A0A077Z4X2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z4X2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 100 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M59.4Low72.9Confident172 Ų17274.2 Ų74.285%0.84739%0.394SS*.  0117.70-171154.5171.700105.2I6 E9M1-I6 HydrophobicContact CB-CD1 4.33Å; M1-I6 HydrophobicContact CE-CG1 4.03Å; M1-I6 HydrophobicContact CG-CD1 4.04Å; M1-I6 HydrophobicContact CG-CG1 3.77Å; M1-I6 HydrophobicContact SD-CG1 4.36Å; M1-E9 WeakPolarHBondContact CE-OE2 3.18Å
2D70.5Confident72.9Confident108 Ų10870.7 Ų70.758%0.57839%0.388SS*.  trans-66.1136-171.9-55-45.4000110.4V4 N5 I6D2-V4 PolarHBondContact O-N 3.39Å; D2-N5 HydrophobicContact CB-CB 4.17Å; D2-N5 WeakPolarHBondContact O-CA 3.43Å; D2-N5 WeakPolarHBondContact O-CB 3.41Å; D2-N5 PolarHBondContact O-N 3.32Å; D2-N5 PolarHBondContact OD2-ND2 3.21Å; D2-I6 PolarHBondContact O-N 3.35Å; D2-I6 VanDerWaalsContact O-N 3.07Å
3T71.3Confident73Confident31 Ų3178.6 Ų78.619%0.1942%0.421CS..Hα-helixtrans-54.8-41.3-179.358.80000111.5N5 I6 A7 W77T3-N5 PolarHBondContact O-N 3.28Å; T3-I6 WeakPolarHBondContact O-CB 3.35Å; T3-I6 PolarHBondContact O-N 3.21Å; T3-A7 PolarHBondContact O-N 2.83Å; T3-W77 HydrophobicContact CG2-CH2 3.55Å; T3-W77 HydrophobicContact CG2-CZ2 4.38Å; T3-W77 HydrophobicContact CG2-CZ3 4.4Å
4V73.3Confident72.8Confident29 Ų2979.8 Ų79.818%0.17644%0.438CS..Hα-helixtrans-62.8-38.5174.6179.10000112.4D2 A7 K8 E20 I23D2-V4 PolarHBondContact O-N 3.39Å; V4-A7 PolarHBondContact O-N 3.42Å; V4-K8 HydrophobicContact CG1-CD 4.49Å; V4-K8 WeakPolarHBondContact O-CG 3.27Å; V4-K8 PolarHBondContact O-N 2.91Å; V4-E20 HydrophobicContact CG2-CB 4.11Å; V4-I23 HydrophobicContact CB-CD1 4.3Å; V4-I23 HydrophobicContact CG2-CD1 3.89Å
5N77.6Confident72.5Confident76 Ų7680.5 Ų80.541%0.40644%0.436SS..Hα-helixtrans-69.1-38.4178.9-74.8-29.8000111D2 T3 K8 E9D2-N5 HydrophobicContact CB-CB 4.17Å; D2-N5 WeakPolarHBondContact O-CA 3.43Å; D2-N5 WeakPolarHBondContact O-CB 3.41Å; D2-N5 PolarHBondContact O-N 3.32Å; D2-N5 PolarHBondContact OD2-ND2 3.21Å; T3-N5 PolarHBondContact O-N 3.28Å; N5-K8 PolarHBondContact O-N 2.91Å; N5-E9 PolarHBondContact O-N 3.32Å
6I76.2Confident72.3Confident27 Ų2778.6 Ų78.614%0.13843%0.43CS..Hα-helixtrans-62.1-46.7173.7-63.5168000110.4M1 D2 T3 K8 E9 L10 F76M1-I6 HydrophobicContact CB-CD1 4.33Å; M1-I6 HydrophobicContact CE-CG1 4.03Å; M1-I6 HydrophobicContact CG-CD1 4.04Å; M1-I6 HydrophobicContact CG-CG1 3.77Å; M1-I6 HydrophobicContact SD-CG1 4.36Å; D2-I6 PolarHBondContact O-N 3.35Å; D2-I6 VanDerWaalsContact O-N 3.07Å; T3-I6 WeakPolarHBondContact O-CB 3.35Å; T3-I6 PolarHBondContact O-N 3.21Å; I6-K8 VanDerWaalsContact C-N 3.29Å; I6-K8 PolarHBondContact O-N 3.37Å; I6-E9 PolarHBondContact O-N 3.22Å; I6-E9 VanDerWaalsContact O-N 3.1Å; I6-L10 HydrophobicContact CG2-CD1 3.8Å; I6-L10 HydrophobicContact CG2-CG 4.3Å; I6-L10 WeakPolarHBondContact O-CG 3.5Å; I6-L10 PolarHBondContact O-N 3.24Å; I6-F76 HydrophobicContact CG2-CD1 3.97Å; I6-F76 HydrophobicContact CG2-CE1 3.38Å; I6-F76 HydrophobicContact CG2-CZ 4.21Å
7A71.7Confident72.6Confident16 Ų1681.1 Ų81.113%0.13245%0.448CS..Hα-helixtrans-59.8-40178.800000112.3T3 V4 G11 M18 I23T3-A7 PolarHBondContact O-N 2.83Å; V4-A7 PolarHBondContact O-N 3.42Å; A7-G11 PolarHBondContact O-N 2.78Å; A7-M18 HydrophobicContact CB-CE 3.63Å; A7-I23 HydrophobicContact CB-CD1 3.77Å
8K74.1Confident72.9Confident83 Ų8379.5 Ų79.536%0.36144%0.437SS..Hα-helixtrans-63.4-40.9173.4-74.4174.1-175177.20112.5V4 N5 I6 G12V4-K8 HydrophobicContact CG1-CD 4.49Å; V4-K8 WeakPolarHBondContact O-CG 3.27Å; V4-K8 PolarHBondContact O-N 2.91Å; N5-K8 PolarHBondContact O-N 2.91Å; I6-K8 VanDerWaalsContact C-N 3.29Å; I6-K8 PolarHBondContact O-N 3.37Å; K8-G12 CarbonylContact O-C 3.58Å; K8-G12 VanDerWaalsContact O-CA 3.3Å; K8-G12 WeakPolarHBondContact O-CA 3.3Å; K8-G12 PolarHBondContact O-N 3.36Å
9E77Confident73.2Confident144 Ų14480.4 Ų80.467%0.67344%0.44SS*.Hα-helixtrans-67.7-38.6-179.6-168.7173.8178.800111.9M1 N5 I6M1-E9 WeakPolarHBondContact CE-OE2 3.18Å; N5-E9 PolarHBondContact O-N 3.32Å; I6-E9 PolarHBondContact O-N 3.22Å; I6-E9 VanDerWaalsContact O-N 3.1Å
10L76.4Confident73.4Confident101 Ų10182.4 Ų82.453%0.52945%0.447SS..Hα-helixtrans-82.5-44.3-178.6-65.3173.5000114.2I6 F76I6-L10 HydrophobicContact CG2-CD1 3.8Å; I6-L10 HydrophobicContact CG2-CG 4.3Å; I6-L10 WeakPolarHBondContact O-CG 3.5Å; I6-L10 PolarHBondContact O-N 3.24Å; L10-F76 HydrophobicContact CD1-CD1 3.63Å; L10-F76 HydrophobicContact CD1-CD2 3.76Å; L10-F76 HydrophobicContact CD1-CE1 3.55Å; L10-F76 HydrophobicContact CD1-CE2 3.67Å; L10-F76 HydrophobicContact CD1-CG 3.74Å; L10-F76 HydrophobicContact CD1-CZ 3.56Å; L10-F76 HydrophobicContact CD2-CD2 4.01Å; L10-F76 HydrophobicContact CD2-CE1 4.34Å; L10-F76 HydrophobicContact CD2-CE2 3.26Å; L10-F76 HydrophobicContact CD2-CZ 3.47Å; L10-F76 VanDerWaalsContact CD2-CZ 3.47Å; L10-F76 HydrophobicContact CG-CE1 4.28Å; L10-F76 HydrophobicContact CG-CE2 4.01Å; L10-F76 HydrophobicContact CG-CZ 3.87Å
11G75Confident73.6Confident29 Ų2984.1 Ų84.130%0.29946%0.456SS..Hα-helixtrans-90.3-15.1-173.500000113.8A7 F15A7-G11 PolarHBondContact O-N 2.78Å; G11-F15 VanDerWaalsContact CA-CE2 3.42Å; G11-F15 WeakPolarHBondContact O-CD2 3.43Å; G11-F15 VanDerWaalsContact O-CE2 3.25Å; G11-F15 WeakPolarHBondContact O-CE2 3.5Å
