A0A5K4F637_SCHMA Loading...

Secreted protein

AlphaFold DB , UniProt , Accession A0A5K4F637, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 72 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M38.4Very low41.9Very low218 Ų21877.5 Ų77.5100%1.07441%0.406SS*.  01190-65.7-177.8174.800107.4F3M1-F3 HydrophobicContact CB-CE2 4.2Å; M1-F3 HydrophobicContact CB-CZ 4.49Å
2Q35.5Very low41.6Very low151 Ų15189.5 Ų89.571%0.70644%0.442SS*.  trans-93.4134.9174.4-72.6177.23.300108.1
3F38.1Very low41.6Very low73 Ų7391.9 Ų91.932%0.3245%0.451SS..  trans-108.1132.9173.8-63.5-92.7000107.7M1 K22M1-F3 HydrophobicContact CB-CE2 4.2Å; M1-F3 HydrophobicContact CB-CZ 4.49Å; F3-K22 HydrophobicContact CD1-CG 4.19Å; F3-K22 HydrophobicContact CE1-CG 3.83Å
4V41.2Very low41.7Very low23 Ų2396.2 Ų96.214%0.13948%0.477CS..EExtended strand (participates in β ladder)trans-104.5122.3173.1171.40000107.2S21 L23V4-S21 PolarHBondContact O-N 2.76Å; V4-S21 VanDerWaalsContact O-O 3.09Å; V4-L23 HydrophobicContact CB-CB 4.05Å; V4-L23 HydrophobicContact CB-CD1 3.53Å; V4-L23 HydrophobicContact CB-CD2 4.01Å; V4-L23 HydrophobicContact CB-CG 4.02Å; V4-L23 HydrophobicContact CG1-CD1 3.97Å; V4-L23 HydrophobicContact CG1-CD2 4.32Å; V4-L23 HydrophobicContact CG2-CB 4.05Å; V4-L23 HydrophobicContact CG2-CD1 4.36Å; V4-L23 HydrophobicContact CG2-CD2 4Å; V4-L23 HydrophobicContact CG2-CG 4.32Å
5C43.6Very low41.5Very low6 Ų693.7 Ų93.74%0.04147%0.469CS..EExtended strand (participates in β ladder)trans-99.7128.9-178.7-53.60000108.7I18 L20 I64C5-I18 HydrophobicContact CB-CG2 3.93Å; C5-L20 HydrophobicContact CB-CD2 4.29Å; C5-L20 WeakPolarHBondContact SG-CD2 3Å; C5-I64 HydrophobicContact CB-CD1 4.1Å
6I46.3Very low41.5Very low35 Ų3588.3 Ų88.318%0.17944%0.442CS..EExtended strand (participates in β ladder)trans-97.2120.5164.3-66.4167000107.3I8 T19 C31 L59I6-I8 HydrophobicContact CG2-CG1 4.32Å; I6-T19 PolarHBondContact N-O 2.97Å; I6-T19 WeakPolarHBondContact O-CB 3.5Å; I6-T19 PolarHBondContact O-N 3.29Å; I6-C31 HydrophobicContact CD1-CB 3.36Å; I6-C31 WeakPolarHBondContact CD1-SG 3.45Å; I6-L59 HydrophobicContact CD1-CD2 4.37Å; I6-L59 HydrophobicContact CG1-CD2 4Å; I6-L59 HydrophobicContact CG2-CD2 4.32Å
7L46.2Very low41.7Very low31 Ų3186.1 Ų86.116%0.16243%0.431CS..EExtended strand (participates in β ladder)trans-89.3126.1174-116.7105.2000110L9 L16 I18 I49 L53L7-L9 HydrophobicContact CD2-CD1 4.4Å; L7-L16 HydrophobicContact CD2-CD1 3.56Å; L7-L16 HydrophobicContact CD2-CD2 3.9Å; L7-L16 HydrophobicContact CD2-CG 3.75Å; L7-I18 HydrophobicContact CD1-CD1 3.66Å; L7-I18 HydrophobicContact CD1-CG1 3.93Å; L7-I18 HydrophobicContact CG-CD1 4.29Å; L7-I18 HydrophobicContact CG-CG1 4.03Å; L7-I49 HydrophobicContact CD1-CG2 3.88Å; L7-I49 HydrophobicContact CD2-CG2 3.48Å; L7-I49 VanDerWaalsContact CD2-CG2 3.48Å; L7-I49 HydrophobicContact CG-CG2 4.32Å; L7-L53 HydrophobicContact CB-CD1 3.85Å; L7-L53 HydrophobicContact CD1-CD1 4.46Å; L7-L53 HydrophobicContact CD2-CD1 3.67Å; L7-L53 HydrophobicContact CG-CD1 4.2Å
8I45.6Very low42Very low88 Ų8881.3 Ų81.345%0.45141%0.408SS..EExtended strand (participates in β ladder)trans-115.2118167.2-56.8175.6000106.5I6 I17I6-I8 HydrophobicContact CG2-CG1 4.32Å; I8-I17 PolarHBondContact N-O 3.19Å; I8-I17 PolarHBondContact O-N 2.89Å; I8-I17 VanDerWaalsContact O-O 3.06Å
