A0A077Z9N6_TRITR Loading...

Zinc transporter 6

Has probably no intrinsic transporter activity but together with SLC30A5 forms a functional zinc ion:proton antiporter heterodimer, mediating zinc entry into the lumen of organelles along the secretory pathway. As part of that zinc ion:proton antiporter, contributes to zinc ion homeostasis within the early secretory pathway and regulates the activation and folding of enzymes like alkaline phosphatases and enzymes involved in phosphatidylinositol glycan anchor biosynthesis.

AlphaFold DB , UniProt , Accession A0A077Z9N6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 319 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
1M89.5Confident95.8Very high144 Ų14472.8 Ų72.871%0.70937%0.368SS*.  0-61.20-160.7169.561.600113.2L3 F4 A5 C123 T124M1-L3 PolarHBondContact O-N 3.27Å; M1-F4 WeakPolarHBondContact O-CB 3.3Å; M1-F4 PolarHBondContact O-N 3.1Å; M1-A5 PolarHBondContact O-N 2.95Å; M1-C123 WeakPolarHBondContact CE-O 3.13Å; M1-C123 VanDerWaalsContact SD-O 3.41Å; M1-T124 HydrophobicContact CE-CG2 4.05Å; M1-T124 HydrophobicContact CG-CG2 3.93Å
2K92Very high96Very high58 Ų5867.3 Ų67.325%0.25234%0.342SS..Hα-helixtrans-55-42.4-179.4-68.8-177.2177.7178.40114.7F4 A5 L6 T45 L46 L49 T124K2-F4 VanDerWaalsContact C-N 3.35Å; K2-F4 PolarHBondContact O-N 3.16Å; K2-A5 PolarHBondContact O-N 3.04Å; K2-L6 WeakPolarHBondContact O-CB 3.4Å; K2-L6 PolarHBondContact O-N 2.96Å; K2-T45 HydrophobicContact CD-CG2 3.88Å; K2-L46 HydrophobicContact CB-CD2 3.85Å; K2-L46 HydrophobicContact CB-CG 4.34Å; K2-L49 HydrophobicContact CD-CD1 4.05Å; K2-T124 HydrophobicContact CG-CG2 4.06Å
3L94.3Very high96.2Very high129 Ų12964.8 Ų64.868%0.67533%0.328SS*.Hα-helixtrans-62.2-39.8175-73168.2000112.9M1 L6 A7 L46M1-L3 PolarHBondContact O-N 3.27Å; L3-L6 PolarHBondContact O-N 3.42Å; L3-A7 PolarHBondContact O-N 3.21Å; L3-L46 HydrophobicContact CD2-CD1 4.08Å; L3-L46 HydrophobicContact CD2-CD2 4.27Å; L3-L46 HydrophobicContact CG-CD2 4.32Å
4F95.4Very high96.3Very high126 Ų12665.2 Ų65.255%0.55334%0.339SS*.Hα-helixtrans-66.6-45.5176.1173.1-100.9000111.3M1 K2 L6 A7 L8 F119M1-F4 WeakPolarHBondContact O-CB 3.3Å; M1-F4 PolarHBondContact O-N 3.1Å; K2-F4 VanDerWaalsContact C-N 3.35Å; K2-F4 PolarHBondContact O-N 3.16Å; F4-L6 VanDerWaalsContact C-N 3.28Å; F4-L6 PolarHBondContact O-N 3.24Å; F4-A7 PolarHBondContact O-N 2.91Å; F4-L8 WeakPolarHBondContact O-CB 3.33Å; F4-L8 PolarHBondContact O-N 2.81Å; F4-F119 HydrophobicContact CD1-CE1 4.1Å; F4-F119 HydrophobicContact CD1-CZ 4.14Å; F4-F119 HydrophobicContact CE1-CE1 4.12Å; F4-F119 HydrophobicContact CE1-CZ 4.05Å
5A96.1Very high96.5Very high0 Ų062.9 Ų62.90%033%0.331CS..Hα-helixtrans-59.7-39.4175.100000111.8M1 K2 L8 S9 L42 F119 V120 T124M1-A5 PolarHBondContact O-N 2.95Å; K2-A5 PolarHBondContact O-N 3.04Å; A5-L8 PolarHBondContact O-N 3.01Å; A5-S9 WeakPolarHBondContact O-CB 3.47Å; A5-S9 PolarHBondContact O-N 3.08Å; A5-S9 PolarHBondContact O-OG 2.78Å; A5-L42 HydrophobicContact CB-CD1 4.21Å; A5-L42 HydrophobicContact CB-CD2 4.49Å; A5-F119 HydrophobicContact CB-CD1 4.48Å; A5-F119 HydrophobicContact CB-CE1 3.99Å; A5-V120 HydrophobicContact CB-CG2 4.27Å; A5-T124 HydrophobicContact CB-CG2 3.81Å
6L97.4Very high96.6Very high17 Ų1759 Ų599%0.08931%0.31CS..Hα-helixtrans-64-48175.3175.964.5000111.5K2 L3 F4 L8 S9 L10 V39 L42 L43 L46K2-L6 WeakPolarHBondContact O-CB 3.4Å; K2-L6 PolarHBondContact O-N 2.96Å; L3-L6 PolarHBondContact O-N 3.42Å; F4-L6 VanDerWaalsContact C-N 3.28Å; F4-L6 PolarHBondContact O-N 3.24Å; L6-L8 VanDerWaalsContact C-N 3.3Å; L6-L8 PolarHBondContact O-N 3.31Å; L6-S9 PolarHBondContact O-N 3.41Å; L6-L10 HydrophobicContact CD1-CD1 4.07Å; L6-L10 HydrophobicContact CD1-CG 4.1Å; L6-L10 HydrophobicContact CG-CD1 3.92Å; L6-L10 HydrophobicContact CG-CG 4.39Å; L6-L10 WeakPolarHBondContact O-CB 3.48Å; L6-L10 WeakPolarHBondContact O-CG 3.37Å; L6-L10 PolarHBondContact O-N 3.46Å; L6-V39 HydrophobicContact CD1-CG1 4.18Å; L6-L42 HydrophobicContact CB-CB 4.47Å; L6-L42 HydrophobicContact CB-CD1 4.43Å; L6-L42 HydrophobicContact CD1-CB 4.12Å; L6-L43 HydrophobicContact CD1-CD2 4.01Å; L6-L43 HydrophobicContact CD1-CG 3.83Å; L6-L43 HydrophobicContact CD2-CD2 3.59Å; L6-L43 HydrophobicContact CD2-CG 4.31Å; L6-L43 HydrophobicContact CG-CD2 4.45Å; L6-L46 HydrophobicContact CB-CD1 4.27Å; L6-L46 HydrophobicContact CD2-CD1 3.62Å
7A97.8Very high96.7Very high58 Ų5859.9 Ų59.948%0.47932%0.315SS..Hα-helixtrans-59-43177.900000111.8L3 F4 L10 F11L3-A7 PolarHBondContact O-N 3.21Å; F4-A7 PolarHBondContact O-N 2.91Å; A7-L10 PolarHBondContact O-N 2.99Å; A7-F11 WeakPolarHBondContact O-CB 3.43Å; A7-F11 PolarHBondContact O-N 3.27Å
8L97.3Very high96.7Very high55 Ų5566.7 Ų66.729%0.28834%0.336SS..Hα-helixtrans-64.8-41.2176.7-171.863.4000112.1F4 A5 L6 F11 A12 V116 F119F4-L8 WeakPolarHBondContact O-CB 3.33Å; F4-L8 PolarHBondContact O-N 2.81Å; A5-L8 PolarHBondContact O-N 3.01Å; L6-L8 VanDerWaalsContact C-N 3.3Å; L6-L8 PolarHBondContact O-N 3.31Å; L8-F11 PolarHBondContact O-N 3.41Å; L8-A12 WeakPolarHBondContact O-CB 3.45Å; L8-A12 PolarHBondContact O-N 2.94Å; L8-V116 HydrophobicContact CB-CG1 4.24Å; L8-V116 HydrophobicContact CD1-CG2 3.9Å; L8-V116 HydrophobicContact CD2-CB 4.28Å; L8-V116 HydrophobicContact CD2-CG1 3.94Å; L8-V116 HydrophobicContact CD2-CG2 3.73Å; L8-V116 HydrophobicContact CG-CB 4.18Å; L8-V116 HydrophobicContact CG-CG1 3.65Å; L8-V116 HydrophobicContact CG-CG2 3.49Å; L8-V116 VanDerWaalsContact CG-CG2 3.49Å; L8-F119 HydrophobicContact CD2-CD1 4.22Å
9S97.5Very high96.8Very high1 Ų163.4 Ų63.41%0.00732%0.32CS..Hα-helixtrans-67.8-39.3177.5-56.60000112.3A5 L6 A12 F13 V120A5-S9 WeakPolarHBondContact O-CB 3.47Å; A5-S9 PolarHBondContact O-N 3.08Å; A5-S9 PolarHBondContact O-OG 2.78Å; L6-S9 PolarHBondContact O-N 3.41Å; S9-A12 PolarHBondContact O-N 2.99Å; S9-F13 VanDerWaalsContact O-CB 3.32Å; S9-F13 WeakPolarHBondContact O-CB 3.36Å; S9-F13 PolarHBondContact O-N 2.95Å; S9-V120 VanDerWaalsContact OG-CG2 3.28Å; S9-V120 WeakPolarHBondContact OG-CG2 3.47Å
10L98.3Very high96.8Very high72 Ų7261.3 Ų61.338%0.37731%0.31SS..Hα-helixtrans-62.9-44.7174.1-76.8169000110.7L6 A7 A12 F13 S14 V39L6-L10 HydrophobicContact CD1-CD1 4.07Å; L6-L10 HydrophobicContact CD1-CG 4.1Å; L6-L10 HydrophobicContact CG-CD1 3.92Å; L6-L10 HydrophobicContact CG-CG 4.39Å; L6-L10 WeakPolarHBondContact O-CB 3.48Å; L6-L10 WeakPolarHBondContact O-CG 3.37Å; L6-L10 PolarHBondContact O-N 3.46Å; A7-L10 PolarHBondContact O-N 2.99Å; L10-A12 PolarHBondContact O-N 3.38Å; L10-F13 PolarHBondContact O-N 2.85Å; L10-S14 WeakPolarHBondContact O-CB 3.46Å; L10-S14 PolarHBondContact O-N 3.43Å; L10-S14 PolarHBondContact O-OG 3.19Å; L10-S14 VanDerWaalsContact O-OG 3.12Å; L10-V39 HydrophobicContact CD2-CG1 3.56Å; L10-V39 HydrophobicContact CD2-CG2 4.45Å; L10-V39 HydrophobicContact CG-CG1 4.19Å
11F98.3Very high96.8Very high141 Ų14161.4 Ų61.462%0.61833%0.327SS*.Hα-helixtrans-61.1-44.5175.7-179.6-97.2000112.1A7 L8 S15A7-F11 WeakPolarHBondContact O-CB 3.43Å; A7-F11 PolarHBondContact O-N 3.27Å; L8-F11 PolarHBondContact O-N 3.41Å; F11-S15 WeakPolarHBondContact O-CB 3.5Å; F11-S15 PolarHBondContact O-N 3.36Å; F11-S15 PolarHBondContact O-OG 3.48Å
12A98.3Very high97.1Very high7 Ų758.9 Ų58.96%0.05831%0.313CS..Hα-helixtrans-61.9-45.8176.200000111.7L8 S9 L10 S15 L16 T35 A113 V116L8-A12 WeakPolarHBondContact O-CB 3.45Å; L8-A12 PolarHBondContact O-N 2.94Å; S9-A12 PolarHBondContact O-N 2.99Å; L10-A12 PolarHBondContact O-N 3.38Å; A12-S15 PolarHBondContact O-N 2.99Å; A12-L16 WeakPolarHBondContact O-CG 3.46Å; A12-L16 PolarHBondContact O-N 2.88Å; A12-T35 HydrophobicContact CB-CG2 4.29Å; A12-A113 HydrophobicContact CB-CB 4.06Å; A12-V116 HydrophobicContact CB-CB 4.34Å; A12-V116 HydrophobicContact CB-CG1 4.32Å; A12-V116 HydrophobicContact CB-CG2 4.3Å
