE2 3.85Å; I39-F66 HydrophobicContact CD1-CD1 3.49Å; I39-F66 VanDerWaalsContact CD1-CD1 3.49Å; I39-F66 HydrophobicContact CD1-CD2 4.27Å; I39-F66 HydrophobicContact CD1-CE1 3.13Å; I39-F66 HydrophobicContact CD1-CE2 3.96Å; I39-F66 HydrophobicContact CD1-CG 4.06Å; I39-F66 HydrophobicContact CD1-CZ 3.38Å; I39-F66 HydrophobicContact CG1-CE1 4.45Å; I39-F66 HydrophobicContact CG1-CZ 4.4Å
40Q54.6Low58.7Low123 Ų12392.2 Ų92.258%0.57549%0.488SS*.EExtended strand (participates in β ladder)trans-116.2140.2177.1-66.7-176.7-14.100110.8K44 T45Q40-K44 CarbonylContact C-O 3.51Å; Q40-K44 WeakPolarHBondContact CA-O 3.41Å; Q40-T45 HydrophobicContact CG-CG2 4.49Å; Q40-T45 WeakPolarHBondContact CG-OG1 3.29Å; Q40-T45 PolarHBondContact NE2-OG1 3.44Å
41N52.6Low59.1Low85 Ų8590.2 Ų90.246%0.45547%0.474SS..EExtended strand (participates in β ladder)trans-134.8129.6165.8174.716.6000108.2S43 K44 F46N41-S43 VanDerWaalsContact C-N 3.27Å; N41-S43 PolarHBondContact O-N 3.2Å; N41-K44 PolarHBondContact N-O 2.91Å; N41-K44 PolarHBondContact O-N 3.1Å; N41-F46 HydrophobicContact CB-CD2 4.12Å; N41-F46 HydrophobicContact CB-CE2 3.43Å; N41-F46 VanDerWaalsContact CB-CE2 3.43Å; N41-F46 HydrophobicContact CB-CZ 4.05Å
42N63.4Low58.8Low146 Ų14687.8 Ų87.878%0.78146%0.457SS*.THydrogen-bonded Turntrans46.849.7-175.1-63.5-26.9000112.7K44N42-K44 PolarHBondContact O-N 3.02Å
43S61.7Low58.6Low117 Ų11782.1 Ų82.182%0.81843%0.428SS*.THydrogen-bonded Turntrans64.16.2-179.6-49.40000116.1N41N41-S43 VanDerWaalsContact C-N 3.27Å; N41-S43 PolarHBondContact O-N 3.2Å
44K50.5Low58.5Low153 Ų15387.7 Ų87.767%0.66545%0.449SS*.EExtended strand (participates in β ladder)trans-97.9127.5172.3-67-175.2178.9-178.30110.4Q40 N41 N42 F46Q40-K44 CarbonylContact C-O 3.51Å; Q40-K44 WeakPolarHBondContact CA-O 3.41Å; N41-K44 PolarHBondContact N-O 2.91Å; N41-K44 PolarHBondContact O-N 3.1Å; N42-K44 PolarHBondContact O-N 3.02Å; K44-F46 HydrophobicContact CB-CE2 4.07Å; K44-F46 HydrophobicContact CB-CZ 4.46Å; K44-F46 WeakPolarHBondContact O-CD2 3.49Å; K44-F46 WeakPolarHBondContact O-CE2 3.26Å
45T64.6Low57.9Low70 Ų7087.3 Ų87.343%0.42947%0.466SS..EExtended strand (participates in β ladder)trans-80.6120.4173-54.30000110.3I39 Q40I39-T45 CarbonylContact O-C 3.59Å; I39-T45 WeakPolarHBondContact O-CA 3.43Å; Q40-T45 HydrophobicContact CG-CG2 4.49Å; Q40-T45 WeakPolarHBondContact CG-OG1 3.29Å; Q40-T45 PolarHBondContact NE2-OG1 3.44Å