9L43Very low42.3Very low63 Ų6377.6 Ų77.633%0.3339%0.389SS..EExtended strand (participates in β ladder)trans-89111.2173.4-91133.5000108.5L7 S11 L16 A50 F54L7-L9 HydrophobicContact CD2-CD1 4.4Å; L9-S11 PolarHBondContact O-N 2.99Å; L9-L16 HydrophobicContact CD1-CD1 4.43Å; L9-L16 HydrophobicContact CD2-CD1 3.73Å; L9-L16 HydrophobicContact CG-CD1 3.9Å; L9-A50 HydrophobicContact CD1-CB 4.13Å; L9-A50 HydrophobicContact CD2-CB 4.12Å; L9-F54 HydrophobicContact CD1-CD2 4.38Å; L9-F54 HydrophobicContact CD1-CE2 3.7Å; L9-F54 HydrophobicContact CD1-CZ 4.37Å; L9-F54 HydrophobicContact CD2-CE2 4.23Å; L9-F54 HydrophobicContact CG-CE2 4.41Å
10D42.7Very low42.4Very low55 Ų5575.9 Ų75.929%0.29438%0.381SS..EExtended strand (participates in β ladder)trans-85.499.2163.5-174.758.2000107.9W12 H13 I17D10-W12 PolarHBondContact O-N 3.02Å; D10-W12 VanDerWaalsContact O-N 3.12Å; D10-H13 IonicContact OD2-CE1 3.87Å; D10-H13 IonicContact OD2-CG 3.65Å; D10-H13 PolarHBondContact OD2-N 2.84Å; D10-H13 IonicContact OD2-ND1 2.81Å; D10-H13 PolarHBondContact OD2-ND1 3.29Å; D10-I17 HydrophobicContact CB-CD1 4.46Å
11S40.3Very low42.5Very low110 Ų11072.4 Ų72.477%0.76936%0.364SS*.THydrogen-bonded Turntrans-65.3-8.8177.953.40000112.9L9L9-S11 PolarHBondContact O-N 2.99Å
12W38.2Very low42.4Very low221 Ų22170.7 Ų70.784%0.83735%0.351SS*.THydrogen-bonded Turntrans-82.2-24.7-175.6-150.79.3000113.5D10D10-W12 PolarHBondContact O-N 3.02Å; D10-W12 VanDerWaalsContact O-N 3.12Å
13H41.6Very low42.6Very low121 Ų12164.9 Ų64.956%0.5632%0.324SS*.THydrogen-bonded Turntrans-121.612.6-175.8-65.288.7000115D10 T15D10-H13 IonicContact OD2-CE1 3.87Å; D10-H13 IonicContact OD2-CG 3.65Å; D10-H13 PolarHBondContact OD2-N 2.84Å; D10-H13 IonicContact OD2-ND1 2.81Å; D10-H13 PolarHBondContact OD2-ND1 3.29Å; H13-T15 WeakPolarHBondContact CB-OG1 3.47Å; H13-T15 PolarHBondContact O-N 2.85Å; H13-T15 PolarHBondContact O-OG1 2.96Å
14N43.4Very low42.5Very low152 Ų15267.6 Ų67.681%0.81334%0.342SS*.THydrogen-bonded Turntrans47.530.3-168.2-90.1-13.7000112.1
15T38.1Very low42.2Very low58 Ų5872 Ų7236%0.35637%0.371SS..EExtended strand (participates in β ladder)trans-112.3120.8-171.7-580000108.7H13 I17H13-T15 WeakPolarHBondContact CB-OG1 3.47Å; H13-T15 PolarHBondContact O-N 2.85Å; H13-T15 PolarHBondContact O-OG1 2.96Å; T15-I17 HydrophobicContact CG2-CG1 4.4Å
16L42.7Very low41.5Very low7 Ų778 Ų784%0.03741%0.412CS..EExtended strand (participates in β ladder)trans-81.1118.4172.9-156.588.4000108.4L7 L9 I18 I39 F41 A46L7-L16 HydrophobicContact CD2-CD1 3.56Å; L7-L16 HydrophobicContact CD2-CD2 3.9Å; L7-L16 HydrophobicContact CD2-CG 3.75Å; L9-L16 HydrophobicContact CD1-CD1 4.43Å; L9-L16 HydrophobicContact CD2-CD1 3.73Å; L9-L16 HydrophobicContact CG-CD1 3.9Å; L16-I18 HydrophobicContact CD2-CD1 3.94Å; L16-I18 HydrophobicContact CD2-CG1 3.86Å; L16-I18 HydrophobicContact CG-CG1 4.42Å; L16-I39 VanDerWaalsContact O-O 3.08Å; L16-F41 HydrophobicContact CB-CD2 4.46Å; L16-F41 HydrophobicContact CD2-CB 4.34Å; L16-F41 HydrophobicContact CD2-CD2 3.3Å; L16-F41 HydrophobicContact CD2-CE2 3.87Å; L16-F41 HydrophobicContact CD2-CG 3.97Å; L16-F41 HydrophobicContact CG-CD2 4.48Å; L16-A46 HydrophobicContact CB-CB 4.39Å; L16-A46 HydrophobicContact CD1-CB 4.2Å
17I45Very low40.7Very low52 Ų5279 Ų7927%0.26742%0.422SS..EExtended strand (participates in β ladder)trans-104.1108.4173.4-56177.5000107.9I8 D10 T15I8-I17 PolarHBondContact N-O 3.19Å; I8-I17 PolarHBondContact O-N 2.89Å; I8-I17 VanDerWaalsContact O-O 3.06Å; D10-I17 HydrophobicContact CB-CD1 4.46Å; T15-I17 HydrophobicContact CG2-CG1 4.4Å