12G72.1Confident74.7Confident32 Ų3279.2 Ų79.233%0.3343%0.433SS..  trans78.5-174.8-169.600000112.8K8 S14 F15K8-G12 CarbonylContact O-C 3.58Å; K8-G12 VanDerWaalsContact O-CA 3.3Å; K8-G12 WeakPolarHBondContact O-CA 3.3Å; K8-G12 PolarHBondContact O-N 3.36Å; G12-S14 PolarHBondContact O-N 3.09Å; G12-S14 VanDerWaalsContact O-N 3.07Å; G12-F15 PolarHBondContact O-N 3.03Å
13E74.8Confident75Confident174 Ų17474.9 Ų74.981%0.81341%0.409SS*.G310 helixtrans-63.2-21.3-168.4-156.8160-154.600113.8F15 S16E13-F15 PolarHBondContact O-N 3.19Å; E13-S16 WeakPolarHBondContact O-CB 3.49Å; E13-S16 PolarHBondContact O-N 3.18Å; E13-S16 VanDerWaalsContact O-N 3.11Å; E13-S16 PolarHBondContact O-OG 3.37Å
14S70.3Confident75.3Confident95 Ų9575.7 Ų75.766%0.66441%0.414SS*.G310 helixtrans-65-24.2175.152.40000113.9G12 S16G12-S14 PolarHBondContact O-N 3.09Å; G12-S14 VanDerWaalsContact O-N 3.07Å; S14-S16 VanDerWaalsContact C-N 3.31Å
15F68.3Low75.5Confident91 Ų9180.7 Ų80.740%0.39944%0.436SS..G310 helixtrans-88.7-0.9177.6-69.8-94.6000112.5G11 G12 E13 V17 M18G11-F15 VanDerWaalsContact CA-CE2 3.42Å; G11-F15 WeakPolarHBondContact O-CD2 3.43Å; G11-F15 VanDerWaalsContact O-CE2 3.25Å; G11-F15 WeakPolarHBondContact O-CE2 3.5Å; G12-F15 PolarHBondContact O-N 3.03Å; E13-F15 PolarHBondContact O-N 3.19Å; F15-V17 PolarHBondContact O-N 3.32Å; F15-M18 HydrophobicContact CB-CE 3.94Å; F15-M18 HydrophobicContact CD1-CE 3.59Å; F15-M18 HydrophobicContact CD1-SD 3.8Å; F15-M18 HydrophobicContact CG-CE 4.23Å; F15-M18 PolarHBondContact O-N 3.08Å; F15-M18 VanDerWaalsContact O-N 3.17Å
16S69.1Low75.3Confident50 Ų5083.3 Ų83.335%0.3545%0.445SS..G310 helixtrans-66.4-16.5-179.567.50000114.9E13 S14E13-S16 WeakPolarHBondContact O-CB 3.49Å; E13-S16 PolarHBondContact O-N 3.18Å; E13-S16 VanDerWaalsContact O-N 3.11Å; E13-S16 PolarHBondContact O-OG 3.37Å; S14-S16 VanDerWaalsContact C-N 3.31Å
17V76.4Confident75.1Confident120 Ų12084.8 Ų84.873%0.72745%0.453SS*.G310 helixtrans-79-22.4178.1-175.80000111.7F15 I19F15-V17 PolarHBondContact O-N 3.32Å; V17-I19 PolarHBondContact O-N 2.88Å
18M77.9Confident75.1Confident53 Ų5390.9 Ų90.926%0.26148%0.479SS..  trans-66128.3-179.8-62.4-169.4-46.300110.1A7 F15 I23A7-M18 HydrophobicContact CB-CE 3.63Å; F15-M18 HydrophobicContact CB-CE 3.94Å; F15-M18 HydrophobicContact CD1-CE 3.59Å; F15-M18 HydrophobicContact CD1-SD 3.8Å; F15-M18 HydrophobicContact CG-CE 4.23Å; F15-M18 PolarHBondContact O-N 3.08Å; F15-M18 VanDerWaalsContact O-N 3.17Å; M18-I23 HydrophobicContact CB-CD1 4.45Å; M18-I23 HydrophobicContact CB-CG1 4.27Å; M18-I23 HydrophobicContact CE-CD1 4.3Å; M18-I23 HydrophobicContact CE-CG1 4.05Å
19I78.6Confident75Confident96 Ų9693.3 Ų93.349%0.49250%0.495SS..  trans-87.7165.2173.758168.2000110.1V17 D21 D22 I23V17-I19 PolarHBondContact O-N 2.88Å; I19-D21 HydrophobicContact CD1-CB 4.09Å; I19-D21 HydrophobicContact CG1-CB 4.32Å; I19-D21 PolarHBondContact O-N 2.91Å; I19-D22 HydrophobicContact CG1-CB 4.42Å; I19-D22 WeakPolarHBondContact CG1-OD2 3.44Å; I19-D22 PolarHBondContact N-OD2 3.01Å; I19-D22 PolarHBondContact O-N 3.32Å; I19-I23 PolarHBondContact O-N 3.21Å
20E77.5Confident74.5Confident121 Ų12188 Ų8857%0.56547%0.474SS*.Hα-helixtrans-56.3-35.9-179.2-174.7172.9-173.500112.5V4 I23 T24V4-E20 HydrophobicContact CG2-CB 4.11Å; E20-I23 PolarHBondContact O-N 3.38Å; E20-T24 WeakPolarHBondContact O-CB 3.45Å; E20-T24 PolarHBondContact O-N 3.09Å; E20-T24 PolarHBondContact O-OG1 3.31Å
21D78.6Confident73.8Confident119 Ų11986.1 Ų86.164%0.63648%0.479SS*.Hα-helixtrans-63.1-45.7177.3-73.3-2.3000112I19 I23 T24 E25I19-D21 HydrophobicContact CD1-CB 4.09Å; I19-D21 HydrophobicContact CG1-CB 4.32Å; I19-D21 PolarHBondContact O-N 2.91Å; D21-I23 PolarHBondContact O-N 3.18Å; D21-T24 PolarHBondContact O-N 3.17Å; D21-E25 WeakPolarHBondContact O-CB 3.36Å; D21-E25 PolarHBondContact O-N 3.27Å
22D81.6Confident73.6Confident69 Ų6992.9 Ų92.937%0.36950%0.503SS..Hα-helixtrans-59.8-38.3179.2-58.9-23.9000111.4I19 H26I19-D22 HydrophobicContact CG1-CB 4.42Å; I19-D22 WeakPolarHBondContact CG1-OD2 3.44Å; I19-D22 PolarHBondContact N-OD2 3.01Å; I19-D22 PolarHBondContact O-N 3.32Å; D22-H26 WeakPolarHBondContact O-CB 3.49Å; D22-H26 PolarHBondContact O-N 3.47Å
23I76.4Confident73.2Confident17 Ų1796 Ų969%0.08752%0.517CS..Hα-helixtrans-72-45.4179.9-62.2171.1000109.8V4 A7 M18 I19 E20 D21 H26 I27 W77V4-I23 HydrophobicContact CB-CD1 4.3Å; V4-I23 HydrophobicContact CG2-CD1 3.89Å; A7-I23 HydrophobicContact CB-CD1 3.77Å; M18-I23 HydrophobicContact CB-CD1 4.45Å; M18-I23 HydrophobicContact CB-CG1 4.27Å; M18-I23 HydrophobicContact CE-CD1 4.3Å; M18-I23 HydrophobicContact CE-CG1 4.05Å; I19-I23 PolarHBondContact O-N 3.21Å; E20-I23 PolarHBondContact O-N 3.38Å; D21-I23 PolarHBondContact O-N 3.18Å; I23-H26 PolarHBondContact O-N 3.16Å; I23-I27 HydrophobicContact CG2-CD1 3.74Å; I23-I27 VanDerWaalsContact O-CD1 3.3Å; I23-I27 WeakPolarHBondContact O-CD1 3.17Å; I23-I27 WeakPolarHBondContact O-CG1 3.26Å; I23-I27 PolarHBondContact O-N 3.39Å; I23-W77 HydrophobicContact CG2-CZ2 4.31Å