46F57.6Low57.1Low139 Ų13987.7 Ų87.761%0.6147%0.472SS*.EExtended strand (participates in β ladder)trans-88.8-22.3179.7-71-94.6000112.7I39 N41 K44I39-F46 PolarHBondContact O-N 3.47Å; N41-F46 HydrophobicContact CB-CD2 4.12Å; N41-F46 HydrophobicContact CB-CE2 3.43Å; N41-F46 VanDerWaalsContact CB-CE2 3.43Å; N41-F46 HydrophobicContact CB-CZ 4.05Å; K44-F46 HydrophobicContact CB-CE2 4.07Å; K44-F46 HydrophobicContact CB-CZ 4.46Å; K44-F46 WeakPolarHBondContact O-CD2 3.49Å; K44-F46 WeakPolarHBondContact O-CE2 3.26Å
47G56.8Low56.4Low19 Ų1995.2 Ų95.220%0.19649%0.491CS..EExtended strand (participates in β ladder)trans178153.5178.800000111.7S38 I39S38-G47 WeakPolarHBondContact CA-O 3.07Å; I39-G47 PolarHBondContact N-O 2.82Å
48N59.8Low55.4Low112 Ų11298.5 Ų98.560%0.59950%0.503SS*.EExtended strand (participates in β ladder)trans-109.4121.1170.5-63.2-47.1000107.1S38S38-N48 WeakPolarHBondContact CB-OD1 3.41Å; S38-N48 PolarHBondContact OG-OD1 3.47Å
49F59.1Low54.7Low81 Ų81101.7 Ų101.736%0.35552%0.522SS..EExtended strand (participates in β ladder)trans-108.2128.6178.4-63.1-91.3000108.2T36 F37 I39 F66T36-F49 VanDerWaalsContact CA-O 3.29Å; T36-F49 WeakPolarHBondContact CA-O 3.28Å; F37-F49 HydrophobicContact CD1-CB 4.4Å; F37-F49 HydrophobicContact CD2-CB 4.14Å; F37-F49 HydrophobicContact CD2-CD2 4.25Å; F37-F49 HydrophobicContact CE1-CB 3.88Å; F37-F49 HydrophobicContact CE2-CB 3.58Å; F37-F49 AromaticContact CE2-CD2 3.74Å; F37-F49 HydrophobicContact CE2-CD2 3.74Å; F37-F49 AromaticContact CE2-CG 3.84Å; F37-F49 HydrophobicContact CE2-CG 3.84Å; F37-F49 HydrophobicContact CZ-CB 3.43Å; F37-F49 VanDerWaalsContact CZ-CB 3.43Å; F37-F49 HydrophobicContact CZ-CD2 4.38Å; F37-F49 HydrophobicContact CZ-CG 4.01Å; F37-F49 PolarHBondContact N-O 2.92Å; F37-F49 PolarHBondContact O-N 3.36Å; I39-F49 HydrophobicContact CD1-CD2 3.84Å; I39-F49 HydrophobicContact CD1-CE2 3.32Å; I39-F49 HydrophobicContact CD1-CZ 4.13Å; I39-F49 HydrophobicContact CG1-CD2 4.04Å; I39-F49 HydrophobicContact CG1-CE2 3.85Å; F49-F66 HydrophobicContact CE2-CE1 4.23Å; F49-F66 HydrophobicContact CZ-CE1 4.22Å
50R58.9Low53.8Low167 Ų167103.9 Ų103.963%0.6354%0.542SS*.EExtended strand (participates in β ladder)trans-109.4127.1171.2-176.1178-178.9-170.6-1.6108.1Y34 V35Y34-R50 VanDerWaalsContact CD1-NH2 3.27Å; Y34-R50 HydrophobicContact CD2-CG 4.12Å; Y34-R50 VanDerWaalsContact CD2-NE 3.34Å; V35-R50 WeakPolarHBondContact O-CA 3.44Å