18I46.8Very low40.3Very low0 Ų087 Ų870%046%0.456CS..EExtended strand (participates in β ladder)trans-93.1111.1173.7-58-155.3000109.8C5 L7 L16 L20 I39 F41 I64C5-I18 HydrophobicContact CB-CG2 3.93Å; L7-I18 HydrophobicContact CD1-CD1 3.66Å; L7-I18 HydrophobicContact CD1-CG1 3.93Å; L7-I18 HydrophobicContact CG-CD1 4.29Å; L7-I18 HydrophobicContact CG-CG1 4.03Å; L16-I18 HydrophobicContact CD2-CD1 3.94Å; L16-I18 HydrophobicContact CD2-CG1 3.86Å; L16-I18 HydrophobicContact CG-CG1 4.42Å; I18-L20 HydrophobicContact CG2-CD2 3.99Å; I18-L20 HydrophobicContact CG2-CG 4.33Å; I18-L20 PolarHBondContact O-N 3.49Å; I18-I39 HydrophobicContact CB-CB 4.38Å; I18-I39 HydrophobicContact CB-CD1 4.27Å; I18-I39 HydrophobicContact CG2-CD1 4.41Å; I18-F41 HydrophobicContact CB-CE2 4.44Å; I18-F41 HydrophobicContact CD1-CD2 3.94Å; I18-F41 HydrophobicContact CD1-CE1 4.45Å; I18-F41 HydrophobicContact CD1-CE2 2.97Å; I18-F41 HydrophobicContact CD1-CZ 3.28Å; I18-F41 HydrophobicContact CG1-CD2 4.26Å; I18-F41 HydrophobicContact CG1-CE2 3.49Å; I18-F41 VanDerWaalsContact CG1-CE2 3.49Å; I18-F41 HydrophobicContact CG1-CZ 4.25Å; I18-I64 HydrophobicContact CD1-CD1 3.96Å
19T46.5Very low39.8Very low10 Ų1092.5 Ų92.56%0.06147%0.472CS..EExtended strand (participates in β ladder)trans-83.4107169.8-55.40000108.9I6 S21 A34 H36I6-T19 PolarHBondContact N-O 2.97Å; I6-T19 WeakPolarHBondContact O-CB 3.5Å; I6-T19 PolarHBondContact O-N 3.29Å; T19-S21 PolarHBondContact O-N 3.41Å; T19-A34 HydrophobicContact CG2-CB 4.22Å; T19-H36 PolarHBondContact OG1-ND1 2.84Å
20L44.8Very low39.4Very low43 Ų4392.9 Ų92.923%0.22548%0.48CS..EExtended strand (participates in β ladder)trans-81101.1171.3-66.9-179.9000109.4C5 I18 I39 L69C5-L20 HydrophobicContact CB-CD2 4.29Å; C5-L20 WeakPolarHBondContact SG-CD2 3Å; I18-L20 HydrophobicContact CG2-CD2 3.99Å; I18-L20 HydrophobicContact CG2-CG 4.33Å; I18-L20 PolarHBondContact O-N 3.49Å; L20-I39 HydrophobicContact CD1-CD1 3.69Å; L20-I39 HydrophobicContact CD2-CD1 4.42Å; L20-I39 HydrophobicContact CG-CD1 3.95Å; L20-L69 HydrophobicContact CD1-CD2 4.22Å; L20-L69 HydrophobicContact CD2-CD2 4.12Å
21S43.7Very low39.1Very low4 Ų492.7 Ų92.73%0.02848%0.482CS..EExtended strand (participates in β ladder)trans-89125.1166.2-65.50000108.6V4 T19 L23 A34V4-S21 PolarHBondContact O-N 2.76Å; V4-S21 VanDerWaalsContact O-O 3.09Å; T19-S21 PolarHBondContact O-N 3.41Å; S21-L23 PolarHBondContact O-N 3.43Å; S21-A34 WeakPolarHBondContact OG-CB 3.25Å
22K37.9Very low38.8Very low182 Ų18297.3 Ų97.379%0.79149%0.489SS*.  trans-63.893.1159.4-83-178-179.8179.20106.5F3 D24F3-K22 HydrophobicContact CD1-CG 4.19Å; F3-K22 HydrophobicContact CE1-CG 3.83Å; K22-D24 PolarHBondContact O-N 3.36Å
23L39.8Very low38.7Very low28 Ų2890.6 Ų90.615%0.14749%0.488CS..  trans-79104.7164.2-93.286.5000106.7V4 S21V4-L23 HydrophobicContact CB-CB 4.05Å; V4-L23 HydrophobicContact CB-CD1 3.53Å; V4-L23 HydrophobicContact CB-CD2 4.01Å; V4-L23 HydrophobicContact CB-CG 4.02Å; V4-L23 HydrophobicContact CG1-CD1 3.97Å; V4-L23 HydrophobicContact CG1-CD2 4.32Å; V4-L23 HydrophobicContact CG2-CB 4.05Å; V4-L23 HydrophobicContact CG2-CD1 4.36Å; V4-L23 HydrophobicContact CG2-CD2 4Å; V4-L23 HydrophobicContact CG2-CG 4.32Å; S21-L23 PolarHBondContact O-N 3.43Å
24D35.3Very low38.6Very low131 Ų13185.8 Ų85.870%0.70147%0.469SS*.  trans-45.5141.4149.5-111.6-89.1000108.4K22 C26K22-D24 PolarHBondContact O-N 3.36Å; D24-C26 PolarHBondContact O-N 3.35Å