24T77.7Confident72.8Confident47 Ų4789.1 Ų89.129%0.28849%0.485SS..Hα-helixtrans-63.4-45.9179.8-55.60000111E20 D21 H26 I27 E28E20-T24 WeakPolarHBondContact O-CB 3.45Å; E20-T24 PolarHBondContact O-N 3.09Å; E20-T24 PolarHBondContact O-OG1 3.31Å; D21-T24 PolarHBondContact O-N 3.17Å; T24-H26 VanDerWaalsContact C-N 3.31Å; T24-H26 PolarHBondContact O-N 3.16Å; T24-I27 PolarHBondContact O-N 3.07Å; T24-I27 VanDerWaalsContact O-N 3.09Å; T24-E28 HydrophobicContact CG2-CG 4.26Å; T24-E28 WeakPolarHBondContact O-CB 3.36Å; T24-E28 WeakPolarHBondContact O-CG 3.42Å; T24-E28 PolarHBondContact O-N 3.17Å
25E78.9Confident73.1Confident134 Ų13488.2 Ų88.263%0.62648%0.475SS*.Hα-helixtrans-56.3-45.7175.4-177.8176.7-166.100110.9D21 I27 E28 D29D21-E25 WeakPolarHBondContact O-CB 3.36Å; D21-E25 PolarHBondContact O-N 3.27Å; E25-I27 VanDerWaalsContact C-N 3.32Å; E25-I27 PolarHBondContact O-N 3.4Å; E25-E28 PolarHBondContact O-N 2.96Å; E25-D29 VanDerWaalsContact O-CB 3.27Å; E25-D29 WeakPolarHBondContact O-CB 3.47Å; E25-D29 PolarHBondContact O-N 3.43Å
26H72.4Confident73.5Confident132 Ų13290.6 Ų90.661%0.61149%0.492SS*.Hα-helixtrans-65.2-32.3177.1-94.2-10.7000114.3D22 I23 T24 C30D22-H26 WeakPolarHBondContact O-CB 3.49Å; D22-H26 PolarHBondContact O-N 3.47Å; I23-H26 PolarHBondContact O-N 3.16Å; T24-H26 VanDerWaalsContact C-N 3.31Å; T24-H26 PolarHBondContact O-N 3.16Å; H26-C30 PolarHBondContact O-N 3.26Å; H26-C30 PolarHBondContact O-SG 3.15Å
27I71.7Confident73.9Confident57 Ų5795.1 Ų95.129%0.29251%0.508SS..Hα-helixtrans-73.7-45.9177.3-64.8158.4000110.3I23 T24 E25 D29 C30 W77I23-I27 HydrophobicContact CG2-CD1 3.74Å; I23-I27 VanDerWaalsContact O-CD1 3.3Å; I23-I27 WeakPolarHBondContact O-CD1 3.17Å; I23-I27 WeakPolarHBondContact O-CG1 3.26Å; I23-I27 PolarHBondContact O-N 3.39Å; T24-I27 PolarHBondContact O-N 3.07Å; T24-I27 VanDerWaalsContact O-N 3.09Å; E25-I27 VanDerWaalsContact C-N 3.32Å; E25-I27 PolarHBondContact O-N 3.4Å; I27-D29 VanDerWaalsContact C-N 3.34Å; I27-C30 CarbonylContact O-C 3.38Å; I27-C30 WeakPolarHBondContact O-CA 3.47Å; I27-C30 WeakPolarHBondContact O-CB 3.24Å; I27-C30 PolarHBondContact O-N 3.46Å; I27-C30 VanDerWaalsContact O-N 3.09Å; I27-W77 HydrophobicContact CD1-CD2 4.1Å; I27-W77 HydrophobicContact CD1-CH2 3.88Å; I27-W77 HydrophobicContact CD1-CZ2 3.13Å; I27-W77 HydrophobicContact CG1-CD2 4.49Å; I27-W77 HydrophobicContact CG1-CZ2 4.1Å; I27-W77 VanDerWaalsContact CG1-NE1 3.32Å
28E72.1Confident73.7Confident145 Ų14592.1 Ų92.168%0.67849%0.486SS*.Hα-helixtrans-65.9-36.9-179.7-71.1-174.6170.500111.8T24 E25 C30 G31T24-E28 HydrophobicContact CG2-CG 4.26Å; T24-E28 WeakPolarHBondContact O-CB 3.36Å; T24-E28 WeakPolarHBondContact O-CG 3.42Å; T24-E28 PolarHBondContact O-N 3.17Å; E25-E28 PolarHBondContact O-N 2.96Å; E28-C30 PolarHBondContact O-N 3.33Å; E28-G31 PolarHBondContact O-N 2.91Å
29D71.8Confident73.5Confident133 Ų13392.2 Ų92.271%0.71149%0.487SS*.Hα-helixtrans-66.4-23.7174-160.742.1000111.8E25 I27 G31E25-D29 VanDerWaalsContact O-CB 3.27Å; E25-D29 WeakPolarHBondContact O-CB 3.47Å; E25-D29 PolarHBondContact O-N 3.43Å; I27-D29 VanDerWaalsContact C-N 3.34Å; D29-G31 PolarHBondContact O-N 2.94Å
30C66.3Low73.3Confident32 Ų3293 Ų9322%0.21649%0.489CS..SBendtrans-89.651.3170.6-59.90000111.6H26 I27 E28 E32 Q70H26-C30 PolarHBondContact O-N 3.26Å; H26-C30 PolarHBondContact O-SG 3.15Å; I27-C30 CarbonylContact O-C 3.38Å; I27-C30 WeakPolarHBondContact O-CA 3.47Å; I27-C30 WeakPolarHBondContact O-CB 3.24Å; I27-C30 PolarHBondContact O-N 3.46Å; I27-C30 VanDerWaalsContact O-N 3.09Å; E28-C30 PolarHBondContact O-N 3.33Å; C30-E32 PolarHBondContact O-N 3.37Å; C30-Q70 HydrophobicContact CB-CG 4.15Å; C30-Q70 WeakPolarHBondContact SG-CG 3.5Å; C30-Q70 PolarHBondContact SG-NE2 3.22Å
31G61.7Low73.1Confident62 Ų6292.2 Ų92.264%0.63949%0.485SS*.  trans-64.92.4-164.200000118.7E28 D29E28-G31 PolarHBondContact O-N 2.91Å; D29-G31 PolarHBondContact O-N 2.94Å
32E70.5Confident72.6Confident172 Ų17288.2 Ų88.280%0.80446%0.463SS*.  trans-118.1119.2-177.2-54-161.1-139.200111.9C30C30-E32 PolarHBondContact O-N 3.37Å
33P64.7Low72.1Confident98 Ų9890.3 Ų90.364%0.63647%0.473SS*.PPolyproline II helixtrans-66148.2172.326.6-31.1000110.5
34F65.8Low71.9Confident29 Ų2995.3 Ų95.313%0.12750%0.496CS..PPolyproline II helixtrans-50.1138.4175.3-82.8-71.7000114.1E38 K71 S74 I75 Q78F34-E38 HydrophobicContact CD1-CB 3.61Å; F34-E38 HydrophobicContact CD1-CG 4.43Å; F34-E38 HydrophobicContact CE1-CB 4.16Å; F34-K71 HydrophobicContact CE1-CB 4.1Å; F34-K71 HydrophobicContact CE1-CD 3.94Å; F34-K71 HydrophobicContact CE1-CG 3.85Å; F34-K71 WeakPolarHBondContact CE2-O 3.02Å; F34-K71 VanDerWaalsContact CZ-CA 3.45Å; F34-K71 HydrophobicContact CZ-CB 3.6Å; F34-K71 HydrophobicContact CZ-CD 4.32Å; F34-K71 HydrophobicContact CZ-CG 3.8Å; F34-K71 WeakPolarHBondContact CZ-O 3.48Å; F34-S74 WeakPolarHBondContact CD2-OG 3.3Å; F34-S74 VanDerWaalsContact CE2-OG 3.26Å; F34-S74 WeakPolarHBondContact CE2-OG 3.19Å; F34-I75 HydrophobicContact CD2-CG1 3.92Å; F34-I75 HydrophobicContact CE2-CB 4.3Å; F34-I75 HydrophobicContact CE2-CD1 4.03Å; F34-I75 HydrophobicContact CE2-CG1 3.48Å; F34-I75 VanDerWaalsContact CE2-CG1 3.48Å; F34-I75 VanDerWaalsContact CE2-N 3.32Å; F34-I75 HydrophobicContact CZ-CD1 3.91Å; F34-I75 HydrophobicContact CZ-CG1 3.87Å; F34-Q78 VanDerWaalsContact N-NE2 3.19Å