51V61.2Low53.3Low24 Ų2498.7 Ų98.715%0.14552%0.521CS..EExtended strand (participates in β ladder)trans-120.7117.5174.3178.10000108.8I29 Y34 V35 F37 I62 F64I29-V51 HydrophobicContact CD1-CB 4.33Å; I29-V51 HydrophobicContact CD1-CG1 4.08Å; Y34-V51 CarbonylContact C-O 3.55Å; Y34-V51 WeakPolarHBondContact CA-O 3.5Å; Y34-V51 WeakPolarHBondContact CB-O 3.16Å; V35-V51 PolarHBondContact N-O 2.92Å; V35-V51 PolarHBondContact O-N 3.37Å; F37-V51 HydrophobicContact CE1-CG2 4.17Å; V51-I62 HydrophobicContact CG1-CD1 3.36Å; V51-F64 HydrophobicContact CB-CZ 4.27Å; V51-F64 HydrophobicContact CG1-CZ 4.47Å; V51-F64 HydrophobicContact CG2-CE1 3.48Å; V51-F64 VanDerWaalsContact CG2-CE1 3.48Å; V51-F64 HydrophobicContact CG2-CZ 3.44Å; V51-F64 VanDerWaalsContact CG2-CZ 3.44Å
52S55.6Low53.1Low50 Ų5095.7 Ų95.735%0.3551%0.505SS..EExtended strand (participates in β ladder)trans-103.1141.6174.658.50000109.8E54S52-E54 PolarHBondContact O-N 2.97Å
53S54.9Low52.2Low8 Ų896.8 Ų96.86%0.05650%0.503CS..  trans-86.828.6176.379.80000112P30 S31 N32 A33 S55P30-S53 PolarHBondContact O-OG 3.41Å; S31-S53 WeakPolarHBondContact CA-OG 3.31Å; N32-S53 PolarHBondContact N-OG 3.26Å; A33-S53 PolarHBondContact O-N 3.01Å; S53-S55 PolarHBondContact O-N 2.9Å
54E51.9Low51.6Low144 Ų14494.8 Ų94.867%0.67348%0.48SS*.SBendtrans-60.5-11.5-162.9-93.7-173.9174.100115.4S52S52-E54 PolarHBondContact O-N 2.97Å
55S45.7Very low51.1Low125 Ų12592.1 Ų92.187%0.87448%0.48SS*.SBendtrans-161.4-5.8168.7-72.60000114.1S53 R57S53-S55 PolarHBondContact O-N 2.9Å; S55-R57 PolarHBondContact O-N 3.27Å
56A43.8Very low50.1Low36 Ų3694.5 Ų94.530%0.29849%0.485SS..  trans-91.899.5-17600000109.4Y58A56-Y58 VanDerWaalsContact C-N 3.28Å; A56-Y58 HydrophobicContact CB-CD1 4.36Å; A56-Y58 HydrophobicContact CB-CD2 3.65Å; A56-Y58 HydrophobicContact CB-CE1 3.91Å; A56-Y58 HydrophobicContact CB-CE2 3.15Å; A56-Y58 HydrophobicContact CB-CG 4.24Å; A56-Y58 VanDerWaalsContact O-CD2 3.26Å; A56-Y58 WeakPolarHBondContact O-CD2 2.9Å; A56-Y58 PolarHBondContact O-N 2.9Å
57R43.8Very low49Very low238 Ų23897.1 Ų97.190%0.89850%0.497SS*.  trans-55.3101.7152.9-74.1-179.5-178.9-172.80.1106.1S55 P59S55-R57 PolarHBondContact O-N 3.27Å; R57-P59 WeakPolarHBondContact O-CD 3.39Å
58Y45.7Very low48.3Very low120 Ų120102.9 Ų102.947%0.47151%0.512SS..  trans-96.877.8167-64.8-74.8000108A56 S60 G61 I62A56-Y58 VanDerWaalsContact C-N 3.28Å; A56-Y58 HydrophobicContact CB-CD1 4.36Å; A56-Y58 HydrophobicContact CB-CD2 3.65Å; A56-Y58 HydrophobicContact CB-CE1 3.91Å; A56-Y58 HydrophobicContact CB-CE2 3.15Å; A56-Y58 HydrophobicContact CB-CG 4.24Å; A56-Y58 VanDerWaalsContact O-CD2 3.26Å; A56-Y58 WeakPolarHBondContact O-CD2 2.9Å; A56-Y58 PolarHBondContact O-N 2.9Å; Y58-S60 PolarHBondContact O-N 3.3Å; Y58-S60 VanDerWaalsContact O-N 3.1Å; Y58-G61 PolarHBondContact O-N 2.87Å; Y58-I62 HydrophobicContact CD1-CG1 4.08Å; Y58-I62 HydrophobicContact CD2-CD1 3.52Å; Y58-I62 HydrophobicContact CD2-CG1 3.51Å; Y58-I62 HydrophobicContact CE1-CG1 4.35Å; Y58-I62 HydrophobicContact CE2-CD1 3.52Å; Y58-I62 HydrophobicContact CE2-CG1 3.77Å; Y58-I62 HydrophobicContact CG-CD1 4.21Å; Y58-I62 HydrophobicContact CG-CG1 3.66Å