25P35Very low38.4Very low115 Ų11583.3 Ų83.375%0.74746%0.461SS*.SBendtrans-57.1116.8-178.123.9-32000109.5
26C28.4Very low38.6Very low132 Ų13287.2 Ų87.289%0.89248%0.475SS*.  trans70.278167.1-68.20000118D24D24-C26 PolarHBondContact O-N 3.35Å
27S29.9Very low38.4Very low56 Ų5694.7 Ų94.739%0.39250%0.503SS..  trans-140.3115.6138.740.90000110Y29 S30S27-Y29 PolarHBondContact O-N 3.17Å; S27-S30 PolarHBondContact O-N 3.05Å; S27-S30 PolarHBondContact OG-OG 3Å
28K37Very low38.3Very low200 Ų20095.8 Ų95.887%0.8752%0.52SS*.THydrogen-bonded Turntrans-57.88.3-177.6-132.2177.8-176.8-179.40115
29Y36.7Very low38.1Very low203 Ų20396.7 Ų96.780%0.79653%0.525SS*.THydrogen-bonded Turntrans-140.53.1-162.3-69.6-77.6000115.3S27S27-Y29 PolarHBondContact O-N 3.17Å
30S33.1Very low37.8Very low71 Ų71104.8 Ų104.850%0.49756%0.562SS.*  trans-100.524.3-166.4-56.60000115.9S27 F32S27-S30 PolarHBondContact O-N 3.05Å; S27-S30 PolarHBondContact OG-OG 3Å; S30-F32 VanDerWaalsContact C-N 3.35Å; S30-F32 PolarHBondContact O-N 2.8Å
31C36.2Very low37.9Very low51 Ų51103.6 Ų103.635%0.34556%0.555SS.*  trans-91.318.8-176.4-68.70000115.5I6I6-C31 HydrophobicContact CD1-CB 3.36Å; I6-C31 WeakPolarHBondContact CD1-SG 3.45Å
32F34.3Very low37.9Very low207 Ų207108 Ų10891%0.90858%0.583SS**SBendtrans-106.697.7172.3-81.7-92.3000109.2S30S30-F32 VanDerWaalsContact C-N 3.35Å; S30-F32 PolarHBondContact O-N 2.8Å
33G36.3Very low38.3Very low79 Ų79104.8 Ų104.881%0.81458%0.575SS**SBendtrans1355.7171.400000117.4
34A39.7Very low38.6Very low20 Ų20110.2 Ų110.217%0.16560%0.604CS.*  trans-75.2140.5175.700000111.8T19 S21 H36T19-A34 HydrophobicContact CG2-CB 4.22Å; S21-A34 WeakPolarHBondContact OG-CB 3.25Å; A34-H36 PolarHBondContact O-N 2.96Å; A34-H36 VanDerWaalsContact O-N 3.17Å
35P39.4Very low39.2Very low100 Ų100107 Ų10765%0.64958%0.584SS**  trans-61.4119.8175.624.8-32.4000109.9R37P35-R37 PolarHBondContact O-N 3.3Å
36H42.7Very low39.5Very low141 Ų141102.4 Ų102.465%0.65356%0.556SS**  trans-62.3107.3172-61.9-79.6000109T19 A34T19-H36 PolarHBondContact OG1-ND1 2.84Å; A34-H36 PolarHBondContact O-N 2.96Å; A34-H36 VanDerWaalsContact O-N 3.17Å
37R38.4Very low40.1Very low163 Ų163100.3 Ų100.362%0.61554%0.539SS*.  trans-103.8108.3165.1-78.1-169.7171-160.8-2107.9P35 I39P35-R37 PolarHBondContact O-N 3.3Å; R37-I39 PolarHBondContact O-N 2.86Å; R37-I39 VanDerWaalsContact O-N 3.12Å
38A42Very low40.8Very low75 Ų75101.5 Ų101.562%0.6254%0.544SS*.  trans-64.3114.9169.400000108.6
39I43.9Very low41.3Very low20 Ų2092.7 Ų92.710%0.10351%0.506CS..  trans-101.8112.7171.7-57.9175.2000106.5L16 I18 L20 R37 F41 L69 P70L16-I39 VanDerWaalsContact O-O 3.08Å; I18-I39 HydrophobicContact CB-CB 4.38Å; I18-I39 HydrophobicContact CB-CD1 4.27Å; I18-I39 HydrophobicContact CG2-CD1 4.41Å; L20-I39 HydrophobicContact CD1-CD1 3.69Å; L20-I39 HydrophobicContact CD2-CD1 4.42Å; L20-I39 HydrophobicContact CG-CD1 3.95Å; R37-I39 PolarHBondContact O-N 2.86Å; R37-I39 VanDerWaalsContact O-N 3.12Å; I39-F41 HydrophobicContact CB-CD2 4.48Å; I39-F41 HydrophobicContact CB-CE2 3.74Å; I39-F41 HydrophobicContact CB-CZ 4.36Å; I39-F41 HydrophobicContact CG2-CD2 4.1Å; I39-F41 HydrophobicContact CG2-CE2 3.4Å; I39-F41 VanDerWaalsContact CG2-CE2 3.4Å; I39-F41 HydrophobicContact CG2-CZ 3.69Å; I39-F41 VanDerWaalsContact O-CD2 3.31Å; I39-F41 WeakPolarHBondContact O-CD2 3.25Å; I39-F41 PolarHBondContact O-N 3.26Å; I39-L69 HydrophobicContact CD1-CD2 4Å; I39-P70 HydrophobicContact CG2-CG 3.94Å