35T77.2Confident71.3Confident75 Ų7595.4 Ų95.446%0.4650%0.498SS..PPolyproline II helixtrans-77.8152.8165.664.10000110.6E37 E38 L39T35-E37 PolarHBondContact O-N 2.8Å; T35-E37 VanDerWaalsContact O-N 3.15Å; T35-E38 PolarHBondContact N-OE2 3.22Å; T35-E38 VanDerWaalsContact N-OE2 3.11Å; T35-E38 WeakPolarHBondContact O-CB 3.48Å; T35-E38 PolarHBondContact O-N 3.11Å; T35-E38 VanDerWaalsContact OG1-CG 3.31Å; T35-E38 WeakPolarHBondContact OG1-CG 3.16Å; T35-E38 PolarHBondContact OG1-OE2 3.29Å; T35-L39 PolarHBondContact O-N 2.92Å; T35-L39 VanDerWaalsContact O-N 3.12Å
36N75.8Confident70.6Confident142 Ų14296.1 Ų96.176%0.75951%0.505SS*.Hα-helixtrans-54.3-37.3-179.1-34.8-2.4000111.7L39 E40N36-L39 PolarHBondContact O-N 3.07Å; N36-E40 PolarHBondContact O-N 2.95Å
37E77.5Confident70.2Confident144 Ų14497.7 Ų97.767%0.67351%0.51SS*.Hα-helixtrans-66.1-36.8179.3-175.4173.7-172.700112.3T35 Q41T35-E37 PolarHBondContact O-N 2.8Å; T35-E37 VanDerWaalsContact O-N 3.15Å; E37-Q41 WeakPolarHBondContact O-CG 3.31Å; E37-Q41 PolarHBondContact O-N 2.62Å
38E73.2Confident69.2Low57 Ų5798.2 Ų98.227%0.26653%0.529SS..Hα-helixtrans-72.6-34.8176.1-68.6175.3116.100112F34 T35 Q41 L42 K71F34-E38 HydrophobicContact CD1-CB 3.61Å; F34-E38 HydrophobicContact CD1-CG 4.43Å; F34-E38 HydrophobicContact CE1-CB 4.16Å; T35-E38 PolarHBondContact N-OE2 3.22Å; T35-E38 VanDerWaalsContact N-OE2 3.11Å; T35-E38 WeakPolarHBondContact O-CB 3.48Å; T35-E38 PolarHBondContact O-N 3.11Å; T35-E38 VanDerWaalsContact OG1-CG 3.31Å; T35-E38 WeakPolarHBondContact OG1-CG 3.16Å; T35-E38 PolarHBondContact OG1-OE2 3.29Å; E38-Q41 PolarHBondContact O-N 3.11Å; E38-L42 PolarHBondContact O-N 3.36Å; E38-L42 VanDerWaalsContact O-N 3.12Å; E38-K71 WeakPolarHBondContact OE1-CE 3.42Å; E38-K71 IonicContact OE1-NZ 2.8Å; E38-K71 PolarHBondContact OE1-NZ 2.9Å
39L73.5Confident68.1Low56 Ų5696.6 Ų96.629%0.29353%0.534SS..Hα-helixtrans-66.2-42.6175.1-173.966.1000111.8T35 N36 Q41 L42 M43T35-L39 PolarHBondContact O-N 2.92Å; T35-L39 VanDerWaalsContact O-N 3.12Å; N36-L39 PolarHBondContact O-N 3.07Å; L39-Q41 VanDerWaalsContact C-N 3.31Å; L39-Q41 PolarHBondContact O-N 3.05Å; L39-L42 HydrophobicContact CD1-CD2 4.26Å; L39-L42 VanDerWaalsContact O-CB 3.27Å; L39-L42 WeakPolarHBondContact O-CB 3.25Å; L39-L42 PolarHBondContact O-N 3.04Å; L39-M43 PolarHBondContact O-N 3.1Å
40E73.4Confident67.3Low112 Ų11297.8 Ų97.852%0.52354%0.541SS..Hα-helixtrans-60.3-42173.9-81.8-66.915100111.6N36 L42 M43 Q44N36-E40 PolarHBondContact O-N 2.95Å; E40-L42 VanDerWaalsContact C-N 3.3Å; E40-L42 PolarHBondContact O-N 3.07Å; E40-M43 PolarHBondContact O-N 3.35Å; E40-Q44 WeakPolarHBondContact O-CG 3.39Å; E40-Q44 PolarHBondContact O-N 3.41Å; E40-Q44 VanDerWaalsContact O-N 3.14Å
41Q74.2Confident66.5Low104 Ų104104 Ų10449%0.48657%0.572SS.*Hα-helixtrans-62.3-34.7176.2-73.7179.751.800113E37 E38 L39 S45E37-Q41 WeakPolarHBondContact O-CG 3.31Å; E37-Q41 PolarHBondContact O-N 2.62Å; E38-Q41 PolarHBondContact O-N 3.11Å; L39-Q41 VanDerWaalsContact C-N 3.31Å; L39-Q41 PolarHBondContact O-N 3.05Å; Q41-S45 PolarHBondContact O-N 3.35Å
42L68.3Low65.8Low35 Ų35109.2 Ų109.218%0.18359%0.585CS.*Hα-helixtrans-56-55.3170.5176.963.6000111.5E38 L39 E40 Q44 S45 L46 W67 I75E38-L42 PolarHBondContact O-N 3.36Å; E38-L42 VanDerWaalsContact O-N 3.12Å; L39-L42 HydrophobicContact CD1-CD2 4.26Å; L39-L42 VanDerWaalsContact O-CB 3.27Å; L39-L42 WeakPolarHBondContact O-CB 3.25Å; L39-L42 PolarHBondContact O-N 3.04Å; E40-L42 VanDerWaalsContact C-N 3.3Å; E40-L42 PolarHBondContact O-N 3.07Å; L42-Q44 VanDerWaalsContact C-N 3.26Å; L42-Q44 PolarHBondContact O-N 3.01Å; L42-S45 PolarHBondContact O-N 2.94Å; L42-S45 PolarHBondContact O-OG 2.91Å; L42-L46 PolarHBondContact O-N 2.96Å; L42-W67 VanDerWaalsContact CA-CH2 3.48Å; L42-W67 HydrophobicContact CB-CH2 3.5Å; L42-W67 HydrophobicContact CB-CZ2 4.14Å; L42-W67 HydrophobicContact CD1-CH2 2.99Å; L42-W67 HydrophobicContact CD1-CZ2 3.81Å; L42-W67 HydrophobicContact CD1-CZ3 3.41Å; L42-W67 VanDerWaalsContact CD1-CZ3 3.41Å; L42-W67 HydrophobicContact CG-CH2 3.73Å; L42-W67 HydrophobicContact CG-CZ3 4.42Å; L42-I75 HydrophobicContact CB-CD1 4.49Å; L42-I75 HydrophobicContact CD1-CD1 3.88Å; L42-I75 HydrophobicContact CD2-CB 4.38Å; L42-I75 HydrophobicContact CD2-CD1 3.46Å; L42-I75 VanDerWaalsContact CD2-CD1 3.46Å; L42-I75 HydrophobicContact CD2-CG1 3.73Å; L42-I75 HydrophobicContact CD2-CG2 3.72Å; L42-I75 HydrophobicContact CG-CD1 4.11Å
43M71.7Confident64.8Low114 Ų114107.3 Ų107.356%0.56258%0.58SS**Hα-helixtrans-61.9-37.5-172.8-67.7-173.967.900111.5L39 E40 K47L39-M43 PolarHBondContact O-N 3.1Å; E40-M43 PolarHBondContact O-N 3.35Å; M43-K47 PolarHBondContact O-N 3.2Å
44Q72.1Confident64Low122 Ų122110 Ų11057%0.5759%0.589SS**Hα-helixtrans-67.7-36.8175.9-62.7-59.9-32.800112.6E40 L42 L46 K47E40-Q44 WeakPolarHBondContact O-CG 3.39Å; E40-Q44 PolarHBondContact O-N 3.41Å; E40-Q44 VanDerWaalsContact O-N 3.14Å; L42-Q44 VanDerWaalsContact C-N 3.26Å; L42-Q44 PolarHBondContact O-N 3.01Å; Q44-L46 VanDerWaalsContact C-N 3.35Å; Q44-L46 PolarHBondContact O-N 2.95Å; Q44-K47 PolarHBondContact O-N 3.43Å
45S64.8Low63.3Low49 Ų49114.7 Ų114.734%0.34362%0.62SS.*Hα-helixtrans-67.6-34.9179.875.60000112.9Q41 L42 K47 G48 W67Q41-S45 PolarHBondContact O-N 3.35Å; L42-S45 PolarHBondContact O-N 2.94Å; L42-S45 PolarHBondContact O-OG 2.91Å; S45-K47 VanDerWaalsContact C-N 3.35Å; S45-G48 PolarHBondContact O-N 3.26Å; S45-W67 WeakPolarHBondContact OG-CZ2 3.47Å