13F98.5Very high97.2Very high35 Ų3556.2 Ų56.215%0.15430%0.302CS..Hα-helixtrans-62-47.2177.9177.5-114000112.3S9 L10 S15 L16 L17 A32 T35 L36 V39S9-F13 VanDerWaalsContact O-CB 3.32Å; S9-F13 WeakPolarHBondContact O-CB 3.36Å; S9-F13 PolarHBondContact O-N 2.95Å; L10-F13 PolarHBondContact O-N 2.85Å; F13-S15 VanDerWaalsContact C-N 3.31Å; F13-S15 PolarHBondContact O-N 2.8Å; F13-L16 PolarHBondContact O-N 2.58Å; F13-L17 HydrophobicContact CD1-CD1 4.17Å; F13-L17 HydrophobicContact CE1-CD1 3.5Å; F13-L17 HydrophobicContact CE1-CG 4.2Å; F13-L17 HydrophobicContact CE2-CD1 4.21Å; F13-L17 HydrophobicContact CE2-CD2 4.2Å; F13-L17 HydrophobicContact CE2-CG 4.07Å; F13-L17 HydrophobicContact CZ-CD1 3.53Å; F13-L17 HydrophobicContact CZ-CD2 4.14Å; F13-L17 HydrophobicContact CZ-CG 3.9Å; F13-L17 PolarHBondContact O-N 2.98Å; F13-A32 HydrophobicContact CD2-CB 4.39Å; F13-A32 WeakPolarHBondContact CD2-O 3.41Å; F13-A32 HydrophobicContact CE2-CB 4.19Å; F13-A32 WeakPolarHBondContact CE2-O 3.37Å; F13-T35 HydrophobicContact CB-CG2 3.95Å; F13-L36 HydrophobicContact CD2-CB 4.1Å; F13-L36 HydrophobicContact CE1-CD1 4.13Å; F13-L36 HydrophobicContact CE2-CB 3.7Å; F13-L36 HydrophobicContact CE2-CD1 4.18Å; F13-L36 HydrophobicContact CE2-CG 4.36Å; F13-L36 HydrophobicContact CZ-CB 4.22Å; F13-L36 HydrophobicContact CZ-CD1 3.86Å; F13-L36 HydrophobicContact CZ-CD2 4.46Å; F13-L36 HydrophobicContact CZ-CG 4.4Å; F13-V39 HydrophobicContact CB-CG2 4.13Å
14S98.3Very high97.3Very high70 Ų7057.2 Ų57.249%0.4930%0.3SS..Hα-helixtrans-62.5-38.3176.4-63.90000112.2L10 L16 L17 W18L10-S14 WeakPolarHBondContact O-CB 3.46Å; L10-S14 PolarHBondContact O-N 3.43Å; L10-S14 PolarHBondContact O-OG 3.19Å; L10-S14 VanDerWaalsContact O-OG 3.12Å; S14-L16 VanDerWaalsContact C-N 3.34Å; S14-L17 PolarHBondContact O-N 3.28Å; S14-W18 WeakPolarHBondContact O-CB 3.14Å; S14-W18 PolarHBondContact O-N 2.84Å
15S98.2Very high97.3Very high31 Ų3151.2 Ų51.222%0.21727%0.274CS..Hα-helixtrans-65.6-38175.9-58.90000111.9F11 A12 F13 T19F11-S15 WeakPolarHBondContact O-CB 3.5Å; F11-S15 PolarHBondContact O-N 3.36Å; F11-S15 PolarHBondContact O-OG 3.48Å; A12-S15 PolarHBondContact O-N 2.99Å; F13-S15 VanDerWaalsContact C-N 3.31Å; F13-S15 PolarHBondContact O-N 2.8Å; S15-T19 PolarHBondContact O-N 3.2Å; S15-T19 PolarHBondContact O-OG1 3.27Å
16L98.5Very high97.4Very high0 Ų052 Ų520%028%0.278CS..Hα-helixtrans-65.5-47.2174.1-74.6168.5000111.3A12 F13 S14 W18 T19 V20 V28 Y31 A32 T35 V109 P110 A113A12-L16 WeakPolarHBondContact O-CG 3.46Å; A12-L16 PolarHBondContact O-N 2.88Å; F13-L16 PolarHBondContact O-N 2.58Å; S14-L16 VanDerWaalsContact C-N 3.34Å; L16-W18 VanDerWaalsContact C-N 3.3Å; L16-W18 PolarHBondContact O-N 2.97Å; L16-T19 CarbonylContact O-C 3.57Å; L16-T19 WeakPolarHBondContact O-CA 3.43Å; L16-T19 WeakPolarHBondContact O-CB 3.46Å; L16-T19 PolarHBondContact O-N 2.95Å; L16-V20 WeakPolarHBondContact O-CG2 3.23Å; L16-V20 PolarHBondContact O-N 3.41Å; L16-V28 HydrophobicContact CD2-CG1 3.84Å; L16-Y31 HydrophobicContact CD1-CD1 4.14Å; L16-Y31 HydrophobicContact CD2-CD1 4.18Å; L16-A32 HydrophobicContact CB-CB 3.89Å; L16-A32 HydrophobicContact CD1-CB 4.44Å; L16-T35 HydrophobicContact CD1-CG2 4.28Å; L16-T35 WeakPolarHBondContact CD1-OG1 3.43Å; L16-V109 HydrophobicContact CD2-CG1 3.85Å; L16-V109 HydrophobicContact CG-CG1 4.03Å; L16-P110 HydrophobicContact CD2-CB 4.44Å; L16-P110 HydrophobicContact CD2-CG 3.86Å; L16-A113 HydrophobicContact CD1-CB 3.71Å; L16-A113 HydrophobicContact CD2-CB 4.48Å; L16-A113 HydrophobicContact CG-CB 4.2Å
17L98.1Very high97.4Very high75 Ų7551.1 Ų51.139%0.39327%0.274SS..Hα-helixtrans-59.4-40.3176.2-71.8-176.5000112.5F13 S14 T19 V20 G21 A32F13-L17 HydrophobicContact CD1-CD1 4.17Å; F13-L17 HydrophobicContact CE1-CD1 3.5Å; F13-L17 HydrophobicContact CE1-CG 4.2Å; F13-L17 HydrophobicContact CE2-CD1 4.21Å; F13-L17 HydrophobicContact CE2-CD2 4.2Å; F13-L17 HydrophobicContact CE2-CG 4.07Å; F13-L17 HydrophobicContact CZ-CD1 3.53Å; F13-L17 HydrophobicContact CZ-CD2 4.14Å; F13-L17 HydrophobicContact CZ-CG 3.9Å; F13-L17 PolarHBondContact O-N 2.98Å; S14-L17 PolarHBondContact O-N 3.28Å; L17-T19 VanDerWaalsContact C-N 3.3Å; L17-T19 PolarHBondContact O-N 3.39Å; L17-V20 PolarHBondContact O-N 3.47Å; L17-G21 PolarHBondContact O-N 3.4Å; L17-A32 HydrophobicContact CD2-CB 4.28Å
18W98Very high97.4Very high182 Ų18248.4 Ų48.469%0.68925%0.251SS*.Hα-helixtrans-58.6-45.5172.1-177.1-62.8000111.1S14 L16 G21 H22S14-W18 WeakPolarHBondContact O-CB 3.14Å; S14-W18 PolarHBondContact O-N 2.84Å; L16-W18 VanDerWaalsContact C-N 3.3Å; L16-W18 PolarHBondContact O-N 2.97Å; W18-G21 PolarHBondContact O-N 3.34Å; W18-H22 PolarHBondContact O-N 3.1Å; W18-H22 VanDerWaalsContact O-N 3.16Å
19T97.7Very high97.5Very high4 Ų448.2 Ų48.23%0.02525%0.249CC..Hα-helixtrans-62.9-44.2179.9-55.40000110.8S15 L16 L17 G21 H22 S23 V28 R105S15-T19 PolarHBondContact O-N 3.2Å; S15-T19 PolarHBondContact O-OG1 3.27Å; L16-T19 CarbonylContact O-C 3.57Å; L16-T19 WeakPolarHBondContact O-CA 3.43Å; L16-T19 WeakPolarHBondContact O-CB 3.46Å; L16-T19 PolarHBondContact O-N 2.95Å; L17-T19 VanDerWaalsContact C-N 3.3Å; L17-T19 PolarHBondContact O-N 3.39Å; T19-G21 PolarHBondContact O-N 3.47Å; T19-H22 PolarHBondContact O-N 3.37Å; T19-H22 VanDerWaalsContact O-N 3.1Å; T19-S23 WeakPolarHBondContact O-CB 3.42Å; T19-S23 PolarHBondContact O-N 3.26Å; T19-S23 PolarHBondContact O-OG 3.03Å; T19-V28 HydrophobicContact CG2-CG1 4.11Å; T19-R105 HydrophobicContact CG2-CB 4Å
20V97.5Very high97.5Very high21 Ų2148.2 Ų48.213%0.12725%0.248CC..Hα-helixtrans-56.2-47.4173.8172.80000111.3L16 L17 H22 K24 V28 H29L16-V20 WeakPolarHBondContact O-CG2 3.23Å; L16-V20 PolarHBondContact O-N 3.41Å; L17-V20 PolarHBondContact O-N 3.47Å; V20-H22 PolarHBondContact O-N 3.01Å; V20-K24 VanDerWaalsContact O-CA 3.23Å; V20-K24 WeakPolarHBondContact O-CA 3.47Å; V20-K24 PolarHBondContact O-N 2.91Å; V20-V28 HydrophobicContact CG2-CB 4.12Å; V20-V28 HydrophobicContact CG2-CG1 3.84Å; V20-H29 HydrophobicContact CG1-CB 4.11Å; V20-H29 WeakPolarHBondContact CG1-ND1 3.45Å; V20-H29 HydrophobicContact CG2-CB 3.95Å
21G96Very high97.5Very high64 Ų6444.8 Ų44.866%0.6623%0.23SC*.Hα-helixtrans-62.2-26.7179.100000113.7L17 W18 T19L17-G21 PolarHBondContact O-N 3.4Å; W18-G21 PolarHBondContact O-N 3.34Å; T19-G21 PolarHBondContact O-N 3.47Å
22H95.9Very high97.5Very high91 Ų9138.1 Ų38.142%0.42120%0.201SC..Hα-helixtrans-93.5-43.1-178.4-155.869.8000113.7W18 T19 V20W18-H22 PolarHBondContact O-N 3.1Å; W18-H22 VanDerWaalsContact O-N 3.16Å; T19-H22 PolarHBondContact O-N 3.37Å; T19-H22 VanDerWaalsContact O-N 3.1Å; V20-H22 PolarHBondContact O-N 3.01Å
23S95Very high97.6Very high2 Ų238.5 Ų38.51%0.01420%0.203CC..Hα-helixtrans-85.7-26.3-178.567.40000112.9T19 S25 V100 N101T19-S23 WeakPolarHBondContact O-CB 3.42Å; T19-S23 PolarHBondContact O-N 3.26Å; T19-S23 PolarHBondContact O-OG 3.03Å; S23-S25 PolarHBondContact O-N 3.01Å; S23-S25 WeakPolarHBondContact OG-CB 3.25Å; S23-S25 PolarHBondContact OG-N 3.24Å; S23-V100 WeakPolarHBondContact O-CG1 3.45Å; S23-N101 WeakPolarHBondContact CB-O 3.39Å; S23-N101 PolarHBondContact O-N 3.17Å
24K95.2Very high97.5Very high149 Ų14937 Ų3765%0.64820%0.196SC*.  trans58.918.2-168.1-53.4178.6180175.70114.1V20 L26V20-K24 VanDerWaalsContact O-CA 3.23Å; V20-K24 WeakPolarHBondContact O-CA 3.47Å; V20-K24 PolarHBondContact O-N 2.91Å; K24-L26 PolarHBondContact O-N 2.71Å
25S96.2Very high97.5Very high0 Ų033.7 Ų33.70%017%0.173CC..  trans-72.7126.2177.5165.40000111S23 V27 V28 H29 D197S23-S25 PolarHBondContact O-N 3.01Å; S23-S25 WeakPolarHBondContact OG-CB 3.25Å; S23-S25 PolarHBondContact OG-N 3.24Å; S25-V27 PolarHBondContact OG-N 2.96Å; S25-V28 PolarHBondContact OG-N 2.81Å; S25-H29 PolarHBondContact O-N 3.21Å; S25-D197 WeakPolarHBondContact CA-OD1 3.5Å; S25-D197 WeakPolarHBondContact CB-OD1 3.49Å; S25-D197 PolarHBondContact OG-OD1 3.15Å