59P45.4Very low47Very low128 Ų128103.7 Ų103.783%0.83152%0.524SS*.THydrogen-bonded Turntrans-61.1-19.8176.926.8-34.6000112R57R57-P59 WeakPolarHBondContact O-CD 3.39Å
60S42.8Very low46.4Very low97 Ų97112 Ų11268%0.67856%0.56SS**THydrogen-bonded Turntrans-112.716.2-175.459.50000114.6Y58Y58-S60 PolarHBondContact O-N 3.3Å; Y58-S60 VanDerWaalsContact O-N 3.1Å
61G44.3Very low45.8Very low13 Ų13109.3 Ų109.313%0.13456%0.557CS.*  trans79.6164.718000000114.7Y58Y58-G61 PolarHBondContact O-N 2.87Å
62I47.3Very low45Very low23 Ų23113.7 Ų113.712%0.11858%0.578CS.*  trans-100.1119.7179.2-55.9179.8000107.6I29 V51 Y58 F64I29-I62 HydrophobicContact CD1-CD1 4.14Å; V51-I62 HydrophobicContact CG1-CD1 3.36Å; Y58-I62 HydrophobicContact CD1-CG1 4.08Å; Y58-I62 HydrophobicContact CD2-CD1 3.52Å; Y58-I62 HydrophobicContact CD2-CG1 3.51Å; Y58-I62 HydrophobicContact CE1-CG1 4.35Å; Y58-I62 HydrophobicContact CE2-CD1 3.52Å; Y58-I62 HydrophobicContact CE2-CG1 3.77Å; Y58-I62 HydrophobicContact CG-CD1 4.21Å; Y58-I62 HydrophobicContact CG-CG1 3.66Å; I62-F64 HydrophobicContact CB-CE2 4.21Å; I62-F64 HydrophobicContact CB-CZ 4.28Å; I62-F64 HydrophobicContact CG2-CD2 4.44Å; I62-F64 HydrophobicContact CG2-CE1 3.93Å; I62-F64 HydrophobicContact CG2-CE2 3.77Å; I62-F64 HydrophobicContact CG2-CZ 3.47Å; I62-F64 VanDerWaalsContact CG2-CZ 3.47Å
63K45.4Very low44.4Very low169 Ų169117.3 Ų117.374%0.73559%0.591SS**  trans-95115.7177.3-68.7-177-178174.60109.7
64F49.4Very low43.8Very low74 Ų74123.7 Ų123.733%0.32562%0.622SS.*  trans-91.7132.7168.5-57.8-79.4000109.8F37 V51 I62 F66F37-F64 HydrophobicContact CE1-CD1 4.36Å; F37-F64 HydrophobicContact CE1-CD2 4.37Å; F37-F64 AromaticContact CE1-CE1 3.76Å; F37-F64 HydrophobicContact CE1-CE1 3.76Å; F37-F64 AromaticContact CE1-CE2 3.77Å; F37-F64 HydrophobicContact CE1-CE2 3.77Å; F37-F64 AromaticContact CE1-CZ 3.42Å; F37-F64 HydrophobicContact CE1-CZ 3.42Å; F37-F64 VanDerWaalsContact CE1-CZ 3.42Å; F37-F64 AromaticContact CZ-CD1 3.66Å; F37-F64 HydrophobicContact CZ-CD1 3.66Å; F37-F64 HydrophobicContact CZ-CD2 4.03Å; F37-F64 AromaticContact CZ-CE1 3.47Å; F37-F64 HydrophobicContact CZ-CE1 3.47Å; F37-F64 VanDerWaalsContact CZ-CE1 3.47Å; F37-F64 AromaticContact CZ-CE2 3.86Å; F37-F64 