40Q40.3Very low41.5Very low179 Ų17983.6 Ų83.684%0.83647%0.473SS*.PPolyproline II helixtrans-76.3117175.1-167172.80.900109
41F45.9Very low41.8Very low19 Ų1984.3 Ų84.38%0.08348%0.477CS..PPolyproline II helixtrans-92.6146.2171.4-73.1-91.1000110L16 I18 I39 N43 F45 A46L16-F41 HydrophobicContact CB-CD2 4.46Å; L16-F41 HydrophobicContact CD2-CB 4.34Å; L16-F41 HydrophobicContact CD2-CD2 3.3Å; L16-F41 HydrophobicContact CD2-CE2 3.87Å; L16-F41 HydrophobicContact CD2-CG 3.97Å; L16-F41 HydrophobicContact CG-CD2 4.48Å; I18-F41 HydrophobicContact CB-CE2 4.44Å; I18-F41 HydrophobicContact CD1-CD2 3.94Å; I18-F41 HydrophobicContact CD1-CE1 4.45Å; I18-F41 HydrophobicContact CD1-CE2 2.97Å; I18-F41 HydrophobicContact CD1-CZ 3.28Å; I18-F41 HydrophobicContact CG1-CD2 4.26Å; I18-F41 HydrophobicContact CG1-CE2 3.49Å; I18-F41 VanDerWaalsContact CG1-CE2 3.49Å; I18-F41 HydrophobicContact CG1-CZ 4.25Å; I39-F41 HydrophobicContact CB-CD2 4.48Å; I39-F41 HydrophobicContact CB-CE2 3.74Å; I39-F41 HydrophobicContact CB-CZ 4.36Å; I39-F41 HydrophobicContact CG2-CD2 4.1Å; I39-F41 HydrophobicContact CG2-CE2 3.4Å; I39-F41 VanDerWaalsContact CG2-CE2 3.4Å; I39-F41 HydrophobicContact CG2-CZ 3.69Å; I39-F41 VanDerWaalsContact O-CD2 3.31Å; I39-F41 WeakPolarHBondContact O-CD2 3.25Å; I39-F41 PolarHBondContact O-N 3.26Å; F41-N43 PolarHBondContact O-N 3.12Å; F41-F45 HydrophobicContact CB-CB 4.36Å; F41-F45 HydrophobicContact CB-CD1 4.47Å; F41-F45 HydrophobicContact CD1-CB 4.4Å; F41-F45 AromaticContact CD1-CD1 3.27Å; F41-F45 HydrophobicContact CD1-CD1 3.27Å; F41-F45 AromaticContact CD1-CE1 3.84Å; F41-F45 HydrophobicContact CD1-CE1 3.84Å; F41-F45 HydrophobicContact CD1-CG 4.15Å; F41-F45 AromaticContact CE1-CD1 3.76Å; F41-F45 HydrophobicContact CE1-CD1 3.76Å; F41-F45 AromaticContact CE1-CE1 3.81Å; F41-F45 HydrophobicContact CE1-CE1 3.81Å; F41-F45 HydrophobicContact CG-CD1 4.05Å; F41-A46 HydrophobicContact CB-CB 4.44Å
42P43.6Very low42.1Very low96 Ų9687.3 Ų87.362%0.62349%0.489SS*.PPolyproline II helixtrans-57.7135.9166.322.8-29.4000109.3N44 F45 A46P42-N44 PolarHBondContact O-N 3.13Å; P42-F45 HydrophobicContact CG-CB 4.4Å; P42-F45 PolarHBondContact O-N 3.03Å; P42-A46 PolarHBondContact O-N 3.35Å
43N46.2Very low42.7Very low115 Ų11578.9 Ų78.962%0.61545%0.453SS*.Hα-helixtrans-44.4-36.3-169.7-79.8-8.5000114.6F41 F45 A46 T47F41-N43 PolarHBondContact O-N 3.12Å; N43-F45 VanDerWaalsContact C-N 3.29Å; N43-F45 PolarHBondContact O-N 3.38Å; N43-A46 PolarHBondContact O-N 3.11Å; N43-T47 PolarHBondContact O-N 3.45Å; N43-T47 PolarHBondContact O-OG1 3.32Å
44N47Very low42.8Very low141 Ų14182.4 Ų82.475%0.75445%0.447SS*.Hα-helixtrans-65.6-31.9-179.2-64.2-10.1000113.1P42 V48P42-N44 PolarHBondContact O-N 3.13Å; N44-V48 WeakPolarHBondContact O-CG2 3.49Å
45F47.6Very low42.7Very low64 Ų6484.6 Ų84.628%0.28147%0.471SS..Hα-helixtrans-83.7-34.3-178.7-158.5-97.6000111.8F41 P42 N43 T47 V48 I49 L68F41-F45 HydrophobicContact CB-CB 4.36Å; F41-F45 HydrophobicContact CB-CD1 4.47Å; F41-F45 HydrophobicContact CD1-CB 4.4Å; F41-F45 AromaticContact CD1-CD1 3.27Å; F41-F45 HydrophobicContact CD1-CD1 3.27Å; F41-F45 AromaticContact CD1-CE1 3.84Å; F41-F45 HydrophobicContact CD1-CE1 3.84Å; F41-F45 HydrophobicContact CD1-CG 4.15Å; F41-F45 AromaticContact CE1-CD1 3.76Å; F41-F45 HydrophobicContact