26L97.2Very high97.5Very high16 Ų1633.8 Ų33.88%0.08417%0.171CC..Hα-helixtrans-74.7-30.7174.8-62.7-175000111.8K24 V28 H29 V30 V86 E89 G90 Q93 D197 C201K24-L26 PolarHBondContact O-N 2.71Å; L26-V28 VanDerWaalsContact C-N 3.33Å; L26-V28 PolarHBondContact O-N 2.99Å; L26-H29 WeakPolarHBondContact O-CA 3.34Å; L26-H29 VanDerWaalsContact O-CB 3.26Å; L26-H29 WeakPolarHBondContact O-CB 3.39Å; L26-H29 PolarHBondContact O-N 2.88Å; L26-V30 WeakPolarHBondContact O-CG2 3.36Å; L26-V30 PolarHBondContact O-N 2.87Å; L26-V86 HydrophobicContact CB-CG1 4.41Å; L26-E89 HydrophobicContact CD1-CB 4.13Å; L26-E89 HydrophobicContact CD2-CB 4.15Å; L26-G90 VanDerWaalsContact CD1-CA 3.46Å; L26-Q93 HydrophobicContact CD1-CB 4.3Å; L26-D197 PolarHBondContact N-OD1 3.04Å; L26-D197 PolarHBondContact N-OD2 3.34Å; L26-C201 HydrophobicContact CB-CB 3.75Å; L26-C201 VanDerWaalsContact CB-SG 3.53Å
27V97.9Very high97.5Very high0 Ų034 Ų340%017%0.172CC..Hα-helixtrans-58.1-47.8175173.30000110.8S25 H29 V30 Y31 I180 C181 D184 D197 L200 C201 L204S25-V27 PolarHBondContact OG-N 2.96Å; V27-H29 PolarHBondContact O-N 3.34Å; V27-V30 PolarHBondContact O-N 3.49Å; V27-Y31 PolarHBondContact O-N 3.38Å; V27-I180 HydrophobicContact CG1-CG2 3.8Å; V27-C181 HydrophobicContact CG1-CB 4.49Å; V27-D184 HydrophobicContact CG1-CB 4.43Å; V27-D184 HydrophobicContact CG2-CB 4.29Å; V27-D197 WeakPolarHBondContact CG2-O 3.48Å; V27-D197 WeakPolarHBondContact CG2-OD1 3.47Å; V27-D197 PolarHBondContact N-OD1 3.47Å; V27-D197 VanDerWaalsContact N-OD1 3.17Å; V27-L200 HydrophobicContact CG2-CB 3.7Å; V27-C201 HydrophobicContact CG2-CB 4.12Å; V27-L204 HydrophobicContact CG1-CD2 4.46Å
28V98.1Very high97.4Very high1 Ų130.8 Ų30.81%0.00616%0.155CC..Hα-helixtrans-64.5-32.9176.6-177.20000110.8L16 T19 V20 S25 L26 Y31 A32 M106 P110L16-V28 HydrophobicContact CD2-CG1 3.84Å; T19-V28 HydrophobicContact CG2-CG1 4.11Å; V20-V28 HydrophobicContact CG2-CB 4.12Å; V20-V28 HydrophobicContact CG2-CG1 3.84Å; S25-V28 PolarHBondContact OG-N 2.81Å; L26-V28 VanDerWaalsContact C-N 3.33Å; L26-V28 PolarHBondContact O-N 2.99Å; V28-Y31 PolarHBondContact O-N 3.45Å; V28-A32 PolarHBondContact O-N 2.84Å; V28-M106 HydrophobicContact CG2-CB 4.46Å; V28-M106 HydrophobicContact CG2-CG 4.45Å; V28-P110 HydrophobicContact CG1-CG 4.47Å; V28-P110 HydrophobicContact CG2-CG 4.43Å
29H98.2Very high97.4Very high51 Ų5122.3 Ų22.324%0.23612%0.123CC..Hα-helixtrans-63.5-47.9175-162123.5000111.8V20 S25 L26 V27 Y31 A32 L33 V86V20-H29 HydrophobicContact CG1-CB 4.11Å; V20-H29 WeakPolarHBondContact CG1-ND1 3.45Å; V20-H29 HydrophobicContact CG2-CB 3.95Å; S25-H29 PolarHBondContact O-N 3.21Å; L26-H29 WeakPolarHBondContact O-CA 3.34Å; L26-H29 VanDerWaalsContact O-CB 3.26Å; L26-H29 WeakPolarHBondContact O-CB 3.39Å; L26-H29 PolarHBondContact O-N 2.88Å; V27-H29 PolarHBondContact O-N 3.34Å; H29-Y31 VanDerWaalsContact C-N 3.26Å; H29-Y31 PolarHBondContact O-N 3.12Å; H29-A32 WeakPolarHBondContact O-CA 3.15Å; H29-A32 VanDerWaalsContact O-CB 3.28Å; H29-A32 WeakPolarHBondContact O-CB 3.42Å; H29-A32 PolarHBondContact O-N 3.21Å; H29-A32 VanDerWaalsContact O-N 3.1Å; H29-L33 PolarHBondContact O-N 3.05Å; H29-L33 VanDerWaalsContact O-N 3.12Å; H29-V86 WeakPolarHBondContact CD2-CG2 3.43Å
30V98.5Very high97.4Very high0 Ų023.9 Ų23.90%013%0.131CC..Hα-helixtrans-61.7-38.9175.2-172.70000110.6L26 V27 A32 L33 V34 V86 L204 A205 L208L26-V30 WeakPolarHBondContact O-CG2 3.36Å; L26-V30 PolarHBondContact O-N 2.87Å; V27-V30 PolarHBondContact O-N 3.49Å; V30-A32 VanDerWaalsContact C-N 3.28Å; V30-A32 PolarHBondContact O-N 2.83Å; V30-L33 WeakPolarHBondContact O-CA 3.27Å; V30-L33 WeakPolarHBondContact O-CB 3.32Å; V30-L33 PolarHBondContact O-N 2.85Å; V30-V34 PolarHBondContact O-N 3.37Å; V30-V86 HydrophobicContact CG2-CB 4.23Å; V30-V86 HydrophobicContact CG2-CG1 3.41Å; V30-V86 VanDerWaalsContact CG2-CG1 3.41Å; V30-L204 HydrophobicContact CB-CB 4.48Å; V30-L204 HydrophobicContact CB-CD2 3.98Å; V30-L204 HydrophobicContact CB-CG 4.07Å; V30-L204 HydrophobicContact CG1-CB 4.17Å; V30-L204 HydrophobicContact CG1-CD2 4.05Å; V30-L204 HydrophobicContact CG1-CG 3.63Å; V30-A205 HydrophobicContact CG1-CB 4.18Å; V30-A205 HydrophobicContact CG2-CB 4.02Å; V30-L208 HydrophobicContact CG1-CD2 4.07Å
31Y98.5Very high97.3Very high0 Ų023.6 Ų23.60%013%0.13CC..Hα-helixtrans-66.1-30.2176.3-156.4-112.9000113.2L16 V27 V28 H29 L33 V34 T35 P110 A113 Y114 Q117 A174 G177 W178 L204L16-Y31 HydrophobicContact CD1-CD1 4.14Å; L16-Y31 HydrophobicContact CD2-CD1 4.18Å; V27-Y31 PolarHBondContact O-N 3.38Å; V28-Y31 PolarHBondContact O-N 3.45Å; H29-Y31 VanDerWaalsContact C-N 3.26Å; H29-Y31 PolarHBondContact O-N 3.12Å; Y31-L33 VanDerWaalsContact C-N 3.34Å; Y31-V34 HydrophobicContact CD2-CB 4.47Å; Y31-V34 PolarHBondContact O-N 3.05Å; Y31-T35 PolarHBondContact O-N 3.31Å; Y31-T35 PolarHBondContact O-OG1 2.6Å; Y31-T35 VanDerWaalsContact O-OG1 3.06Å; Y31-P110 HydrophobicContact CD1-CB 3.84Å; Y31-P110 HydrophobicContact CD1-CG 4.48Å; Y31-P110 HydrophobicContact CE1-CB 3.95Å; Y31-A113 HydrophobicContact CE1-CB 4.16Å; Y31-Y114 WeakPolarHBondContact OH-CA 3.38Å; Y31-Y114 VanDerWaalsContact OH-CB 3.31Å; Y31-Y114 WeakPolarHBondContact OH-CB 3.24Å; Y31-Q117 PolarHBondContact OH-NE2 3.3Å; Y31-A174 WeakPolarHBondContact CE2-O 3.18Å; Y31-A174 PolarHBondContact OH-O 2.95Å; Y31-G177 VanDerWaalsContact CE2-C 3.42Å; Y31-W178 HydrophobicContact CE2-CB 4.48Å; Y31-W178 VanDerWaalsContact CE2-N 3.34Å; Y31-L204 HydrophobicContact CD2-CD2 4.4Å
32A98.6Very high97.3Very high1 Ų120.8 Ų20.81%0.00810%0.1CC..Hα-helixtrans-63.6-38.8169.100000111.5F13 L16 L17 V28 H29 V30 T35 L36F13-A32 HydrophobicContact CD2-CB 4.39Å; F13-A32 WeakPolarHBondContact CD2-O 3.41Å; F13-A32 HydrophobicContact CE2-CB 4.19Å; F13-A32 WeakPolarHBondContact CE2-O 3.37Å; L16-A32 HydrophobicContact CB-CB 3.89Å; L16-A32 HydrophobicContact CD1-CB 4.44Å; L17-A32 HydrophobicContact CD2-CB 4.28Å; V28-A32 PolarHBondContact O-N 2.84Å; H29-A32 WeakPolarHBondContact O-CA 3.15Å; H29-A32 VanDerWaalsContact O-CB 3.28Å; H29-A32 WeakPolarHBondContact O-CB 3.42Å; H29-A32 PolarHBondContact O-N 3.21Å; H29-A32 VanDerWaalsContact O-N 3.1Å; V30-A32 VanDerWaalsContact C-N 3.28Å; V30-A32 PolarHBondContact O-N 2.83Å; A32-T35 CarbonylContact O-C 3.59Å; A32-T35 PolarHBondContact O-N 3.3Å; A32-L36 WeakPolarHBondContact O-CB 3.36Å; A32-L36 PolarHBondContact O-N 3.17Å
33L98.5Very high97.2Very high16 Ų1620.3 Ų20.38%0.08410%0.1CC..Hα-helixtrans-65.3-37.8174-64.4175.4000112.6H29 V30 Y31 T35 L36 F37 V79 G82 A83 V86 L208H29-L33 PolarHBondContact O-N 3.05Å; H29-L33 VanDerWaalsContact O-N 3.12Å; V30-L33 WeakPolarHBondContact O-CA 3.27Å; V30-L33 WeakPolarHBondContact O-CB 3.32Å; V30-L33 PolarHBondContact O-N 2.85Å; Y31-L33 VanDerWaalsContact C-N 3.34Å; L33-T35 VanDerWaalsContact C-N 3.29Å; L33-T35 PolarHBondContact O-N 2.87Å; L33-L36 HydrophobicContact CD2-CD2 4.21Å; L33-L36 WeakPolarHBondContact O-CB 3.39Å; L33-L36 PolarHBondContact O-N 3.29Å; L33-F37 PolarHBondContact O-N 2.93Å; L33-V79 HydrophobicContact CB-CG1 4.36Å; L33-G82 VanDerWaalsContact CD1-C 3.44Å; L33-A83 HydrophobicContact CD1-CB 4.4Å; L33-V86 HydrophobicContact CD1-CG2 3.93Å; L33-L208 HydrophobicContact CB-CD2 3.92Å; L33-L208 HydrophobicContact CD1-CD2 4.46Å
34V98Very high97.1Very high2 Ų223.1 Ų23.11%0.01211%0.114CC..Hα-helixtrans-60.3-42.2171.1179.40000110.4V30 Y31 F37 H38 L173 L208V30-V34 PolarHBondContact O-N 3.37Å; Y31-V34 HydrophobicContact CD2-CB 4.47Å; Y31-V34 PolarHBondContact O-N 3.05Å; V34-F37 WeakPolarHBondContact O-CB 3.28Å; V34-F37 PolarHBondContact O-N 3.36Å; V34-H38 PolarHBondContact O-CD2 3.11Å; V34-H38 VanDerWaalsContact O-CD2 3.31Å; V34-L173 HydrophobicContact CG1-CD2 4.44Å; V34-L173 HydrophobicContact CG1-CG 4.38Å; V34-L173 HydrophobicContact CG2-CD2 4.26Å; V34-L173 HydrophobicContact CG2-CG 4.22Å; V34-L208 HydrophobicContact CG2-CD1 4.26Å; V34-L208 HydrophobicContact CG2-CD2 4.46Å