HydrophobicContact CZ-CE2 3.86Å; F37-F64 AromaticContact CZ-CG 3.93Å; F37-F64 HydrophobicContact CZ-CG 3.93Å; F37-F64 AromaticContact CZ-CZ 3.58Å; F37-F64 HydrophobicContact CZ-CZ 3.58Å; V51-F64 HydrophobicContact CB-CZ 4.27Å; V51-F64 HydrophobicContact CG1-CZ 4.47Å; V51-F64 HydrophobicContact CG2-CE1 3.48Å; V51-F64 VanDerWaalsContact CG2-CE1 3.48Å; V51-F64 HydrophobicContact CG2-CZ 3.44Å; V51-F64 VanDerWaalsContact CG2-CZ 3.44Å; I62-F64 HydrophobicContact CB-CE2 4.21Å; I62-F64 HydrophobicContact CB-CZ 4.28Å; I62-F64 HydrophobicContact CG2-CD2 4.44Å; I62-F64 HydrophobicContact CG2-CE1 3.93Å; I62-F64 HydrophobicContact CG2-CE2 3.77Å; I62-F64 HydrophobicContact CG2-CZ 3.47Å; I62-F64 VanDerWaalsContact CG2-CZ 3.47Å; F64-F66 HydrophobicContact CB-CE1 4.24Å; F64-F66 HydrophobicContact CB-CE2 3.83Å; F64-F66 HydrophobicContact CB-CZ 3.54Å; F64-F66 HydrophobicContact CG-CZ 4.21Å
65S39.6Very low43.3Very low98 Ų98122.4 Ų122.469%0.68562%0.619SS**  trans-124.6118.9170.3-64.40000108.1
66F43.4Very low43.1Very low119 Ų119122.3 Ų122.352%0.52260%0.602SS.*PPolyproline II helixtrans-100.3119.4178.8-52.7-71.9000108.7F37 I39 F49 F64F37-F66 HydrophobicContact CE2-CE1 4.46Å; F37-F66 AromaticContact CE2-CZ 3.95Å; F37-F66 HydrophobicContact CE2-CZ 3.95Å; I39-F66 HydrophobicContact CD1-CD1 3.49Å; I39-F66 VanDerWaalsContact CD1-CD1 3.49Å; I39-F66 HydrophobicContact CD1-CD2 4.27Å; I39-F66 HydrophobicContact CD1-CE1 3.13Å; I39-F66 HydrophobicContact CD1-CE2 3.96Å; I39-F66 HydrophobicContact CD1-CG 4.06Å; I39-F66 HydrophobicContact CD1-CZ 3.38Å; I39-F66 HydrophobicContact CG1-CE1 4.45Å; I39-F66 HydrophobicContact CG1-CZ 4.4Å; F49-F66 HydrophobicContact CE2-CE1 4.23Å; F49-F66 HydrophobicContact CZ-CE1 4.22Å; F64-F66 HydrophobicContact CB-CE1 4.24Å; F64-F66 HydrophobicContact CB-CE2 3.83Å; F64-F66 HydrophobicContact CB-CZ 3.54Å; F64-F66 HydrophobicContact CG-CZ 4.21Å
67F34.5Very low43.1Very low195 Ų195128.4 Ų128.486%0.85562%0.624SS**PPolyproline II helixtrans-91.1125.4167.6-90.3-92.7000108.7
68R41.5Very low43Very low140 Ų140120 Ų12053%0.52860%0.603SS.*PPolyproline II helixtrans-88.7120.5165.7-76.9-170.7-75.8178.9-9.5107.9G19 F70G19-R68 PolarHBondContact O-NH2 3.01Å; R68-F70 PolarHBondContact O-N 2.93Å
69P33.2Very low42.8Very low129 Ų129120 Ų12084%0.83861%0.614SS**  trans-71.4112.7160.228.6-27.2000106.9
70F47Very low42.6Very low255 Ų255119.3 Ų119.3100%1.11859%0.594SS**  trans-85.90157.925.6-99.6000108.4R68R68-F70 PolarHBondContact O-N 2.93Å

Retrieved 70 of 70 residues in 54.5 ms (Link to these results)