46L63.2Low61.9Low149 Ų149119.7 Ų119.778%0.7864%0.642SS**Hα-helixtrans-73.4-29.3178.3-167.269.8000112.1L42 Q44 G48L42-L46 PolarHBondContact O-N 2.96Å; Q44-L46 VanDerWaalsContact C-N 3.35Å; Q44-L46 PolarHBondContact O-N 2.95Å; L46-G48 PolarHBondContact O-N 3.12Å
47K64.5Low60.7Low165 Ų165121.1 Ų121.172%0.71764%0.644SS**THydrogen-bonded Turntrans-71.6-11.4178.8-162163.7-176.61690113.4M43 Q44 S45 S49M43-K47 PolarHBondContact O-N 3.2Å; Q44-K47 PolarHBondContact O-N 3.43Å; S45-K47 VanDerWaalsContact C-N 3.35Å; K47-S49 VanDerWaalsContact C-N 3.34Å; K47-S49 PolarHBondContact O-N 3.04Å
48G50.7Low59.2Low67 Ų67120.9 Ų120.969%0.69165%0.648SS**THydrogen-bonded Turntrans-82.726.2-169.700000117.6S45 L46S45-G48 PolarHBondContact O-N 3.26Å; L46-G48 PolarHBondContact O-N 3.12Å
49S48.5Very low58.1Low112 Ų112128 Ų12878%0.78367%0.672SS**THydrogen-bonded Turntrans-143.532.8-176-172.50000115.6K47K47-S49 VanDerWaalsContact C-N 3.34Å; K47-S49 PolarHBondContact O-N 3.04Å
50D54.9Low56.7Low157 Ų157132.8 Ų132.884%0.8469%0.693SS**  trans-116.312.2169.3-157.434.3000113.4D52D50-D52 PolarHBondContact O-N 2.79Å
51D50.5Low55.6Low164 Ų164131.1 Ų131.188%0.87770%0.698SS**  trans-100.771.5172.6-110.7-13.9000109.5D53D51-D53 VanDerWaalsContact C-N 3.27Å; D51-D53 PolarHBondContact O-N 3.47Å
52D46.6Very low54.2Low171 Ų171135.9 Ų135.991%0.91471%0.712SS**  trans-74.181.6155.3-102.9-32.9000107.6D50D50-D52 PolarHBondContact O-N 2.79Å
53D50.3Low53.4Low131 Ų131139.2 Ų139.270%0.70173%0.734SS**SBendtrans-157.795.9158.2-136.4-6.7000112.2D51 V55D51-D53 VanDerWaalsContact C-N 3.27Å; D51-D53 PolarHBondContact O-N 3.47Å; D53-V55 PolarHBondContact O-N 3.37Å
54D47.5Very low52.5Low155 Ų155136 Ų13683%0.82972%0.721SS**  trans31.961.8145.2-75-24.7000119.2
55V50.7Low51.9Low127 Ų127136.2 Ų136.277%0.7774%0.737SS**  trans-142.4100.3149.5-172.90000110.3D53 E57D53-V55 PolarHBondContact O-N 3.37Å; V55-E57 PolarHBondContact O-N 2.88Å
56I48.4Very low52Low180 Ų180135.7 Ų135.792%0.92374%0.738SS**  trans-64.680.1162.749154.5000110.6
57E49.9Very low52.2Low172 Ų172132.1 Ų132.180%0.80472%0.715SS**  trans-109.4123.7153.2-163.5175.8-173.100108.9V55 R59V55-E57 PolarHBondContact O-N 2.88Å; E57-R59 PolarHBondContact O-N 3.06Å
58N46.3Very low52.8Low139 Ų139127.6 Ų127.674%0.74370%0.701SS**  trans-64.756.6-172.4-160.538.8000112.7E60N58-E60 PolarHBondContact O-N 2.72Å
59R49.4Very low53.9Low208 Ų208131.7 Ų131.779%0.78571%0.706SS**  trans-7772.5163.7-167.8179-162.6173.75.4105.9E57 A61E57-R59 PolarHBondContact O-N 3.06Å; R59-A61 WeakPolarHBondContact O-CA 3.07Å; R59-A61 PolarHBondContact O-N 3.01Å
60E45.8Very low55.2Low155 Ų155131.3 Ų131.372%0.72469%0.692SS**  trans-27.4108.6166.9-73.4179.6174.200107.4N58 R62N58-E60 PolarHBondContact O-N 2.72Å; E60-R62 PolarHBondContact O-N 3.15Å
61A49.3Very low56.2Low77 Ų77126.7 Ų126.764%0.63667%0.665SS**  trans-40.3108.9-169.700000106.9R59 T63R59-A61 WeakPolarHBondContact O-CA 3.07Å; R59-A61 PolarHBondContact O-N 3.01Å; A61-T63 HydrophobicContact CB-CG2 4.41Å; A61-T63 PolarHBondContact O-N 3.12Å; A61-T63 PolarHBondContact O-OG1 3Å
62R45.8Very low57.5Low204 Ų204123.3 Ų123.377%0.7765%0.646SS**  trans-6863.3166.5-171.6-174.2-177-166.31105E60 P64E60-R62 PolarHBondContact O-N 3.15Å; R62-P64 VanDerWaalsContact C-N 3.32Å; R62-P64 WeakPolarHBondContact O-CD 3.43Å
63T50.2Low59.1Low106 Ų106117.3 Ų117.365%0.6562%0.62SS**  trans-43.7109.5149.939.80000102.2A61 S65A61-T63 HydrophobicContact CB-CG2 4.41Å; A61-T63 PolarHBondContact O-N 3.12Å; A61-T63 PolarHBondContact O-OG1 3Å; T63-S65 PolarHBondContact O-N 3.38Å
64P52.7Low60.4Low46 Ų46112 Ų11230%0.29959%0.593SS.*  trans-62.8103.9179.1-1932.2000103.9R62 G66 W67R62-P64 VanDerWaalsContact C-N 3.32Å; R62-P64 WeakPolarHBondContact O-CD 3.43Å; P64-G66 PolarHBondContact O-N 3.35Å; P64-W67 VanDerWaalsContact CB-NE1 3.32Å; P64-W67 PolarHBondContact O-N 3.21Å
65S60.2Low62Low127 Ų127106.2 Ų106.289%0.88856%0.562SS**THydrogen-bonded Turntrans-63.6-0.9-170.253.90000112.6T63T63-S65 PolarHBondContact O-N 3.38Å
66G65.8Low63.4Low37 Ų37104.4 Ų104.438%0.38154%0.544SS..THydrogen-bonded Turntrans-87.5-2.1172.700000116P64 T68 K71P64-G66 PolarHBondContact O-N 3.35Å; G66-T68 PolarHBondContact O-N 3.06Å; G66-K71 VanDerWaalsContact O-CD 3.24Å; G66-K71 WeakPolarHBondContact O-CD 3.49Å; G66-K71 WeakPolarHBondContact O-CE 3.43Å
67W67.6Low64.9Low75 Ų75100.6 Ų100.628%0.28452%0.518SS..  trans-71.187.8175.7-71.3105.3000111.7L42 S45 P64 L72 I75L42-W67 VanDerWaalsContact CA-CH2 3.48Å; L42-W67 HydrophobicContact CB-CH2 3.5Å; L42-W67 HydrophobicContact CB-CZ2 4.14Å; L42-W67 HydrophobicContact CD1-CH2 2.99Å; L42-W67 HydrophobicContact CD1-CZ2 3.81Å; L42-W67 HydrophobicContact CD1-CZ3 3.41Å; L42-W67 VanDerWaalsContact CD1-CZ3 3.41Å; L42-W67 HydrophobicContact CG-CH2 3.73Å; L42-W67 HydrophobicContact CG-CZ3 4.42Å; S45-W67 WeakPolarHBondContact OG-CZ2 3.47Å; P64-W67 VanDerWaalsContact CB-NE1 3.32Å; P64-W67 PolarHBondContact O-N 3.21Å; W67-L72 HydrophobicContact CE3-CD2 3.58Å; W67-L72 HydrophobicContact CE3-CG 4.17Å; W67-L72 HydrophobicContact CZ3-CD2 3.81Å; W67-I75 HydrophobicContact CH2-CD1 4.17Å; W67-I75 HydrophobicContact CZ3-CD1 3.67Å