35T98.3Very high97Very high1 Ų116.8 Ų16.81%0.0069%0.088CC..Hα-helixtrans-69.5-36.9177-53.20000112.1A12 F13 L16 Y31 A32 L33 F37 H38 V39 Q117A12-T35 HydrophobicContact CB-CG2 4.29Å; F13-T35 HydrophobicContact CB-CG2 3.95Å; L16-T35 HydrophobicContact CD1-CG2 4.28Å; L16-T35 WeakPolarHBondContact CD1-OG1 3.43Å; Y31-T35 PolarHBondContact O-N 3.31Å; Y31-T35 PolarHBondContact O-OG1 2.6Å; Y31-T35 VanDerWaalsContact O-OG1 3.06Å; A32-T35 CarbonylContact O-C 3.59Å; A32-T35 PolarHBondContact O-N 3.3Å; L33-T35 VanDerWaalsContact C-N 3.29Å; L33-T35 PolarHBondContact O-N 2.87Å; T35-F37 VanDerWaalsContact C-N 3.29Å; T35-F37 PolarHBondContact O-N 3.48Å; T35-H38 WeakPolarHBondContact O-CB 3.34Å; T35-H38 PolarHBondContact O-N 3.18Å; T35-H38 VanDerWaalsContact O-N 3.09Å; T35-V39 PolarHBondContact O-N 3.19Å; T35-Q117 PolarHBondContact OG1-NE2 3.37Å
36L98.2Very high96.8Very high33 Ų3318.3 Ų18.317%0.17310%0.095CC..Hα-helixtrans-59.4-41.2175.3179.661.9000111.3F13 A32 L33 H38 V39 L40F13-L36 HydrophobicContact CD2-CB 4.1Å; F13-L36 HydrophobicContact CE1-CD1 4.13Å; F13-L36 HydrophobicContact CE2-CB 3.7Å; F13-L36 HydrophobicContact CE2-CD1 4.18Å; F13-L36 HydrophobicContact CE2-CG 4.36Å; F13-L36 HydrophobicContact CZ-CB 4.22Å; F13-L36 HydrophobicContact CZ-CD1 3.86Å; F13-L36 HydrophobicContact CZ-CD2 4.46Å; F13-L36 HydrophobicContact CZ-CG 4.4Å; A32-L36 WeakPolarHBondContact O-CB 3.36Å; A32-L36 PolarHBondContact O-N 3.17Å; L33-L36 HydrophobicContact CD2-CD2 4.21Å; L33-L36 WeakPolarHBondContact O-CB 3.39Å; L33-L36 PolarHBondContact O-N 3.29Å; L36-H38 VanDerWaalsContact C-N 3.26Å; L36-H38 PolarHBondContact O-N 3.43Å; L36-V39 PolarHBondContact O-N 3.01Å; L36-L40 HydrophobicContact CD1-CD1 4.02Å; L36-L40 HydrophobicContact CD1-CD2 4.38Å; L36-L40 HydrophobicContact CD1-CG 3.9Å; L36-L40 HydrophobicContact CD2-CD1 4.39Å; L36-L40 HydrophobicContact CG-CD1 3.82Å; L36-L40 HydrophobicContact CG-CG 4.15Å; L36-L40 WeakPolarHBondContact O-CB 3.39Å; L36-L40 WeakPolarHBondContact O-CG 3.36Å; L36-L40 PolarHBondContact O-N 3.4Å
37F97.6Very high96.6Very high4 Ų418.9 Ų18.92%0.01811%0.105CC..Hα-helixtrans-53.3-44.9173.7174-90.3000111.9L33 V34 T35 S41 V75 T76 V79 M129 I170 M212L33-F37 PolarHBondContact O-N 2.93Å; V34-F37 WeakPolarHBondContact O-CB 3.28Å; V34-F37 PolarHBondContact O-N 3.36Å; T35-F37 VanDerWaalsContact C-N 3.29Å; T35-F37 PolarHBondContact O-N 3.48Å; F37-S41 VanDerWaalsContact O-CB 3.26Å; F37-S41 WeakPolarHBondContact O-CB 3.14Å; F37-S41 PolarHBondContact O-N 3.3Å; F37-S41 PolarHBondContact O-OG 2.99Å; F37-V75 HydrophobicContact CD2-CG1 3.67Å; F37-V75 HydrophobicContact CE2-CG1 3.96Å; F37-V75 HydrophobicContact CG-CG1 4.47Å; F37-T76 HydrophobicContact CE2-CG2 3.94Å; F37-V79 HydrophobicContact CB-CG1 4.45Å; F37-V79 HydrophobicContact CB-CG2 3.98Å; F37-V79 HydrophobicContact CD2-CG2 4.45Å; F37-M129 HydrophobicContact CE1-CE 4.08Å; F37-M129 HydrophobicContact CE1-SD 4.43Å; F37-M129 HydrophobicContact CE2-CE 4.31Å; F37-M129 HydrophobicContact CZ-CE 3.46Å; F37-M129 VanDerWaalsContact CZ-CE 3.46Å; F37-M129 HydrophobicContact CZ-SD 3.8Å; F37-I170 HydrophobicContact CD1-CD1 4.45Å; F37-I170 HydrophobicContact CD1-CG2 4.06Å; F37-I170 HydrophobicContact CE1-CD1 3.37Å; F37-I170 HydrophobicContact CE1-CG1 4.48Å; F37-I170 HydrophobicContact CE1-CG2 3.86Å; F37-I170 HydrophobicContact CZ-CD1 3.52Å; F37-M212 HydrophobicContact CD1-CE 4.3Å; F37-M212 HydrophobicContact CD2-CE 3.92Å; F37-M212 HydrophobicContact CD2-SD 3.65Å; F37-M212 HydrophobicContact CE1-CE 4.36Å; F37-M212 HydrophobicContact CE2-CE 3.94Å; F37-M212 HydrophobicContact CE2-SD 3.47Å; F37-M212 WeakPolarHBondContact CE2-SD 3.43Å; F37-M212 HydrophobicContact CG-CE 4.1Å; F37-M212 HydrophobicContact CG-SD 4.42Å; F37-M212 HydrophobicContact CZ-CE 4.16Å; F37-M212 HydrophobicContact CZ-SD 4.13Å
38H96.5Very high96.2Very high9 Ų920.3 Ų20.34%0.04211%0.113CC..Hα-helixtrans-66.7-43.2177.5-74.2-71.6000112.7V34 T35 L36 S41 L42 I121V34-H38 PolarHBondContact O-CD2 3.11Å; V34-H38 VanDerWaalsContact O-CD2 3.31Å; T35-H38 WeakPolarHBondContact O-CB 3.34Å; T35-H38 PolarHBondContact O-N 3.18Å; T35-H38 VanDerWaalsContact O-N 3.09Å; L36-H38 VanDerWaalsContact C-N 3.26Å; L36-H38 PolarHBondContact O-N 3.43Å; H38-S41 PolarHBondContact O-N 2.86Å; H38-L42 WeakPolarHBondContact O-CG 3.19Å; H38-L42 PolarHBondContact O-N 3.27Å; H38-I121 VanDerWaalsContact CE1-CG1 3.46Å; H38-I121 WeakPolarHBondContact CE1-CG1 3.44Å
39V97.9Very high95.8Very high4 Ų424.1 Ų24.12%0.02413%0.132CC..Hα-helixtrans-57.4-51.3175.7170.50000110.7L6 L10 F13 T35 L36 S41 L42 L43L6-V39 HydrophobicContact CD1-CG1 4.18Å; L10-V39 HydrophobicContact CD2-CG1 3.56Å; L10-V39 HydrophobicContact CD2-CG2 4.45Å; L10-V39 HydrophobicContact CG-CG1 4.19Å; F13-V39 HydrophobicContact CB-CG2 4.13Å; T35-V39 PolarHBondContact O-N 3.19Å; L36-V39 PolarHBondContact O-N 3.01Å; V39-S41 PolarHBondContact O-N 3.26Å; V39-L42 PolarHBondContact O-N 2.91Å; V39-L43 HydrophobicContact CG1-CD1 4.07Å; V39-L43 WeakPolarHBondContact O-CG 2.95Å; V39-L43 PolarHBondContact O-N 3.46Å
40L97.1Very high95.3Very high36 Ų3627.1 Ų27.119%0.18815%0.15CC..Hα-helixtrans-66.8-38.9-178-66.7175.6000111.9L36 L42 L43 M44 V75 L78L36-L40 HydrophobicContact CD1-CD1 4.02Å; L36-L40 HydrophobicContact CD1-CD2 4.38Å; L36-L40 HydrophobicContact CD1-CG 3.9Å; L36-L40 HydrophobicContact CD2-CD1 4.39Å; L36-L40 HydrophobicContact CG-CD1 3.82Å; L36-L40 HydrophobicContact CG-CG 4.15Å; L36-L40 WeakPolarHBondContact O-CB 3.39Å; L36-L40 WeakPolarHBondContact O-CG 3.36Å; L36-L40 PolarHBondContact O-N 3.4Å; L40-L42 VanDerWaalsContact C-N 3.32Å; L40-L42 PolarHBondContact O-N 2.87Å; L40-L43 HydrophobicContact CD2-CD1 4.37Å; L40-L43 PolarHBondContact O-N 2.69Å; L40-M44 WeakPolarHBondContact O-CG 3.44Å; L40-M44 PolarHBondContact O-N 2.94Å; L40-V75 HydrophobicContact CB-CB 4.32Å; L40-V75 HydrophobicContact CB-CG1 3.71Å; L40-V75 HydrophobicContact CB-CG2 3.66Å; L40-V75 HydrophobicContact CD1-CG1 4.21Å; L40-V75 HydrophobicContact CD1-CG2 4.49Å; L40-L78 HydrophobicContact CD1-CD2 3.77Å
41S95Very high94.8Very high15 Ų1529.8 Ų29.811%0.10516%0.164CC..Hα-helixtrans-62.8-38.7175.9-62.50000112.2F37 H38 V39 T45 M129F37-S41 VanDerWaalsContact O-CB 3.26Å; F37-S41 WeakPolarHBondContact O-CB 3.14Å; F37-S41 PolarHBondContact O-N 3.3Å; F37-S41 PolarHBondContact O-OG 2.99Å; H38-S41 PolarHBondContact O-N 2.86Å; V39-S41 PolarHBondContact O-N 3.26Å; S41-T45 WeakPolarHBondContact O-CB 3.48Å; S41-T45 PolarHBondContact O-N 2.69Å; S41-T45 PolarHBondContact O-OG1 2.92Å; S41-M129 WeakPolarHBondContact OG-CE 3.37Å
42L95.9Very high94Very high6 Ų633.3 Ų33.33%0.03119%0.189CC..Hα-helixtrans-67.9-42.1173.9-76.7170.6000112.1A5 L6 H38 V39 L40 T45 L46 V120A5-L42 HydrophobicContact CB-CD1 4.21Å; A5-L42 HydrophobicContact CB-CD2 4.49Å; L6-L42 HydrophobicContact CB-CB 4.47Å; L6-L42 HydrophobicContact CB-CD1 4.43Å; L6-L42 HydrophobicContact CD1-CB 4.12Å; H38-L42 WeakPolarHBondContact O-CG 3.19Å; H38-L42 PolarHBondContact O-N 3.27Å; V39-L42 PolarHBondContact O-N 2.91Å; L40-L42 VanDerWaalsContact C-N 3.32Å; L40-L42 PolarHBondContact O-N 2.87Å; L42-T45 PolarHBondContact O-N 3.3Å; L42-L46 WeakPolarHBondContact O-CG 3.28Å; L42-L46 PolarHBondContact O-N 3.36Å; L42-V120 HydrophobicContact CD1-CG1 3.84Å; L42-V120 HydrophobicContact CD1-CG2 3.92Å; L42-V120 HydrophobicContact CD2-CG1 4.19Å; L42-V120 HydrophobicContact CG-CG1 4.04Å
43L95.6Very high93.2Very high80 Ų8043 Ų4342%0.41923%0.225SC..Hα-helixtrans-60.6-46.7175.1-76.2170.4000111.5L6 V39 L40 T45 L46 G47L6-L43 HydrophobicContact CD1-CD2 4.01Å; L6-L43 HydrophobicContact CD1-CG 3.83Å; L6-L43 HydrophobicContact CD2-CD2 3.59Å; L6-L43 HydrophobicContact CD2-CG 4.31Å; L6-L43 HydrophobicContact CG-CD2 4.45Å; V39-L43 HydrophobicContact CG1-CD1 4.07Å; V39-L43 WeakPolarHBondContact O-CG 2.95Å; V39-L43 PolarHBondContact O-N 3.46Å; L40-L43 HydrophobicContact CD2-CD1 4.37Å; L40-L43 PolarHBondContact O-N 2.69Å; L43-T45 VanDerWaalsContact C-N 3.33Å; L43-T45 PolarHBondContact O-N 2.64Å; L43-L46 PolarHBondContact O-N 3.2Å; L43-G47 PolarHBondContact O-N 3.4Å