CE1-CD1 3.76Å; F41-F45 AromaticContact CE1-CE1 3.81Å; F41-F45 HydrophobicContact CE1-CE1 3.81Å; F41-F45 HydrophobicContact CG-CD1 4.05Å; P42-F45 HydrophobicContact CG-CB 4.4Å; P42-F45 PolarHBondContact O-N 3.03Å; N43-F45 VanDerWaalsContact C-N 3.29Å; N43-F45 PolarHBondContact O-N 3.38Å; F45-T47 VanDerWaalsContact C-N 3.31Å; F45-T47 PolarHBondContact O-N 3.45Å; F45-V48 PolarHBondContact O-N 3.45Å; F45-I49 HydrophobicContact CD1-CD1 3.73Å; F45-I49 HydrophobicContact CD1-CG1 4.23Å; F45-I49 HydrophobicContact CE1-CD1 3.27Å; F45-I49 HydrophobicContact CE1-CG1 4.01Å; F45-I49 HydrophobicContact CZ-CD1 4.06Å; F45-I49 PolarHBondContact O-N 3.45Å; F45-I49 VanDerWaalsContact O-N 3.11Å; F45-L68 HydrophobicContact CE2-CD1 4.39Å; F45-L68 HydrophobicContact CE2-CD2 4.5Å; F45-L68 HydrophobicContact CZ-CD1 3.84Å; F45-L68 HydrophobicContact CZ-CD2 4.49Å
46A41.7Very low42.5Very low19 Ų1988 Ų8816%0.15747%0.47CS..Hα-helixtrans-60.5-40.7173.300000111.5L16 F41 P42 N43 A50L16-A46 HydrophobicContact CB-CB 4.39Å; L16-A46 HydrophobicContact CD1-CB 4.2Å; F41-A46 HydrophobicContact CB-CB 4.44Å; P42-A46 PolarHBondContact O-N 3.35Å; N43-A46 PolarHBondContact O-N 3.11Å; A46-A50 WeakPolarHBondContact O-CB 3.38Å; A46-A50 PolarHBondContact O-N 3.36Å
47T40.1Very low42.2Very low87 Ų8789.1 Ų89.153%0.53449%0.487SS..Hα-helixtrans-65.7-41.6177.6-51.10000112.6N43 F45 A50 S51N43-T47 PolarHBondContact O-N 3.45Å; N43-T47 PolarHBondContact O-OG1 3.32Å; F45-T47 VanDerWaalsContact C-N 3.31Å; F45-T47 PolarHBondContact O-N 3.45Å; T47-A50 PolarHBondContact O-N 2.9Å; T47-S51 WeakPolarHBondContact O-CB 3.49Å; T47-S51 PolarHBondContact O-N 2.87Å; T47-S51 PolarHBondContact O-OG 3.4Å
48V43.8Very low42.3Very low82 Ų8283.9 Ų83.950%0.49748%0.479SS..Hα-helixtrans-65.9-45.4179.3174.10000111N44 F45 S51 I52N44-V48 WeakPolarHBondContact O-CG2 3.49Å; F45-V48 PolarHBondContact O-N 3.45Å; V48-S51 PolarHBondContact O-N 3.07Å; V48-I52 HydrophobicContact CG1-CD1 3.95Å; V48-I52 WeakPolarHBondContact O-CD1 3.4Å; V48-I52 VanDerWaalsContact O-CG1 3.25Å; V48-I52 WeakPolarHBondContact O-CG1 3.31Å; V48-I52 PolarHBondContact O-N 2.84Å; V48-I52 VanDerWaalsContact O-N 3.07Å
49I48.6Very low42.3Very low14 Ų1487 Ų877%0.07249%0.485CS..Hα-helixtrans-67.5-41.1177.8-68.2-169.7000111L7 F45 I52 L53L7-I49 HydrophobicContact CD1-CG2 3.88Å; L7-I49 HydrophobicContact CD2-CG2 3.48Å; L7-I49 VanDerWaalsContact CD2-CG2 3.48Å; L7-I49 HydrophobicContact CG-CG2 4.32Å; F45-I49 HydrophobicContact CD1-CD1 3.73Å; F45-I49 HydrophobicContact CD1-CG1 4.23Å; F45-I49 HydrophobicContact CE1-CD1 3.27Å; F45-I49 HydrophobicContact CE1-CG1 4.01Å; F45-I49 HydrophobicContact CZ-CD1 4.06Å; F45-I49 PolarHBondContact O-N 3.45Å; F45-I49 VanDerWaalsContact O-N 3.11Å; I49-I52 PolarHBondContact O-N 3.15Å; I49-L53 HydrophobicContact CG2-CD1 3.71Å; I49-L53 WeakPolarHBondContact O-CD1 3.19Å; I49-L53 WeakPolarHBondContact O-CG 3.45Å; I49-L53 PolarHBondContact O-N 2.83Å; I49-L53 VanDerWaalsContact O-N 3.13Å
50A41.8Very low42.2Very low13 Ų1390 Ų9011%0.10750%0.498CS..Hα-helixtrans-59.2-48.317400000110.9L9 A46 T47 I52 L53 F54L9-A50 HydrophobicContact CD1-CB 4.13Å; L9-A50 HydrophobicContact CD2-CB 4.12Å; A46-A50 WeakPolarHBondContact O-CB 3.38Å; A46-A50 PolarHBondContact O-N 3.36Å; T47-A50 PolarHBondContact O-N 2.9Å; A50-I52 VanDerWaalsContact C-N 3.3Å; A50-I52 PolarHBondContact O-N 3.29Å; A50-L53 CarbonylContact O-C 3.58Å; A50-L53 PolarHBondContact O-N 3.22Å; A50-F54 HydrophobicContact CB-CD2 3.9Å; A50-F54 HydrophobicContact CB-CE2 4.02Å; A50-F54 WeakPolarHBondContact O-CB 3.33Å; A50-F54 WeakPolarHBondContact O-CD2 3.39Å; A50-F54 PolarHBondContact O-N 3.01Å