68T78Confident66.5Low69 Ų6995.2 Ų95.242%0.42349%0.492SS..  trans-87.6155168.563.20000110.3G66 Q70 K71 L72G66-T68 PolarHBondContact O-N 3.06Å; T68-Q70 PolarHBondContact O-N 3.35Å; T68-K71 WeakPolarHBondContact O-CA 3.3Å; T68-K71 WeakPolarHBondContact O-CB 3.08Å; T68-K71 PolarHBondContact O-N 3.48Å; T68-K71 PolarHBondContact OG1-N 3.23Å; T68-L72 PolarHBondContact O-N 2.65Å
69L74.2Confident68.1Low153 Ų15390.8 Ų90.880%0.80148%0.476SS*.Hα-helixtrans-51.2-39.2172.3-99.6145.7000112.1K71 L72 A73L69-K71 VanDerWaalsContact C-N 3.31Å; L69-K71 PolarHBondContact O-N 3.16Å; L69-L72 PolarHBondContact O-N 3.07Å; L69-A73 PolarHBondContact O-N 3.47Å
70Q74.8Confident69.4Low105 Ų10584.3 Ų84.349%0.49146%0.46SS..Hα-helixtrans-56.2-42.1173.4169.9165.828.800112.6C30 T68 A73 S74C30-Q70 HydrophobicContact CB-CG 4.15Å; C30-Q70 WeakPolarHBondContact SG-CG 3.5Å; C30-Q70 PolarHBondContact SG-NE2 3.22Å; T68-Q70 PolarHBondContact O-N 3.35Å; Q70-A73 PolarHBondContact O-N 3.21Å; Q70-S74 PolarHBondContact O-N 2.75Å; Q70-S74 VanDerWaalsContact O-N 3.16Å
71K76.2Confident70.9Confident60 Ų6079.5 Ų79.526%0.26145%0.447SS..Hα-helixtrans-63.1-47.7174.5-77.8-160.9-175.6-158.90111.6F34 E38 G66 T68 L69 A73 S74 I75F34-K71 HydrophobicContact CE1-CB 4.1Å; F34-K71 HydrophobicContact CE1-CD 3.94Å; F34-K71 HydrophobicContact CE1-CG 3.85Å; F34-K71 WeakPolarHBondContact CE2-O 3.02Å; F34-K71 VanDerWaalsContact CZ-CA 3.45Å; F34-K71 HydrophobicContact CZ-CB 3.6Å; F34-K71 HydrophobicContact CZ-CD 4.32Å; F34-K71 HydrophobicContact CZ-CG 3.8Å; F34-K71 WeakPolarHBondContact CZ-O 3.48Å; E38-K71 WeakPolarHBondContact OE1-CE 3.42Å; E38-K71 IonicContact OE1-NZ 2.8Å; E38-K71 PolarHBondContact OE1-NZ 2.9Å; G66-K71 VanDerWaalsContact O-CD 3.24Å; G66-K71 WeakPolarHBondContact O-CD 3.49Å; G66-K71 WeakPolarHBondContact O-CE 3.43Å; T68-K71 WeakPolarHBondContact O-CA 3.3Å; T68-K71 WeakPolarHBondContact O-CB 3.08Å; T68-K71 PolarHBondContact O-N 3.48Å; T68-K71 PolarHBondContact OG1-N 3.23Å; L69-K71 VanDerWaalsContact C-N 3.31Å; L69-K71 PolarHBondContact O-N 3.16Å; K71-A73 VanDerWaalsContact C-N 3.29Å; K71-A73 PolarHBondContact O-N 3.25Å; K71-S74 PolarHBondContact O-N 3.36Å; K71-I75 PolarHBondContact O-N 3.18Å
72L78.1Confident72.1Confident93 Ų9379.3 Ų79.349%0.48744%0.435SS..Hα-helixtrans-61.1-39.9180-66.6172.3000112.2W67 T68 L69 I75 F76W67-L72 HydrophobicContact CE3-CD2 3.58Å; W67-L72 HydrophobicContact CE3-CG 4.17Å; W67-L72 HydrophobicContact CZ3-CD2 3.81Å; T68-L72 PolarHBondContact O-N 2.65Å; L69-L72 PolarHBondContact O-N 3.07Å; L72-I75 PolarHBondContact O-N 2.8Å; L72-F76 PolarHBondContact O-N 3.01Å
73A79.7Confident73.7Confident45 Ų4577 Ų7737%0.37243%0.43SS..Hα-helixtrans-60.9-45.7176.800000112.3L69 Q70 K71 I75 F76 W77L69-A73 PolarHBondContact O-N 3.47Å; Q70-A73 PolarHBondContact O-N 3.21Å; K71-A73 VanDerWaalsContact C-N 3.29Å; K71-A73 PolarHBondContact O-N 3.25Å; A73-I75 VanDerWaalsContact C-N 3.33Å; A73-I75 PolarHBondContact O-N 3.31Å; A73-F76 WeakPolarHBondContact O-CB 3.42Å; A73-F76 PolarHBondContact O-N 3.2Å; A73-F76 VanDerWaalsContact O-N 3.15Å; A73-W77 PolarHBondContact O-N 3.06Å
74S78.8Confident75.1Confident18 Ų1877.4 Ų77.413%0.12643%0.429CS..Hα-helixtrans-67.1-31.3-177.8172.40000112.8F34 Q70 K71 F76 W77 Q78F34-S74 WeakPolarHBondContact CD2-OG 3.3Å; F34-S74 VanDerWaalsContact CE2-OG 3.26Å; F34-S74 WeakPolarHBondContact CE2-OG 3.19Å; Q70-S74 PolarHBondContact O-N 2.75Å; Q70-S74 VanDerWaalsContact O-N 3.16Å; K71-S74 PolarHBondContact O-N 3.36Å; S74-F76 VanDerWaalsContact C-N 3.34Å; S74-W77 PolarHBondContact O-N 3.2Å; S74-Q78 WeakPolarHBondContact O-CG 3.39Å; S74-Q78 PolarHBondContact O-N 3.12Å; S74-Q78 VanDerWaalsContact O-N 3.16Å; S74-Q78 PolarHBondContact OG-NE2 2.95Å
75I80.2Confident76.1Confident34 Ų3480.8 Ų80.817%0.17444%0.442CS..Hα-helixtrans-65.8-44.3173-75.1147.7000109.6F34 L42 W67 K71 L72 A73 W77 Q78 A79F34-I75 HydrophobicContact CD2-CG1 3.92Å; F34-I75 HydrophobicContact CE2-CB 4.3Å; F34-I75 HydrophobicContact CE2-CD1 4.03Å; F34-I75 HydrophobicContact CE2-CG1 3.48Å; F34-I75 VanDerWaalsContact CE2-CG1 3.48Å; F34-I75 VanDerWaalsContact CE2-N 3.32Å; F34-I75 HydrophobicContact CZ-CD1 3.91Å; F34-I75 HydrophobicContact CZ-CG1 3.87Å; L42-I75 HydrophobicContact CB-CD1 4.49Å; L42-I75 HydrophobicContact CD1-CD1 3.88Å; L42-I75 HydrophobicContact CD2-CB 4.38Å; L42-I75 HydrophobicContact CD2-CD1 3.46Å; L42-I75 VanDerWaalsContact CD2-CD1 3.46Å; L42-I75 HydrophobicContact CD2-CG1 3.73Å; L42-I75 HydrophobicContact CD2-CG2 3.72Å; L42-I75 HydrophobicContact CG-CD1 4.11Å; W67-I75 HydrophobicContact CH2-CD1 4.17Å; W67-I75 HydrophobicContact CZ3-CD1 3.67Å; K71-I75 PolarHBondContact O-N 3.18Å; L72-I75 PolarHBondContact O-N 2.8Å; A73-I75 VanDerWaalsContact C-N 3.33Å; A73-I75 PolarHBondContact O-N 3.31Å; I75-W77 PolarHBondContact O-N 3.34Å; I75-Q78 PolarHBondContact O-N 3.43Å; I75-Q78 VanDerWaalsContact O-N 3.12Å; I75-A79 PolarHBondContact O-N 3.2Å