44M92.7Very high92.2Very high62 Ų6244.7 Ų44.731%0.30524%0.236SC..Hα-helixtrans-58.1-47.3175-75.1-51.1-47.200111.1L40 L46 G47 L48 V75L40-M44 WeakPolarHBondContact O-CG 3.44Å; L40-M44 PolarHBondContact O-N 2.94Å; M44-L46 VanDerWaalsContact C-N 3.3Å; M44-L46 PolarHBondContact O-N 3.38Å; M44-G47 PolarHBondContact O-N 3.25Å; M44-L48 VanDerWaalsContact O-CG 3.24Å; M44-L48 WeakPolarHBondContact O-CG 3.42Å; M44-L48 PolarHBondContact O-N 3.04Å; M44-V75 HydrophobicContact CG-CG2 3.79Å
45T91.6Very high91.1Very high16 Ų1652.9 Ų52.910%0.09827%0.274CS..Hα-helixtrans-59.6-40.5178.1-610000112.2K2 S41 L42 L43 L49K2-T45 HydrophobicContact CD-CG2 3.88Å; S41-T45 WeakPolarHBondContact O-CB 3.48Å; S41-T45 PolarHBondContact O-N 2.69Å; S41-T45 PolarHBondContact O-OG1 2.92Å; L42-T45 PolarHBondContact O-N 3.3Å; L43-T45 VanDerWaalsContact C-N 3.33Å; L43-T45 PolarHBondContact O-N 2.64Å; T45-L49 WeakPolarHBondContact O-CG 3.37Å; T45-L49 PolarHBondContact O-N 3.37Å
46L93.3Very high89.6Confident31 Ų3156 Ų5616%0.16230%0.3CS..Hα-helixtrans-70.4-41.5176.6-75.1164.2000111.8K2 L3 L6 L42 L43 M44 L48 L49 L50K2-L46 HydrophobicContact CB-CD2 3.85Å; K2-L46 HydrophobicContact CB-CG 4.34Å; L3-L46 HydrophobicContact CD2-CD1 4.08Å; L3-L46 HydrophobicContact CD2-CD2 4.27Å; L3-L46 HydrophobicContact CG-CD2 4.32Å; L6-L46 HydrophobicContact CB-CD1 4.27Å; L6-L46 HydrophobicContact CD2-CD1 3.62Å; L42-L46 WeakPolarHBondContact O-CG 3.28Å; L42-L46 PolarHBondContact O-N 3.36Å; L43-L46 PolarHBondContact O-N 3.2Å; M44-L46 VanDerWaalsContact C-N 3.3Å; M44-L46 PolarHBondContact O-N 3.38Å; L46-L48 VanDerWaalsContact C-N 3.32Å; L46-L48 PolarHBondContact O-N 3.47Å; L46-L49 HydrophobicContact CD2-CD1 4.48Å; L46-L49 WeakPolarHBondContact O-CB 3.36Å; L46-L49 PolarHBondContact O-N 3.2Å; L46-L49 VanDerWaalsContact O-N 3.14Å; L46-L50 PolarHBondContact O-N 3.24Å
47G91.8Very high88.5Confident28 Ų2861.5 Ų61.529%0.28932%0.322SS..Hα-helixtrans-58.8-43.1175.300000112L43 M44 L49 L50 L51L43-G47 PolarHBondContact O-N 3.4Å; M44-G47 PolarHBondContact O-N 3.25Å; G47-L49 VanDerWaalsContact C-N 3.3Å; G47-L49 PolarHBondContact O-N 3.09Å; G47-L50 WeakPolarHBondContact O-CA 3.43Å; G47-L50 WeakPolarHBondContact O-CB 3.31Å; G47-L50 PolarHBondContact O-N 3.42Å; G47-L51 WeakPolarHBondContact O-CG 3.31Å; G47-L51 PolarHBondContact O-N 2.85Å
48L90.3Very high87.3Confident30 Ų3070.8 Ų70.816%0.15737%0.366CS..Hα-helixtrans-63.2-34.3175.7-68164.2000112.9M44 L46 L50 L51 S52 A67 D68M44-L48 VanDerWaalsContact O-CG 3.24Å; M44-L48 WeakPolarHBondContact O-CG 3.42Å; M44-L48 PolarHBondContact O-N 3.04Å; L46-L48 VanDerWaalsContact C-N 3.32Å; L46-L48 PolarHBondContact O-N 3.47Å; L48-L50 PolarHBondContact O-N 2.82Å; L48-L51 PolarHBondContact O-N 2.73Å; L48-S52 WeakPolarHBondContact O-CB 3.18Å; L48-S52 PolarHBondContact O-N 2.91Å; L48-A67 HydrophobicContact CD2-CB 3.75Å; L48-D68 HydrophobicContact CD1-CB 3.72Å; L48-D68 WeakPolarHBondContact CD1-OD1 3.39Å; L48-D68 HydrophobicContact CD2-CB 4Å
49L89Confident86.4Confident81 Ų8176.4 Ų76.442%0.42440%0.396SS..Hα-helixtrans-68.6-24.7173.6-69.5172.6000112.9K2 T45 L46 G47 S52K2-L49 HydrophobicContact CD-CD1 4.05Å; T45-L49 WeakPolarHBondContact O-CG 3.37Å; T45-L49 PolarHBondContact O-N 3.37Å; L46-L49 HydrophobicContact CD2-CD1 4.48Å; L46-L49 WeakPolarHBondContact O-CB 3.36Å; L46-L49 PolarHBondContact O-N 3.2Å; L46-L49 VanDerWaalsContact O-N 3.14Å; G47-L49 VanDerWaalsContact C-N 3.3Å; G47-L49 PolarHBondContact O-N 3.09Å; L49-S52 PolarHBondContact O-OG 3.48Å; L49-S52 VanDerWaalsContact O-OG 3.09Å
50L88.8Confident85.4Confident115 Ų11581.4 Ų81.460%0.60242%0.418SS*.Hα-helixtrans-79.3-43.5172.5-61174.7000110.3L46 G47 L48 S52 R53L46-L50 PolarHBondContact O-N 3.24Å; G47-L50 WeakPolarHBondContact O-CA 3.43Å; G47-L50 WeakPolarHBondContact O-CB 3.31Å; G47-L50 PolarHBondContact O-N 3.42Å; L48-L50 PolarHBondContact O-N 2.82Å; L50-S52 VanDerWaalsContact C-N 3.34Å; L50-S52 PolarHBondContact O-N 3.38Å; L50-R53 WeakPolarHBondContact O-CB 3.42Å; L50-R53 PolarHBondContact O-N 3.09Å
51L86.8Confident84.3Confident55 Ų5584.6 Ų84.629%0.28844%0.443SS..Hα-helixtrans-67.6-31.4178.7-66176.1000112.8G47 L48 R53 T54 Y64 A67G47-L51 WeakPolarHBondContact O-CG 3.31Å; G47-L51 PolarHBondContact O-N 2.85Å; L48-L51 PolarHBondContact O-N 2.73Å; L51-R53 PolarHBondContact O-N 3.38Å; L51-R53 VanDerWaalsContact O-N 3.09Å; L51-T54 WeakPolarHBondContact O-CB 3.26Å; L51-T54 PolarHBondContact O-N 3.41Å; L51-T54 PolarHBondContact O-OG1 3.15Å; L51-Y64 HydrophobicContact CB-CD2 4.08Å; L51-Y64 HydrophobicContact CB-CG 4.12Å; L51-Y64 HydrophobicContact CD1-CD1 4.01Å; L51-Y64 HydrophobicContact CD1-CG 4.1Å; L51-Y64 HydrophobicContact CD2-CD1 4.32Å; L51-Y64 HydrophobicContact CD2-CD2 4.15Å; L51-Y64 HydrophobicContact CD2-CE1 4.18Å; L51-Y64 HydrophobicContact CD2-CE2 4Å; L51-Y64 HydrophobicContact CD2-CG 4.3Å; L51-Y64 HydrophobicContact CG-CG 4.4Å; L51-A67 HydrophobicContact CD1-CB 4.31Å
52S82.8Confident83.4Confident75 Ų7588.4 Ų88.452%0.52446%0.456SS..THydrogen-bonded Turntrans-62.3-19.1177.968.40000113.5L48 L49 L50 T54L48-S52 WeakPolarHBondContact O-CB 3.18Å; L48-S52 PolarHBondContact O-N 2.91Å; L49-S52 PolarHBondContact O-OG 3.48Å; L49-S52 VanDerWaalsContact O-OG 3.09Å; L50-S52 VanDerWaalsContact C-N 3.34Å; L50-S52 PolarHBondContact O-N 3.38Å; S52-T54 VanDerWaalsContact C-N 3.32Å
53R80.6Confident82.7Confident203 Ų20392.9 Ų92.977%0.76647%0.472SS*.THydrogen-bonded Turntrans-80.4-12175.3-59.2-178.8178.5-173.1-3.4113.5L50 L51L50-R53 WeakPolarHBondContact O-CB 3.42Å; L50-R53 PolarHBondContact O-N 3.09Å; L51-R53 PolarHBondContact O-N 3.38Å; L51-R53 VanDerWaalsContact O-N 3.09Å
54T79.1Confident82.2Confident52 Ų5294.1 Ų94.132%0.31947%0.473SS..SBendtrans-80.2132.8178.162.70000110.9L51 S52 R63 Y64L51-T54 WeakPolarHBondContact O-CB 3.26Å; L51-T54 PolarHBondContact O-N 3.41Å; L51-T54 PolarHBondContact O-OG1 3.15Å; S52-T54 VanDerWaalsContact C-N 3.32Å; T54-R63 PolarHBondContact O-NH2 2.91Å; T54-Y64 HydrophobicContact CG2-CE2 4.44Å; T54-Y64 VanDerWaalsContact OG1-CD2 3.31Å; T54-Y64 WeakPolarHBondContact OG1-CD2 3.49Å; T54-Y64 VanDerWaalsContact OG1-CE2 3.28Å; T54-Y64 WeakPolarHBondContact OG1-CE2 3.31Å
55E74.1Confident81.7Confident174 Ų17493.4 Ų93.481%0.81347%0.468SS*.PPolyproline II helixtrans-74.2158.5175.1-63.7-173.8168.700111.3
56A67.9Low81.5Confident66 Ų6695.3 Ų95.355%0.54547%0.474SS..PPolyproline II helixtrans-65.7140.2174.800000110.5R63A56-R63 HydrophobicContact CB-CG 3.74Å
57K73.9Confident81.3Confident149 Ų14994.7 Ų94.765%0.64847%0.473SS*.  trans-119.1155.2172.5-69.7-176176.8-178.20109.6D59 F60K57-D59 WeakPolarHBondContact CB-OD1 3.49Å; K57-D59 PolarHBondContact O-N 3.24Å; K57-F60 CarbonylContact O-C 3.5Å; K57-F60 PolarHBondContact O-N 3.43Å
58E71.9Confident81.2Confident199 Ų19995.2 Ų95.293%0.9347%0.47SS*.THydrogen-bonded Turntrans-59.4-32.3-179.2-67-175.9166.900113.1F60E58-F60 VanDerWaalsContact C-N 3.25Å; E58-F60 PolarHBondContact O-N 3.29Å
59D79Confident81.3Confident128 Ų12893.8 Ų93.868%0.68446%0.462SS*.THydrogen-bonded Turntrans-77.9-6.1177.564-19.5000113.8K57K57-D59 WeakPolarHBondContact CB-OD1 3.49Å; K57-D59 PolarHBondContact O-N 3.24Å
60F76.5Confident81.6Confident108 Ų10894.2 Ų94.247%0.47446%0.464SS..  trans-137.371-175.6-127-93.2000111.4K57 E58 Y62 R63K57-F60 CarbonylContact O-C 3.5Å; K57-F60 PolarHBondContact O-N 3.43Å; E58-F60 VanDerWaalsContact C-N 3.25Å; E58-F60 PolarHBondContact O-N 3.29Å; F60-Y62 VanDerWaalsContact C-N 3.25Å; F60-Y62 PolarHBondContact O-N 3.2Å; F60-Y62 VanDerWaalsContact O-N 3.12Å; F60-R63 VanDerWaalsContact CD1-C 3.49Å; F60-R63 WeakPolarHBondContact CD1-O 3.4Å; F60-R63 WeakPolarHBondContact CE1-O 3.43Å; F60-R63 PolarHBondContact O-N 3.36Å
61S74.4Confident81.9Confident104 Ų10488.9 Ų88.973%0.72744%0.437SS*.THydrogen-bonded Turntrans-52.6-38.3-173-43.60000114