51S38.2Very low42.4Very low85 Ų8588 Ų8859%0.59449%0.489SS*.Hα-helixtrans-62.6-33178.6-69.80000113.8T47 V48 L53T47-S51 WeakPolarHBondContact O-CB 3.49Å; T47-S51 PolarHBondContact O-N 2.87Å; T47-S51 PolarHBondContact O-OG 3.4Å; V48-S51 PolarHBondContact O-N 3.07Å; S51-L53 VanDerWaalsContact C-N 3.3Å
52I43.3Very low42.4Very low114 Ų11488.9 Ų88.959%0.58550%0.495SS*.Hα-helixtrans-68.2-32.4174.3-68.1164.8000111.2V48 I49 A50V48-I52 HydrophobicContact CG1-CD1 3.95Å; V48-I52 WeakPolarHBondContact O-CD1 3.4Å; V48-I52 VanDerWaalsContact O-CG1 3.25Å; V48-I52 WeakPolarHBondContact O-CG1 3.31Å; V48-I52 PolarHBondContact O-N 2.84Å; V48-I52 VanDerWaalsContact O-N 3.07Å; I49-I52 PolarHBondContact O-N 3.15Å; A50-I52 VanDerWaalsContact C-N 3.3Å; A50-I52 PolarHBondContact O-N 3.29Å
53L45.6Very low42.5Very low31 Ų3190.8 Ų90.816%0.16250%0.496CS..Hα-helixtrans-89.5-36-177.5-68.6166.9000113.3L7 I49 A50 S51 G55 R56 H60 V62L7-L53 HydrophobicContact CB-CD1 3.85Å; L7-L53 HydrophobicContact CD1-CD1 4.46Å; L7-L53 HydrophobicContact CD2-CD1 3.67Å; L7-L53 HydrophobicContact CG-CD1 4.2Å; I49-L53 HydrophobicContact CG2-CD1 3.71Å; I49-L53 WeakPolarHBondContact O-CD1 3.19Å; I49-L53 WeakPolarHBondContact O-CG 3.45Å; I49-L53 PolarHBondContact O-N 2.83Å; I49-L53 VanDerWaalsContact O-N 3.13Å; A50-L53 CarbonylContact O-C 3.58Å; A50-L53 PolarHBondContact O-N 3.22Å; S51-L53 VanDerWaalsContact C-N 3.3Å; L53-G55 PolarHBondContact O-N 3.17Å; L53-R56 PolarHBondContact O-N 3.32Å; L53-R56 VanDerWaalsContact O-O 3.05Å; L53-H60 HydrophobicContact CD2-CB 4.13Å; L53-V62 HydrophobicContact CD2-CG2 4.23Å
54F40.1Very low42.6Very low153 Ų15386.2 Ų86.267%0.67147%0.471SS*.Hα-helixtrans-70.7-13.7-175.8-89.6-76000114.1L9 A50 R56L9-F54 HydrophobicContact CD1-CD2 4.38Å; L9-F54 HydrophobicContact CD1-CE2 3.7Å; L9-F54 HydrophobicContact CD1-CZ 4.37Å; L9-F54 HydrophobicContact CD2-CE2 4.23Å; L9-F54 HydrophobicContact CG-CE2 4.41Å; A50-F54 HydrophobicContact CB-CD2 3.9Å; A50-F54 HydrophobicContact CB-CE2 4.02Å; A50-F54 WeakPolarHBondContact O-CB 3.33Å; A50-F54 WeakPolarHBondContact O-CD2 3.39Å; A50-F54 PolarHBondContact O-N 3.01Å; F54-R56 VanDerWaalsContact C-N 3.34Å
55G36.2Very low42.5Very low65 Ų6582.3 Ų82.367%0.6745%0.453SS*.THydrogen-bonded Turntrans-79.8-10.6173.800000114.8L53L53-G55 PolarHBondContact O-N 3.17Å
56R35.3Very low42.5Very low171 Ų17187.6 Ų87.665%0.64547%0.471SS*.  trans-145.6118.2-174.6-65.9-169.9170.7-170.4-1.6111L53 F54 A58 H60L53-R56 PolarHBondContact O-N 3.32Å; L53-R56 VanDerWaalsContact O-O 3.05Å; F54-R56 VanDerWaalsContact C-N 3.34Å; R56-A58 PolarHBondContact O-N 2.77Å; R56-H60 WeakPolarHBondContact CD-NE2 3.12Å
57T36.9Very low42.6Very low165 Ų16595.5 Ų95.5100%1.01251%0.505SS*.SBendtrans-60.915.5170.821.80000114.9
58A39.6Very low42.7Very low53 Ų5395.1 Ų95.144%0.43850%0.499SS..SBendtrans-108.5131-179.700000109.8R56 H60R56-A58 PolarHBondContact O-N 2.77Å; A58-H60 PolarHBondContact O-CD2 3.42Å; A58-H60 VanDerWaalsContact O-CD2 3.26Å; A58-H60 PolarHBondContact O-N 3.22Å
59L43.5Very low42.9Very low142 Ų14292.7 Ų92.774%0.74348%0.484SS*.  trans-49.1102.9161.7-105.5121.2000108.7I6I6-L59 HydrophobicContact CD1-CD2 4.37Å; I6-L59 HydrophobicContact CG1-CD2 4Å; I6-L59 HydrophobicContact CG2-CD2 4.32Å