76F80.2Confident76.8Confident90 Ų9080.1 Ų80.140%0.39543%0.427SS..Hα-helixtrans-61-39-178.7-155.4-82.8000111.5I6 L10 L72 A73 S74 P80I6-F76 HydrophobicContact CG2-CD1 3.97Å; I6-F76 HydrophobicContact CG2-CE1 3.38Å; I6-F76 HydrophobicContact CG2-CZ 4.21Å; L10-F76 HydrophobicContact CD1-CD1 3.63Å; L10-F76 HydrophobicContact CD1-CD2 3.76Å; L10-F76 HydrophobicContact CD1-CE1 3.55Å; L10-F76 HydrophobicContact CD1-CE2 3.67Å; L10-F76 HydrophobicContact CD1-CG 3.74Å; L10-F76 HydrophobicContact CD1-CZ 3.56Å; L10-F76 HydrophobicContact CD2-CD2 4.01Å; L10-F76 HydrophobicContact CD2-CE1 4.34Å; L10-F76 HydrophobicContact CD2-CE2 3.26Å; L10-F76 HydrophobicContact CD2-CZ 3.47Å; L10-F76 VanDerWaalsContact CD2-CZ 3.47Å; L10-F76 HydrophobicContact CG-CE1 4.28Å; L10-F76 HydrophobicContact CG-CE2 4.01Å; L10-F76 HydrophobicContact CG-CZ 3.87Å; L72-F76 PolarHBondContact O-N 3.01Å; A73-F76 WeakPolarHBondContact O-CB 3.42Å; A73-F76 PolarHBondContact O-N 3.2Å; A73-F76 VanDerWaalsContact O-N 3.15Å; S74-F76 VanDerWaalsContact C-N 3.34Å; F76-P80 VanDerWaalsContact O-CD 3.3Å; F76-P80 WeakPolarHBondContact O-CD 3.38Å
77W80.6Confident77.3Confident100 Ų10081.6 Ų81.638%0.37944%0.443SS..Hα-helixtrans-66.9-33.8175.3-81.7109.3000114.2T3 I23 I27 A73 S74 I75 P80T3-W77 HydrophobicContact CG2-CH2 3.55Å; T3-W77 HydrophobicContact CG2-CZ2 4.38Å; T3-W77 HydrophobicContact CG2-CZ3 4.4Å; I23-W77 HydrophobicContact CG2-CZ2 4.31Å; I27-W77 HydrophobicContact CD1-CD2 4.1Å; I27-W77 HydrophobicContact CD1-CH2 3.88Å; I27-W77 HydrophobicContact CD1-CZ2 3.13Å; I27-W77 HydrophobicContact CG1-CD2 4.49Å; I27-W77 HydrophobicContact CG1-CZ2 4.1Å; I27-W77 VanDerWaalsContact CG1-NE1 3.32Å; A73-W77 PolarHBondContact O-N 3.06Å; S74-W77 PolarHBondContact O-N 3.2Å; I75-W77 PolarHBondContact O-N 3.34Å; W77-P80 WeakPolarHBondContact O-CD 3.41Å
78Q82.1Confident77.6Confident58 Ų5884.8 Ų84.827%0.27147%0.465SS..Hα-helixtrans-84.2-21.5-179.6-68.5179.750.500113.2F34 S74 I75 A81 L82F34-Q78 VanDerWaalsContact N-NE2 3.19Å; S74-Q78 WeakPolarHBondContact O-CG 3.39Å; S74-Q78 PolarHBondContact O-N 3.12Å; S74-Q78 VanDerWaalsContact O-N 3.16Å; S74-Q78 PolarHBondContact OG-NE2 2.95Å; I75-Q78 PolarHBondContact O-N 3.43Å; I75-Q78 VanDerWaalsContact O-N 3.12Å; Q78-A81 WeakPolarHBondContact O-CB 3.27Å; Q78-A81 PolarHBondContact O-N 3.39Å; Q78-L82 PolarHBondContact O-N 3.31Å
79A80.4Confident77.4Confident47 Ų4786.8 Ų86.839%0.38847%0.466SS..Hα-helixtrans-57.4-40-176.600000114.3I75 L82 K83I75-A79 PolarHBondContact O-N 3.2Å; A79-L82 PolarHBondContact O-N 3.43Å; A79-K83 WeakPolarHBondContact O-CB 3.3Å; A79-K83 PolarHBondContact O-N 3.04Å
80P76.9Confident77.4Confident72 Ų7283.4 Ų83.447%0.46845%0.448SS..Hα-helixtrans-62.6-42.4172.4-23.634.3000113.2F76 W77 L82 K83 D84F76-P80 VanDerWaalsContact O-CD 3.3Å; F76-P80 WeakPolarHBondContact O-CD 3.38Å; W77-P80 WeakPolarHBondContact O-CD 3.41Å; P80-L82 VanDerWaalsContact C-N 3.32Å; P80-L82 PolarHBondContact O-N 3.14Å; P80-K83 WeakPolarHBondContact O-CB 3.4Å; P80-K83 PolarHBondContact O-N 3.08Å; P80-D84 PolarHBondContact O-N 3.32Å
81A77.4Confident77.4Confident54 Ų5482.2 Ų82.245%0.44645%0.45SS..Hα-helixtrans-64.8-38.8176.700000111.4Q78 K83 D84 M85Q78-A81 WeakPolarHBondContact O-CB 3.27Å; Q78-A81 PolarHBondContact O-N 3.39Å; A81-K83 VanDerWaalsContact C-N 3.34Å; A81-D84 PolarHBondContact O-N 3.37Å; A81-M85 WeakPolarHBondContact O-CG 3.49Å; A81-M85 PolarHBondContact O-N 3.19Å
82L74.7Confident77.3Confident73 Ų7382.8 Ų82.838%0.38246%0.461SS..Hα-helixtrans-63.7-40.8174.5-145.496.3000111.6Q78 A79 P80 D84 M85 I86Q78-L82 PolarHBondContact O-N 3.31Å; A79-L82 PolarHBondContact O-N 3.43Å; P80-L82 VanDerWaalsContact C-N 3.32Å; P80-L82 PolarHBondContact O-N 3.14Å; L82-D84 VanDerWaalsContact C-N 3.33Å; L82-D84 PolarHBondContact O-N 3.29Å; L82-M85 HydrophobicContact CD1-CE 4.03Å; L82-M85 HydrophobicContact CG-CE 4.48Å; L82-M85 PolarHBondContact O-N 2.91Å; L82-I86 HydrophobicContact CD2-CD1 4.42Å; L82-I86 VanDerWaalsContact O-CG1 3.3Å; L82-I86 WeakPolarHBondContact O-CG1 3.02Å; L82-I86 PolarHBondContact O-N 3.42Å
83K78.2Confident77.2Confident154 Ų15483.5 Ų83.567%0.6746%0.464SS*.Hα-helixtrans-60.4-42.4176.3-178.4-170.6172-164.70111.6A79 P80 A81 I86A79-K83 WeakPolarHBondContact O-CB 3.3Å; A79-K83 PolarHBondContact O-N 3.04Å; P80-K83 WeakPolarHBondContact O-CB 3.4Å; P80-K83 PolarHBondContact O-N 3.08Å; A81-K83 VanDerWaalsContact C-N 3.34Å; K83-I86 PolarHBondContact O-N 2.86Å
84D79.8Confident76.8Confident116 Ų11687 Ų8762%0.6247%0.472SS*.Hα-helixtrans-68.1-42.5177.3-69.6-14.7000111.1P80 A81 L82 I86 G87P80-D84 PolarHBondContact O-N 3.32Å; A81-D84 PolarHBondContact O-N 3.37Å; L82-D84 VanDerWaalsContact C-N 3.33Å; L82-D84 PolarHBondContact O-N 3.29Å; D84-I86 VanDerWaalsContact C-N 3.3Å; D84-I86 PolarHBondContact O-N 3.48Å; D84-G87 PolarHBondContact O-N 3.5Å
85M75.3Confident76.3Confident116 Ų11696.1 Ų96.157%0.57150%0.504SS*.Hα-helixtrans-62.3-33.1176-74.8-172.5-68.700113.6A81 L82 G87 D88 Y89A81-M85 WeakPolarHBondContact O-CG 3.49Å; A81-M85 PolarHBondContact O-N 3.19Å; L82-M85 HydrophobicContact CD1-CE 4.03Å; L82-M85 HydrophobicContact CG-CE 4.48Å; L82-M85 PolarHBondContact O-N 2.91Å; M85-G87 PolarHBondContact O-N 2.7Å; M85-D88 PolarHBondContact O-N 2.9Å; M85-Y89 PolarHBondContact O-N 3.2Å
86I74.1Confident75.5Confident114 Ų11497.8 Ų97.859%0.58553%0.53SS*.Hα-helixtrans-64.9-29.7174.5-72.4163.8000111.2L82 K83 D84 D88 Y89L82-I86 HydrophobicContact CD2-CD1 4.42Å; L82-I86 VanDerWaalsContact O-CG1 3.3Å; L82-I86 WeakPolarHBondContact O-CG1 3.02Å; L82-I86 PolarHBondContact O-N 3.42Å; K83-I86 PolarHBondContact O-N 2.86Å; D84-I86 VanDerWaalsContact C-N 3.3Å; D84-I86 PolarHBondContact O-N 3.48Å; I86-D88 VanDerWaalsContact C-N 3.27Å; I86-D88 PolarHBondContact O-N 3.21Å; I86-Y89 VanDerWaalsContact O-CB 3.27Å; I86-Y89 WeakPolarHBondContact O-CB 3.45Å; I86-Y89 PolarHBondContact O-N 2.63Å