62Y76Confident82.3Confident94 Ų9486.7 Ų86.737%0.36943%0.426SS..THydrogen-bonded Turntrans-100.99.6179.3-61.6-65.3000114.3F60 E65 L259 E295F60-Y62 VanDerWaalsContact C-N 3.25Å; F60-Y62 PolarHBondContact O-N 3.2Å; F60-Y62 VanDerWaalsContact O-N 3.12Å; Y62-E65 WeakPolarHBondContact O-CB 3.47Å; Y62-E65 VanDerWaalsContact O-CG 3.27Å; Y62-E65 WeakPolarHBondContact O-CG 3.26Å; Y62-E65 PolarHBondContact O-N 3.43Å; Y62-L259 HydrophobicContact CD1-CD1 4.17Å; Y62-L259 HydrophobicContact CD1-CD2 3.43Å; Y62-L259 VanDerWaalsContact CD1-CD2 3.43Å; Y62-L259 HydrophobicContact CD1-CG 4.45Å; Y62-L259 HydrophobicContact CD2-CD1 4.18Å; Y62-L259 HydrophobicContact CE1-CD2 3.8Å; Y62-L259 HydrophobicContact CG-CD1 3.94Å; Y62-L259 HydrophobicContact CG-CD2 4.01Å; Y62-E295 HydrophobicContact CE1-CB 4.49Å; Y62-E295 HydrophobicContact CE1-CG 4.4Å
63R81.5Confident82.9Confident100 Ų10086 Ų8638%0.37741%0.413SS..THydrogen-bonded Turntrans51.5-151-179.1-51.7170.162.8-175.8-4.3111.6T54 A56 F60 E65T54-R63 PolarHBondContact O-NH2 2.91Å; A56-R63 HydrophobicContact CB-CG 3.74Å; F60-R63 VanDerWaalsContact CD1-C 3.49Å; F60-R63 WeakPolarHBondContact CD1-O 3.4Å; F60-R63 WeakPolarHBondContact CE1-O 3.43Å; F60-R63 PolarHBondContact O-N 3.36Å; R63-E65 PolarHBondContact O-N 2.92Å
64Y84Confident83.7Confident107 Ų10779.1 Ų79.142%0.4240%0.396SS..THydrogen-bonded Turntrans-85.226.1176.9-64-75.1000114L51 T54 R66 A67L51-Y64 HydrophobicContact CB-CD2 4.08Å; L51-Y64 HydrophobicContact CB-CG 4.12Å; L51-Y64 HydrophobicContact CD1-CD1 4.01Å; L51-Y64 HydrophobicContact CD1-CG 4.1Å; L51-Y64 HydrophobicContact CD2-CD1 4.32Å; L51-Y64 HydrophobicContact CD2-CD2 4.15Å; L51-Y64 HydrophobicContact CD2-CE1 4.18Å; L51-Y64 HydrophobicContact CD2-CE2 4Å; L51-Y64 HydrophobicContact CD2-CG 4.3Å; L51-Y64 HydrophobicContact CG-CG 4.4Å; T54-Y64 HydrophobicContact CG2-CE2 4.44Å; T54-Y64 VanDerWaalsContact OG1-CD2 3.31Å; T54-Y64 WeakPolarHBondContact OG1-CD2 3.49Å; T54-Y64 VanDerWaalsContact OG1-CE2 3.28Å; T54-Y64 WeakPolarHBondContact OG1-CE2 3.31Å; Y64-R66 VanDerWaalsContact C-N 3.27Å; Y64-R66 PolarHBondContact O-N 3.26Å; Y64-A67 HydrophobicContact CD1-CB 4.39Å; Y64-A67 WeakPolarHBondContact O-CB 3.33Å; Y64-A67 PolarHBondContact O-N 3.34Å
65E81.9Confident84.6Confident47 Ų4777 Ų7722%0.2238%0.384CS..THydrogen-bonded Turntrans-62.3-34.2-177.1-73.9-169176.700113.4Y62 R63 A67 L259 K263Y62-E65 WeakPolarHBondContact O-CB 3.47Å; Y62-E65 VanDerWaalsContact O-CG 3.27Å; Y62-E65 WeakPolarHBondContact O-CG 3.26Å; Y62-E65 PolarHBondContact O-N 3.43Å; R63-E65 PolarHBondContact O-N 2.92Å; E65-A67 VanDerWaalsContact C-N 3.31Å; E65-L259 WeakPolarHBondContact OE2-CD2 3.5Å; E65-K263 WeakPolarHBondContact OE1-CD 3.31Å; E65-K263 WeakPolarHBondContact OE1-CE 3.37Å; E65-K263 IonicContact OE1-NZ 3.64Å; E65-K263 PolarHBondContact OE1-NZ 3.18Å; E65-K263 WeakPolarHBondContact OE2-CD 3.36Å; E65-K263 IonicContact OE2-NZ 3.95Å
66R87.7Confident85.6Confident55 Ų5568.8 Ų68.821%0.20835%0.345CS..THydrogen-bonded Turntrans-78.6-11.8175.1-71.1179-174.8-102-3.2113.6Y64 D68 V69 L70 L259Y64-R66 VanDerWaalsContact C-N 3.27Å; Y64-R66 PolarHBondContact O-N 3.26Å; R66-D68 PolarHBondContact O-N 3.35Å; R66-V69 PolarHBondContact O-N 2.84Å; R66-L70 WeakPolarHBondContact O-CB 3.38Å; R66-L70 PolarHBondContact O-N 2.9Å; R66-L259 HydrophobicContact CG-CD1 4.14Å; R66-L259 VanDerWaalsContact CG-O 3.25Å; R66-L259 WeakPolarHBondContact CG-O 3.44Å; R66-L259 VanDerWaalsContact NE-CD1 3.34Å
67A89.6Confident87Confident19 Ų1969.1 Ų69.116%0.15734%0.336CS..Hα-helixtrans-63.5-31.9-173.300000112.2L48 L51 Y64 E65 G71L48-A67 HydrophobicContact CD2-CB 3.75Å; L51-A67 HydrophobicContact CD1-CB 4.31Å; Y64-A67 HydrophobicContact CD1-CB 4.39Å; Y64-A67 WeakPolarHBondContact O-CB 3.33Å; Y64-A67 PolarHBondContact O-N 3.34Å; E65-A67 VanDerWaalsContact C-N 3.31Å; A67-G71 PolarHBondContact O-N 2.99Å
68D89.6Confident88.2Confident39 Ų3966.3 Ų66.321%0.20933%0.328CS..Hα-helixtrans-69.2-44.7178.1-155.3-11.5000111.4L48 R66 G71 V72 S128 F261L48-D68 HydrophobicContact CD1-CB 3.72Å; L48-D68 WeakPolarHBondContact CD1-OD1 3.39Å; L48-D68 HydrophobicContact CD2-CB 4Å; R66-D68 PolarHBondContact O-N 3.35Å; D68-G71 PolarHBondContact O-N 3.06Å; D68-V72 WeakPolarHBondContact O-CG2 3.32Å; D68-V72 PolarHBondContact O-N 3.17Å; D68-S128 WeakPolarHBondContact OD1-CB 3.3Å; D68-S128 PolarHBondContact OD1-OG 3.14Å; D68-S128 WeakPolarHBondContact OD2-CB 3.46Å; D68-S128 PolarHBondContact OD2-OG 2.97Å; D68-F261 HydrophobicContact CB-CD2 4.27Å; D68-F261 HydrophobicContact CB-CE2 3.98Å
69V93.5Very high89.4Confident0 Ų056.9 Ų56.90%028%0.284CS..Hα-helixtrans-60.7-48.4175.2-174.50000110.8R66 G71 V72 F73 T219 I222 L223 F261R66-V69 PolarHBondContact O-N 2.84Å; V69-G71 VanDerWaalsContact C-N 3.28Å; V69-G71 PolarHBondContact O-N 3.44Å; V69-V72 PolarHBondContact O-N 2.96Å; V69-F73 WeakPolarHBondContact O-CB 3.44Å; V69-F73 PolarHBondContact O-N 3.19Å; V69-T219 HydrophobicContact CG1-CG2 4.46Å; V69-T219 WeakPolarHBondContact CG1-O 3.45Å; V69-I222 HydrophobicContact CB-CG2 4.39Å; V69-I222 HydrophobicContact CG1-CB 3.73Å; V69-I222 HydrophobicContact CG1-CD1 4.37Å; V69-I222 HydrophobicContact CG1-CG2 3.73Å; V69-I222 HydrophobicContact CG2-CG2 3.9Å; V69-L223 HydrophobicContact CB-CD2 4.33Å; V69-L223 HydrophobicContact CG1-CD2 3.95Å; V69-L223 HydrophobicContact CG1-CG 3.94Å; V69-F261 HydrophobicContact CB-CE1 4.4Å; V69-F261 HydrophobicContact CB-CZ 4.1Å; V69-F261 HydrophobicContact CG1-CE1 4.38Å; V69-F261 HydrophobicContact CG1-CZ 4.4Å; V69-F261 HydrophobicContact CG2-CD1 4.16Å; V69-F261 HydrophobicContact CG2-CD2 4.29Å; V69-F261 HydrophobicContact CG2-CE1 3.85Å; V69-F261 HydrophobicContact CG2-CE2 4.01Å; V69-F261 HydrophobicContact CG2-CG 4.37Å; V69-F261 HydrophobicContact CG2-CZ 3.8Å
70L94Very high90.3Very high90 Ų9051.4 Ų51.447%0.47125%0.254SS..Hα-helixtrans-60.8-39.7177.5-179.562.3000111.6R66 S74 L223R66-L70 WeakPolarHBondContact O-CB 3.38Å; R66-L70 PolarHBondContact O-N 2.9Å; L70-S74 VanDerWaalsContact O-CB 3.29Å; L70-S74 WeakPolarHBondContact O-CB 3.33Å; L70-S74 PolarHBondContact O-N 2.85Å; L70-S74 PolarHBondContact O-OG 3.32Å; L70-L223 HydrophobicContact CB-CD2 4.25Å; L70-L223 HydrophobicContact CD1-CD1 4.16Å; L70-L223 HydrophobicContact CD1-CD2 4.5Å
71G95Very high91.3Very high2 Ų250.8 Ų50.82%0.02126%0.255CS..Hα-helixtrans-58.9-55.6175.900000112.5A67 D68 V69 F73 S74 V75A67-G71 PolarHBondContact O-N 2.99Å; D68-G71 PolarHBondContact O-N 3.06Å; V69-G71 VanDerWaalsContact C-N 3.28Å; V69-G71 PolarHBondContact O-N 3.44Å; G71-F73 VanDerWaalsContact C-N 3.33Å; G71-F73 PolarHBondContact O-N 2.81Å; G71-S74 PolarHBondContact O-N 3.21Å; G71-V75 WeakPolarHBondContact O-CG2 3.26Å; G71-V75 PolarHBondContact O-N 3.26Å
72V94.8Very high92.4Very high9 Ų946.7 Ų46.76%0.05523%0.229CC..Hα-helixtrans-61.7-41.9179.7-179.90000111.2D68 V69 S74 V75 T76 V132 T219 F261D68-V72 WeakPolarHBondContact O-CG2 3.32Å; D68-V72 PolarHBondContact O-N 3.17Å; V69-V72 PolarHBondContact O-N 2.96Å; V72-S74 PolarHBondContact O-N 2.88Å; V72-V75 PolarHBondContact O-N 3.3Å; V72-T76 HydrophobicContact CG1-CG2 4.23Å; V72-T76 WeakPolarHBondContact O-CB 3.48Å; V72-T76 VanDerWaalsContact O-CG2 3.24Å; V72-T76 WeakPolarHBondContact O-CG2 3.5Å; V72-T76 PolarHBondContact O-N 3.5Å; V72-T76 PolarHBondContact O-OG1 3.19Å; V72-V132 HydrophobicContact CG1-CG1 4.16Å; V72-V132 HydrophobicContact CG1-CG2 4.26Å; V72-T219 HydrophobicContact CB-CG2 4Å; V72-T219 HydrophobicContact CG1-CG2 3.83Å; V72-F261 HydrophobicContact CB-CZ 4.5Å; V72-F261 HydrophobicContact CG2-CE2 4.4Å; V72-F261 HydrophobicContact CG2-CZ 4.27Å
73F96.6Very high93.5Very high61 Ų6142.2 Ų42.227%0.26821%0.211SC..Hα-helixtrans-58.5-47.4174.6-180-101.6000112V69 G71 T76 M77 A216 L223V69-F73 WeakPolarHBondContact O-CB 3.44Å; V69-F73 PolarHBondContact O-N 3.19Å; G71-F73 VanDerWaalsContact C-N 3.33Å; G71-F73 PolarHBondContact O-N 2.81Å; F73-T76 PolarHBondContact O-N 3.09Å; F73-T76 PolarHBondContact O-OG1 3.06Å; F73-M77 HydrophobicContact CD1-CG 4.42Å; F73-M77 HydrophobicContact CD2-CG 4.44Å; F73-M77 HydrophobicContact CE1-CG 3.99Å; F73-M77 HydrophobicContact CE2-CG 4.01Å; F73-M77 HydrophobicContact CZ-CG 3.76Å; F73-M77 HydrophobicContact CZ-SD 4.48Å; F73-M77 WeakPolarHBondContact O-CB 2.97Å; F73-M77 WeakPolarHBondContact O-CG 3.33Å; F73-M77 PolarHBondContact O-N 3.4Å; F73-A216 WeakPolarHBondContact CD2-O 3.49Å; F73-L223 HydrophobicContact CB-CD1 3.79Å; F73-L223 HydrophobicContact CD1-CD1 3.73Å; F73-L223 HydrophobicContact CD2-CD1 4.27Å; F73-L223 HydrophobicContact CE1-CD1 4.4Å; F73-L223 HydrophobicContact CG-CD1 3.65Å