60H41.4Very low42.6Very low81 Ų8196.3 Ų96.338%0.37551%0.508SS..  trans-88.4124.7171.3-88.7-95.8000108.2L53 R56 A58 V62L53-H60 HydrophobicContact CD2-CB 4.13Å; R56-H60 WeakPolarHBondContact CD-NE2 3.12Å; A58-H60 PolarHBondContact O-CD2 3.42Å; A58-H60 VanDerWaalsContact O-CD2 3.26Å; A58-H60 PolarHBondContact O-N 3.22Å; H60-V62 PolarHBondContact O-N 3.24Å
61H45.1Very low42.2Very low139 Ų139102.3 Ų102.364%0.64454%0.538SS*.  trans-60.9105.7162.6-86.2-127.1000107.6
62V46Very low42.1Very low37 Ų37106.2 Ų106.222%0.22456%0.564CS.*BIsolated β-bridgetrans-91.8117.2172.2-175.70000107.6L53 H60 I64L53-V62 HydrophobicContact CD2-CG2 4.23Å; H60-V62 PolarHBondContact O-N 3.24Å; V62-I64 HydrophobicContact CG1-CG1 3.96Å; V62-I64 PolarHBondContact O-N 3.04Å
63H44.9Very low42Very low136 Ų136105.8 Ų105.863%0.6356%0.563SS**  trans-82.5103.5170.9-168.7-129.5000108.2P65H63-P65 WeakPolarHBondContact O-CD 3.41Å
64I49.2Very low41.9Very low18 Ų18109.7 Ų109.79%0.09259%0.585CS.*  trans-90.4116.6176.1-54.8-178.6000107.8C5 I18 V62 L68 L69C5-I64 HydrophobicContact CB-CD1 4.1Å; I18-I64 HydrophobicContact CD1-CD1 3.96Å; V62-I64 HydrophobicContact CG1-CG1 3.96Å; V62-I64 PolarHBondContact O-N 3.04Å; I64-L68 HydrophobicContact CG2-CB 4.06Å; I64-L69 HydrophobicContact CG2-CG 4.33Å
65P43.9Very low42Very low59 Ų59107.3 Ų107.338%0.38358%0.58SS.*  trans-62.3139.2173.624-31.1000110.1H63 E67 L68H63-P65 WeakPolarHBondContact O-CD 3.41Å; P65-E67 PolarHBondContact O-N 3.4Å; P65-L68 HydrophobicContact CG-CD1 3.56Å; P65-L68 HydrophobicContact CG-CG 4.09Å; P65-L68 PolarHBondContact O-N 3.12Å
66R47.2Very low42.3Very low175 Ų175109.8 Ų109.866%0.6657%0.574SS**G310 helixtrans-57.1-24.8-173.9-171176.3-179.4-178.5-1.1113.5L68 L69R66-L68 PolarHBondContact O-N 2.84Å; R66-L69 PolarHBondContact O-N 2.97Å
67E44.8Very low42.7Very low185 Ų185106 Ų10686%0.86457%0.57SS**G310 helixtrans-63.8-22.3177.1-58.6178147.100113.3P65P65-E67 PolarHBondContact O-N 3.4Å
68L42.3Very low43.1Very low80 Ų80102.1 Ų102.142%0.41954%0.541SS..G310 helixtrans-94.8-8.9178.5-64.6172.1000113.1F45 I64 P65 R66F45-L68 HydrophobicContact CE2-CD1 4.39Å; F45-L68 HydrophobicContact CE2-CD2 4.5Å; F45-L68 HydrophobicContact CZ-CD1 3.84Å; F45-L68 HydrophobicContact CZ-CD2 4.49Å; I64-L68 HydrophobicContact CG2-CB 4.06Å; P65-L68 HydrophobicContact CG-CD1 3.56Å; P65-L68 HydrophobicContact CG-CG 4.09Å; P65-L68 PolarHBondContact O-N 3.12Å; R66-L68 PolarHBondContact O-N 2.84Å
69L46.4Very low43.4Very low31 Ų31105.6 Ų105.616%0.16255%0.548CS..SBendtrans-83.5124.9174.2-70.9166.6000107.8L20 I39 I64 R66 L71L20-L69 HydrophobicContact CD1-CD2 4.22Å; L20-L69 HydrophobicContact CD2-CD2 4.12Å; I39-L69 HydrophobicContact CD1-CD2 4Å; I64-L69 HydrophobicContact CG2-CG 4.33Å; R66-L69 PolarHBondContact O-N 2.97Å; L69-L71 PolarHBondContact O-N 2.81Å
70P42.1Very low43.4Very low90 Ų90102.8 Ų102.858%0.58453%0.533SS*.  trans-61.4106.7170.424.9-30.5000107.6I39 S72I39-P70 HydrophobicContact CG2-CG 3.94Å; P70-S72 PolarHBondContact O-N 3.42Å
71L34.5Very low43.5Very low139 Ų139104.6 Ų104.673%0.72855%0.546SS*.  trans-66.596.6172.4-81153.5000107.6L69L69-L71 PolarHBondContact O-N 2.81Å
72S36Very low43.4Very low166 Ų166101.5 Ų101.5100%1.16154%0.537SS*.  trans-136.50161.3-171.50000108.9P70P70-S72 PolarHBondContact O-N 3.42Å

Retrieved 72 of 72 residues in 68.8 ms (Link to these results)