87G75.3Confident74.6Confident68 Ų68100 Ų10070%0.70154%0.544SS*.Hα-helixtrans-63.7-33.6174.400000113.2D84 M85 Y89D84-G87 PolarHBondContact O-N 3.5Å; M85-G87 PolarHBondContact O-N 2.7Å; G87-Y89 VanDerWaalsContact C-N 3.35Å
88D75.2Confident73.5Confident141 Ų141102.8 Ų102.875%0.75456%0.563SS**THydrogen-bonded Turntrans-89-2.1177-66.4-31.5000112.9M85 I86 D90M85-D88 PolarHBondContact O-N 2.9Å; I86-D88 VanDerWaalsContact C-N 3.27Å; I86-D88 PolarHBondContact O-N 3.21Å; D88-D90 PolarHBondContact O-N 3.39Å; D88-D90 VanDerWaalsContact O-N 3.08Å
89Y73.7Confident72.6Confident111 Ų111106.2 Ų106.244%0.43559%0.588SS.*  trans-71.1105.9-177.8-172.7-102.8000111.4M85 I86 G87 P91 M93 E94M85-Y89 PolarHBondContact O-N 3.2Å; I86-Y89 VanDerWaalsContact O-CB 3.27Å; I86-Y89 WeakPolarHBondContact O-CB 3.45Å; I86-Y89 PolarHBondContact O-N 2.63Å; G87-Y89 VanDerWaalsContact C-N 3.35Å; Y89-P91 WeakPolarHBondContact O-CD 3.27Å; Y89-M93 HydrophobicContact CD2-CE 3.94Å; Y89-M93 HydrophobicContact CE2-CE 4.41Å; Y89-E94 WeakPolarHBondContact CE1-OE1 3.39Å; Y89-E94 WeakPolarHBondContact OH-CG 3.49Å; Y89-E94 PolarHBondContact OH-OE1 3.27Å
90D74.9Confident71.7Confident82 Ų82113.3 Ų113.344%0.43963%0.627SS.*  trans-83.1114.3167.2-177.9-1.1000110.2D88 S92 M93D88-D90 PolarHBondContact O-N 3.39Å; D88-D90 VanDerWaalsContact O-N 3.08Å; D90-S92 PolarHBondContact O-N 2.89Å; D90-S92 WeakPolarHBondContact OD1-CB 3.48Å; D90-S92 PolarHBondContact OD1-N 3.27Å; D90-S92 PolarHBondContact OD1-OG 2.97Å; D90-S92 WeakPolarHBondContact OD2-CB 3.47Å; D90-S92 PolarHBondContact OD2-OG 2.54Å; D90-M93 HydrophobicContact CB-CE 4.05Å; D90-M93 HydrophobicContact CB-CG 4.4Å; D90-M93 VanDerWaalsContact N-CE 3.28Å; D90-M93 VanDerWaalsContact O-CB 3.3Å; D90-M93 WeakPolarHBondContact O-CB 3.12Å; D90-M93 WeakPolarHBondContact O-CG 3.3Å; D90-M93 PolarHBondContact O-N 3.21Å
91P73Confident71.4Confident81 Ų81115.4 Ų115.453%0.52663%0.634SS.*G310 helixtrans-56.3-19.5176.3-23.333.6000113.7Y89 M93 E94Y89-P91 WeakPolarHBondContact O-CD 3.27Å; P91-M93 PolarHBondContact O-N 3.22Å; P91-E94 WeakPolarHBondContact O-CB 2.96Å; P91-E94 PolarHBondContact O-N 3.48Å
92S75.3Confident71.1Confident71 Ų71118.6 Ų118.650%0.49764%0.644SS.*G310 helixtrans-62.2-23.7173.8-45.10000112.5D90 E94 R95D90-S92 PolarHBondContact O-N 2.89Å; D90-S92 WeakPolarHBondContact OD1-CB 3.48Å; D90-S92 PolarHBondContact OD1-N 3.27Å; D90-S92 PolarHBondContact OD1-OG 2.97Å; D90-S92 WeakPolarHBondContact OD2-CB 3.47Å; D90-S92 PolarHBondContact OD2-OG 2.54Å; S92-E94 VanDerWaalsContact C-N 3.27Å; S92-E94 PolarHBondContact O-N 3.42Å; S92-R95 PolarHBondContact O-N 3.21Å
93M75.5Confident70.9Confident109 Ų109121.1 Ų121.154%0.53766%0.659SS.*G310 helixtrans-63.7-29.7175.6-70.6-170.4-8100112.7Y89 D90 P91 R95 G96Y89-M93 HydrophobicContact CD2-CE 3.94Å; Y89-M93 HydrophobicContact CE2-CE 4.41Å; D90-M93 HydrophobicContact CB-CE 4.05Å; D90-M93 HydrophobicContact CB-CG 4.4Å; D90-M93 VanDerWaalsContact N-CE 3.28Å; D90-M93 VanDerWaalsContact O-CB 3.3Å; D90-M93 WeakPolarHBondContact O-CB 3.12Å; D90-M93 WeakPolarHBondContact O-CG 3.3Å; D90-M93 PolarHBondContact O-N 3.21Å; P91-M93 PolarHBondContact O-N 3.22Å; M93-R95 VanDerWaalsContact C-N 3.29Å; M93-R95 PolarHBondContact O-N 3.29Å; M93-G96 PolarHBondContact O-N 3.1Å
94E70.9Confident70.5Confident117 Ų117119.2 Ų119.255%0.54766%0.658SS.*G310 helixtrans-66.4-33.1176.1-62.9177.7-175.400112Y89 P91 S92 G96 I97Y89-E94 WeakPolarHBondContact CE1-OE1 3.39Å; Y89-E94 WeakPolarHBondContact OH-CG 3.49Å; Y89-E94 PolarHBondContact OH-OE1 3.27Å; P91-E94 WeakPolarHBondContact O-CB 2.96Å; P91-E94 PolarHBondContact O-N 3.48Å; S92-E94 VanDerWaalsContact C-N 3.27Å; S92-E94 PolarHBondContact O-N 3.42Å; E94-G96 PolarHBondContact O-N 3.19Å; E94-I97 PolarHBondContact O-N 2.88Å
95R69.3Low69.9Low210 Ų210119.4 Ų119.479%0.79266%0.661SS**G310 helixtrans-70-16.6-175-63.3-175175-122.7-0.5113.4S92 M93S92-R95 PolarHBondContact O-N 3.21Å; M93-R95 VanDerWaalsContact C-N 3.29Å; M93-R95 PolarHBondContact O-N 3.29Å
96G62.8Low69.6Low70 Ų70119.6 Ų119.672%0.72267%0.667SS**G310 helixtrans-76.5-20.817600000113.9M93 E94 M98M93-G96 PolarHBondContact O-N 3.1Å; E94-G96 PolarHBondContact O-N 3.19Å; G96-M98 VanDerWaalsContact C-N 3.3Å; G96-M98 PolarHBondContact O-N 3.23Å
97I61.9Low69.2Low136 Ų136120 Ų12070%0.69767%0.673SS**  trans-96.651.5-178.6-44179.7000109.6E94 V99E94-I97 PolarHBondContact O-N 2.88Å; I97-V99 VanDerWaalsContact C-N 3.33Å; I97-V99 HydrophobicContact CG2-CG2 4.09Å; I97-V99 PolarHBondContact O-N 3.48Å
98M56.6Low68.8Low158 Ų158124 Ų12478%0.77867%0.67SS**  trans-8289.3154.9-95-173.4-58.500107.3G96 T100G96-M98 VanDerWaalsContact C-N 3.3Å; G96-M98 PolarHBondContact O-N 3.23Å; M98-T100 PolarHBondContact O-N 3.05Å; M98-T100 VanDerWaalsContact O-N 3.1Å
99V62.8Low68.2Low131 Ų131122.6 Ų122.679%0.79466%0.663SS**  trans-70.1101.9160.5-178.70000105.7I97I97-V99 VanDerWaalsContact C-N 3.33Å; I97-V99 HydrophobicContact CG2-CG2 4.09Å; I97-V99 PolarHBondContact O-N 3.48Å
100T62.3Low67.7Low195 Ų195123.6 Ų123.6100%1.19668%0.684SS**  trans-75.90169.4-42.80000109.7M98M98-T100 PolarHBondContact O-N 3.05Å; M98-T100 VanDerWaalsContact O-N 3.1Å

Retrieved 100 of 100 residues in 63.6 ms (Link to these results)