74S96.9Very high94.2Very high58 Ų5842.2 Ų42.241%0.40622%0.219SC..Hα-helixtrans-65.4-43.5-178-57.70000112L70 G71 V72 M77 L78L70-S74 VanDerWaalsContact O-CB 3.29Å; L70-S74 WeakPolarHBondContact O-CB 3.33Å; L70-S74 PolarHBondContact O-N 2.85Å; L70-S74 PolarHBondContact O-OG 3.32Å; G71-S74 PolarHBondContact O-N 3.21Å; V72-S74 PolarHBondContact O-N 2.88Å; S74-M77 PolarHBondContact O-N 3.41Å; S74-L78 WeakPolarHBondContact O-CB 3.48Å; S74-L78 PolarHBondContact O-N 3.03Å
75V97.3Very high94.9Very high9 Ų943.3 Ų43.36%0.05523%0.226CC..Hα-helixtrans-64.8-45.6178.6172.80000111.2F37 L40 M44 G71 V72 L78 V79F37-V75 HydrophobicContact CD2-CG1 3.67Å; F37-V75 HydrophobicContact CE2-CG1 3.96Å; F37-V75 HydrophobicContact CG-CG1 4.47Å; L40-V75 HydrophobicContact CB-CB 4.32Å; L40-V75 HydrophobicContact CB-CG1 3.71Å; L40-V75 HydrophobicContact CB-CG2 3.66Å; L40-V75 HydrophobicContact CD1-CG1 4.21Å; L40-V75 HydrophobicContact CD1-CG2 4.49Å; M44-V75 HydrophobicContact CG-CG2 3.79Å; G71-V75 WeakPolarHBondContact O-CG2 3.26Å; G71-V75 PolarHBondContact O-N 3.26Å; V72-V75 PolarHBondContact O-N 3.3Å; V75-L78 PolarHBondContact O-N 3.28Å; V75-V79 WeakPolarHBondContact O-CG2 3.47Å; V75-V79 PolarHBondContact O-N 2.78Å; V75-V79 VanDerWaalsContact O-N 3.14Å
76T96.2Very high95.6Very high0 Ų041.2 Ų41.20%022%0.216CC..Hα-helixtrans-66.1-39.1179.353.40000111.9F37 V72 F73 Q80 M212 L215F37-T76 HydrophobicContact CE2-CG2 3.94Å; V72-T76 HydrophobicContact CG1-CG2 4.23Å; V72-T76 WeakPolarHBondContact O-CB 3.48Å; V72-T76 VanDerWaalsContact O-CG2 3.24Å; V72-T76 WeakPolarHBondContact O-CG2 3.5Å; V72-T76 PolarHBondContact O-N 3.5Å; V72-T76 PolarHBondContact O-OG1 3.19Å; F73-T76 PolarHBondContact O-N 3.09Å; F73-T76 PolarHBondContact O-OG1 3.06Å; T76-Q80 WeakPolarHBondContact O-CB 3.32Å; T76-Q80 VanDerWaalsContact O-CG 3.3Å; T76-Q80 WeakPolarHBondContact O-CG 3.43Å; T76-Q80 PolarHBondContact O-N 3.38Å; T76-Q80 VanDerWaalsContact O-N 3.12Å; T76-Q80 PolarHBondContact O-NE2 3.46Å; T76-M212 HydrophobicContact CG2-SD 3.99Å; T76-L215 HydrophobicContact CG2-CB 3.92Å; T76-L215 HydrophobicContact CG2-CD2 4.28Å
77M97.1Very high96Very high74 Ų7440 Ų4037%0.36522%0.215SC..Hα-helixtrans-65.1-46.2174.8-83.7-69.1112.500112.5F73 S74 V79 Q80 L81 A216F73-M77 HydrophobicContact CD1-CG 4.42Å; F73-M77 HydrophobicContact CD2-CG 4.44Å; F73-M77 HydrophobicContact CE1-CG 3.99Å; F73-M77 HydrophobicContact CE2-CG 4.01Å; F73-M77 HydrophobicContact CZ-CG 3.76Å; F73-M77 HydrophobicContact CZ-SD 4.48Å; F73-M77 WeakPolarHBondContact O-CB 2.97Å; F73-M77 WeakPolarHBondContact O-CG 3.33Å; F73-M77 PolarHBondContact O-N 3.4Å; S74-M77 PolarHBondContact O-N 3.41Å; M77-V79 VanDerWaalsContact C-N 3.34Å; M77-V79 PolarHBondContact O-N 3.04Å; M77-Q80 PolarHBondContact O-N 3.18Å; M77-L81 WeakPolarHBondContact O-CB 3.46Å; M77-L81 PolarHBondContact O-N 3.02Å; M77-A216 HydrophobicContact CE-CB 3.38Å
78L98Very high96.4Very high90 Ų9044.1 Ų44.147%0.47123%0.229SC..Hα-helixtrans-60.7-44-17917960000111.8L40 S74 V75 L81 G82L40-L78 HydrophobicContact CD1-CD2 3.77Å; S74-L78 WeakPolarHBondContact O-CB 3.48Å; S74-L78 PolarHBondContact O-N 3.03Å; V75-L78 PolarHBondContact O-N 3.28Å; L78-L81 PolarHBondContact O-N 3.35Å; L78-G82 PolarHBondContact O-N 2.92Å
79V98.2Very high96.7Very high0 Ų046 Ų460%024%0.236CC..Hα-helixtrans-69.8-36.1179.9174.10000111.4L33 F37 V75 M77 G82 A83 L208L33-V79 HydrophobicContact CB-CG1 4.36Å; F37-V79 HydrophobicContact CB-CG1 4.45Å; F37-V79 HydrophobicContact CB-CG2 3.98Å; F37-V79 HydrophobicContact CD2-CG2 4.45Å; V75-V79 WeakPolarHBondContact O-CG2 3.47Å; V75-V79 PolarHBondContact O-N 2.78Å; V75-V79 VanDerWaalsContact O-N 3.14Å; M77-V79 VanDerWaalsContact C-N 3.34Å; M77-V79 PolarHBondContact O-N 3.04Å; V79-G82 PolarHBondContact O-N 3.03Å; V79-A83 WeakPolarHBondContact O-CB 3.46Å; V79-A83 PolarHBondContact O-N 3.12Å; V79-L208 HydrophobicContact CG1-CD1 3.66Å; V79-L208 HydrophobicContact CG1-CD2 3.76Å; V79-L208 HydrophobicContact CG1-CG 4.04Å
80Q96.8Very high96.8Very high14 Ų1446 Ų467%0.06524%0.236CC..Hα-helixtrans-64-43.7172.6-79.7172.190.600112.2T76 M77 G82 A83 L84 M212T76-Q80 WeakPolarHBondContact O-CB 3.32Å; T76-Q80 VanDerWaalsContact O-CG 3.3Å; T76-Q80 WeakPolarHBondContact O-CG 3.43Å; T76-Q80 PolarHBondContact O-N 3.38Å; T76-Q80 VanDerWaalsContact O-N 3.12Å; T76-Q80 PolarHBondContact O-NE2 3.46Å; M77-Q80 PolarHBondContact O-N 3.18Å; Q80-G82 VanDerWaalsContact C-N 3.34Å; Q80-G82 PolarHBondContact O-N 3.46Å; Q80-A83 WeakPolarHBondContact O-CB 3.39Å; Q80-A83 PolarHBondContact O-N 3.3Å; Q80-L84 WeakPolarHBondContact O-CG 3.45Å; Q80-L84 PolarHBondContact O-N 3.1Å; Q80-M212 HydrophobicContact CG-CB 3.58Å; Q80-M212 PolarHBondContact NE2-O 3.15Å
81L97.8Very high96.9Very high95 Ų9546.1 Ų46.150%0.49724%0.237SC..Hα-helixtrans-59.8-46.8175-172.190.6000110.7M77 L78 A83 L84 F85M77-L81 WeakPolarHBondContact O-CB 3.46Å; M77-L81 PolarHBondContact O-N 3.02Å; L78-L81 PolarHBondContact O-N 3.35Å; L81-A83 VanDerWaalsContact C-N 3.29Å; L81-A83 PolarHBondContact O-N 3.37Å; L81-L84 WeakPolarHBondContact O-CB 3.21Å; L81-L84 PolarHBondContact O-N 3.02Å; L81-L84 VanDerWaalsContact O-N 3.17Å; L81-F85 HydrophobicContact CD1-CE2 4.42Å; L81-F85 HydrophobicContact CD2-CE2 3.91Å; L81-F85 HydrophobicContact CG-CD2 4.27Å; L81-F85 HydrophobicContact CG-CE2 3.8Å; L81-F85 WeakPolarHBondContact O-CD2 3.49Å; L81-F85 PolarHBondContact O-N 3.3Å
82G98.1Very high96.9Very high17 Ų1749 Ų4918%0.17525%0.25CS..Hα-helixtrans-56.5-43.7174.300000112.1L33 L78 V79 Q80 L84 F85 V86L33-G82 VanDerWaalsContact CD1-C 3.44Å; L78-G82 PolarHBondContact O-N 2.92Å; V79-G82 PolarHBondContact O-N 3.03Å; Q80-G82 VanDerWaalsContact C-N 3.34Å; Q80-G82 PolarHBondContact O-N 3.46Å; G82-L84 VanDerWaalsContact C-N 3.33Å; G82-L84 PolarHBondContact O-N 2.83Å; G82-F85 PolarHBondContact O-N 2.89Å; G82-V86 WeakPolarHBondContact O-CG2 3.43Å; G82-V86 PolarHBondContact O-N 3.49Å
83A98.1Very high96.9Very high0 Ų048.9 Ų48.90%025%0.249CC..Hα-helixtrans-63.5-37.217800000112.4L33 V79 Q80 L81 V86 V87 L208 I209L33-A83 HydrophobicContact CD1-CB 4.4Å; V79-A83 WeakPolarHBondContact O-CB 3.46Å; V79-A83 PolarHBondContact O-N 3.12Å; Q80-A83 WeakPolarHBondContact O-CB 3.39Å; Q80-A83 PolarHBondContact O-N 3.3Å; L81-A83 VanDerWaalsContact C-N 3.29Å; L81-A83 PolarHBondContact O-N 3.37Å; A83-V86 PolarHBondContact O-N 2.96Å; A83-V87 WeakPolarHBondContact O-CG2 3.39Å; A83-V87 PolarHBondContact O-N 3.38Å; A83-L208 HydrophobicContact CB-CD2 3.79Å; A83-L208 HydrophobicContact CB-CG 4.29Å; A83-I209 HydrophobicContact CB-CD1 4Å; A83-I209 HydrophobicContact CB-CG1 3.71Å
84L97.4Very high96.7Very high101 Ų10148.5 Ų48.553%0.52925%0.249SC..Hα-helixtrans-64.4-37.9176.1-70.8172.4000112.6Q80 L81 G82 V86 V87 K88 I209Q80-L84 WeakPolarHBondContact O-CG 3.45Å; Q80-L84 PolarHBondContact O-N 3.1Å; L81-L84 WeakPolarHBondContact O-CB 3.21Å; L81-L84 PolarHBondContact O-N 3.02Å; L81-L84 VanDerWaalsContact O-N 3.17Å; G82-L84 VanDerWaalsContact C-N 3.33Å; G82-L84 PolarHBondContact O-N 2.83Å; L84-V86 VanDerWaalsContact C-N 3.35Å; L84-V87 PolarHBondContact O-N 3.36Å; L84-K88 PolarHBondContact O-N 3.37Å; L84-I209 HydrophobicContact CD2-CD1 3.8Å; L84-I209 HydrophobicContact CG-CD1 4.23Å
85F97.7Very high96.4Very high130 Ų13052.9 Ų52.957%0.5727%0.267SS*.Hα-helixtrans-63.2-43173.5-76.6-69000111.6L81 G82 V87 K88 E89L81-F85 HydrophobicContact CD1-CE2 4.42Å; L81-F85 HydrophobicContact CD2-CE2 3.91Å; L81-F85 HydrophobicContact CG-CD2 4.27Å; L81-F85 HydrophobicContact CG-CE2 3.8Å; L81-F85 WeakPolarHBondContact O-CD2 3.49Å; L81-F85 PolarHBondContact O-N 3.3Å; G82-F85 PolarHBondContact O-N 2.89Å; F85-V87 VanDerWaalsContact C-N 3.34Å; F85-V87 PolarHBondContact O-N 3.15Å; F85-K88 WeakPolarHBondContact O-CB 2.85Å; F85-K88 PolarHBondContact O-N 3.34Å; F85-E89 PolarHBondContact O-N 3.03Å
86V96.9Very high96.1Very high2 Ų258.6 Ų58.61%0.01229%0.293CS..Hα-helixtrans-69.3-32.9177.8-178.20000111.9L26 H29 V30 L33 G82 A83 L84 K88 E89 G90 C201L26-V86 HydrophobicContact CB-CG1 4.41Å; H29-V86 WeakPolarHBondContact CD2-CG2 3.43Å; V30-V86 HydrophobicContact CG2-CB 4.23Å; V30-V86 HydrophobicContact CG2-CG1 3.41Å; V30-V86 VanDerWaalsContact CG2-CG1 3.41Å; L33-V86 HydrophobicContact CD1-CG2 3.93Å; G82-V86 WeakPolarHBondContact O-CG2 3.43Å; G82-V86 PolarHBondContact O-N 3.49Å; A83-V86 PolarHBondContact O-N 2.96Å; L84-V86 VanDerWaalsContact C-N 3.35Å; V86-K88 VanDerWaalsContact C-N 3.32Å; V86-K88 PolarHBondContact O-N 3.2Å; V86-E89 PolarHBondContact O-N 3.19Å; V86-G90 PolarHBondContact O-N 3.26Å; V86-C201 WeakPolarHBondContact CG1-SG 3.11Å
87V97.3Very high95.5Very high31 Ų3161.6 Ų61.619%0.18831%0.314CS..Hα-helixtrans-59.8-45.1170.1165.20000110.7A83 L84 F85 G90 L91 L202 A205 I209A83-V87 WeakPolarHBondContact O-CG2 3.39Å; A83-V87 PolarHBondContact O-N 3.38Å; L84-V87 PolarHBondContact O-N 3.36Å; F85-V87 VanDerWaalsContact C-N 3.34Å; F85-V87 PolarHBondContact O-N 3.15Å; V87-G90 PolarHBondContact O-N 3.04Å; V87-L91 HydrophobicContact CG1-CD1 4.26Å; V87-L91 WeakPolarHBondContact O-CG 3.43Å; V87-L91 PolarHBondContact O-N 3.17Å; V87-L202 HydrophobicContact CB-CD2 4.24Å; V87-L202 HydrophobicContact CG1-CD2 3.89Å; V87-L202 HydrophobicContact CG2-CD2 4.32Å; V87-A205 HydrophobicContact CG2-CB 3.55Å; V87-I209 HydrophobicContact CG2-CD1 4.39Å
88K97Very high94.9Very high105 Ų10562.9 Ų62.946%0.45732%0.316SS..Hα-helixtrans-59.9-48176.2176.8-81.8-164.6-169.80111L84 F85 V86 G90 L91 E92L84-K88 PolarHBondContact O-N 3.37Å; F85-K88 WeakPolarHBondContact O-CB 2.85Å; F85-K88 PolarHBondContact O-N 3.34Å; V86-K88 VanDerWaalsContact C-N 3.32Å; V86-K88 PolarHBondContact O-N 3.2Å; K88-G90 VanDerWaalsContact C-N 3.3Å; K88-G90 PolarHBondContact O-N 3.37Å; K88-L91 PolarHBondContact O-N 3.17Å; K88-E92 VanDerWaalsContact CE-CD 3.5Å; K88-E92 WeakPolarHBondContact CE-OE1 3.45Å; K88-E92 IonicContact NZ-OE1 2.69Å; K88-E92 PolarHBondContact NZ-OE1 2.98Å; K88-E92 IonicContact NZ-OE2 2.69Å; K88-E92 PolarHBondContact NZ-OE2 3.1Å; K88-E92 PolarHBondContact O-N 3.27Å; K88-E92 VanDerWaalsContact O-N 3.1Å
89E96Very high94.5Very high77 Ų7766.5 Ų66.536%0.3633%0.33SS..Hα-helixtrans-60.8-38.8176-69.9178.2-178.300112L26 F85 V86 E92 Q93L26-E89 HydrophobicContact CD1-CB 4.13Å; L26-E89 HydrophobicContact CD2-CB 4.15Å; F85-E89 PolarHBondContact O-N 3.03Å; V86-E89 PolarHBondContact O-N 3.19Å; E89-E92 PolarHBondContact O-N 3.49Å; E89-Q93 PolarHBondContact O-N 3.26Å
90G96.1Very high94.2Very high0 Ų067.7 Ų67.70%034%0.337CS..Hα-helixtrans-64.3-39.5176.200000113.2L26 V86 V87 K88 E92 Q93 I94L26-G90 VanDerWaalsContact CD1-CA 3.46Å; V86-G90 PolarHBondContact O-N 3.26Å; V87-G90 PolarHBondContact O-N 3.04Å; K88-G90 VanDerWaalsContact C-N 3.3Å; K88-G90 PolarHBondContact O-N 3.37Å; G90-E92 VanDerWaalsContact C-N 3.35Å; G90-Q93 PolarHBondContact O-N 3.49Å; G90-I94 WeakPolarHBondContact O-CG1 3.29Å; G90-I94 PolarHBondContact O-N 3.42Å
91L95.8Very high94.1Very high93 Ų9371 Ų7149%0.48736%0.356SS..Hα-helixtrans-66.1-38174.6-69.9172.3000111.9V87 K88 I94 L202V87-L91 HydrophobicContact CG1-CD1 4.26Å; V87-L91 WeakPolarHBondContact O-CG 3.43Å; V87-L91 PolarHBondContact O-N 3.17Å; K88-L91 PolarHBondContact O-N 3.17Å; L91-I94 PolarHBondContact O-N 3.42Å; L91-L202 HydrophobicContact CD2-CD1 4Å; L91-L202 HydrophobicContact CD2-CD2 4.41Å; L91-L202 HydrophobicContact CG-CD2 4.25Å
92E95.5Very high93.9Very high64 Ų6469.2 Ų69.230%0.29935%0.348SS..Hα-helixtrans-67-40.5174.8-72176.1166.500111.9K88 E89 G90 I94 L95 E96K88-E92 VanDerWaalsContact CE-CD 3.5Å; K88-E92 WeakPolarHBondContact CE-OE1 3.45Å; K88-E92 IonicContact NZ-OE1 2.69Å; K88-E92 PolarHBondContact NZ-OE1 2.98Å; K88-E92 IonicContact NZ-OE2 2.69Å; K88-E92 PolarHBondContact NZ-OE2 3.1Å; K88-E92 PolarHBondContact O-N 3.27Å; K88-E92 VanDerWaalsContact O-N 3.1Å; E89-E92 PolarHBondContact O-N 3.49Å; G90-E92 VanDerWaalsContact C-N 3.35Å; E92-I94 VanDerWaalsContact C-N 3.26Å; E92-I94 PolarHBondContact O-N 3.25Å; E92-L95 PolarHBondContact O-N 2.82Å; E92-E96 PolarHBondContact O-N 3.34Å
93Q93.6Very high93.7Very high6 Ų670.3 Ų70.33%0.02835%0.35CS..Hα-helixtrans-63.6-29.8176.9-173.8172.3-20.300112.8L26 E89 G90 L95 S97 Y98 D197 A198L26-Q93 HydrophobicContact CD1-CB 4.3Å; E89-Q93 PolarHBondContact O-N 3.26Å; G90-Q93 PolarHBondContact O-N 3.49Å; Q93-L95 VanDerWaalsContact C-N 3.28Å; Q93-L95 PolarHBondContact O-N 2.94Å; Q93-S97 WeakPolarHBondContact O-CA 3.28Å; Q93-S97 PolarHBondContact O-N 2.85Å; Q93-Y98 HydrophobicContact CB-CD2 3.75Å; Q93-Y98 HydrophobicContact CB-CE2 4.15Å; Q93-Y98 HydrophobicContact CG-CD2 3.83Å; Q93-Y98 HydrophobicContact CG-CG 4.32Å; Q93-D197 PolarHBondContact NE2-OD2 2.84Å; Q93-D197 VanDerWaalsContact NE2-OD2 3.11Å; Q93-D197 PolarHBondContact OE1-OD2 3.45Å; Q93-A198 HydrophobicContact CB-CB 4.02Å; Q93-A198 HydrophobicContact CG-CB 3.97Å
94I92.3Very high93.5Very high53 Ų5373.3 Ų73.327%0.27237%0.371SS..Hα-helixtrans-63.3-37.6172.3-69.2170.8000110.9G90 L91 E92 A198 L199 L202G90-I94 WeakPolarHBondContact O-CG1 3.29Å; G90-I94 PolarHBondContact O-N 3.42Å; L91-I94 PolarHBondContact O-N 3.42Å; E92-I94 VanDerWaalsContact C-N 3.26Å; E92-I94 PolarHBondContact O-N 3.25Å; I94-A198 HydrophobicContact CG1-CB 3.76Å; I94-L199 HydrophobicContact CD1-CD2 4.16Å; I94-L202 HydrophobicContact CD1-CD1 3.59Å
95L92.1Very high93.5Very high149 Ų14973.4 Ų73.478%0.7837%0.365SS*.Hα-helixtrans-81.2-46.2-177.6-63.2173.5000112.3E92 Q93E92-L95 PolarHBondContact O-N 2.82Å; Q93-L95 VanDerWaalsContact C-N 3.28Å; Q93-L95 PolarHBondContact O-N 2.94Å
96E89.7Confident93.4Very high130 Ų13067.3 Ų67.361%0.60734%0.338SS*.Hα-helixtrans-95.6-13.3-172.7-65.2-174.2-179.700113.7E92 Y98E92-E96 PolarHBondContact O-N 3.34Å; E96-Y98 HydrophobicContact CB-CD1 4.22Å; E96-Y98 HydrophobicContact CB-CE1 3.58Å; E96-Y98 HydrophobicContact CG-CE1 4.46Å; E96-Y98 WeakPolarHBondContact OE2-CE1 3.3Å; E96-Y98 VanDerWaalsContact OE2-CZ 3.23Å; E96-Y98 PolarHBondContact OE2-OH 3.19Å
97S84.1Confident93.4Very high63 Ų6368.8 Ų68.844%0.44135%0.347SS..  trans50.964.2177.9-63.20000113.8Q93 Q195Q93-S97 WeakPolarHBondContact O-CA 3.28Å; Q93-S97 PolarHBondContact O-N 2.85Å; S97-Q195 PolarHBondContact OG-NE2 3.41Å
98Y85.6Confident93.5Very high101 Ų10171.2 Ų71.240%0.39636%0.362SS..PPolyproline II helixtrans-62.1144.3175-53.5-44000112.7Q93 E96Q93-Y98 HydrophobicContact CB-CD2 3.75Å; Q93-Y98 HydrophobicContact CB-CE2 4.15Å; Q93-Y98 HydrophobicContact CG-CD2 3.83Å; Q93-Y98 HydrophobicContact CG-CG 4.32Å; E96-Y98 HydrophobicContact CB-CD1 4.22Å; E96-Y98 HydrophobicContact CB-CE1 3.58Å; E96-Y98 HydrophobicContact CG-CE1 4.46Å; E96-Y98 WeakPolarHBondContact OE2-CE1 3.3Å; E96-Y98 VanDerWaalsContact OE2-CZ 3.23Å; E96-Y98 PolarHBondContact OE2-OH 3.19Å
99E87.6Confident93.5Very high166 Ų16667.3 Ų67.378%0.77635%0.346SS*.PPolyproline II helixtrans-79.8123.2175.9-63.5-172.5158.300111.2
100V92.7Very high93.7Very high24 Ų2463.6 Ų63.615%0.14533%0.329CS..PPolyproline II helixtrans-93.9128.3172.9-178.60000109S23 V102 M106 L188 D197S23-V100 WeakPolarHBondContact O-CG1 3.45Å; V100-V102 PolarHBondContact O-N 2.98Å; V100-M106 HydrophobicContact CG1-CE 4.08Å; V100-M106 HydrophobicContact CG1-SD 4.23Å; V100-L188 HydrophobicContact CB-CD1 4.3Å; V100-L188 HydrophobicContact CG1-CD1 3.85Å; V100-D197 HydrophobicContact CG2-CB 3.98Å
101N94.1Very high93.8Very high85 Ų8565.5 Ų65.546%0.45534%0.341SS..  trans-83.4101.2176.8178.717.7000109.7S23 D103S23-N101 WeakPolarHBondContact CB-O 3.39Å; S23-N101 PolarHBondContact O-N 3.17Å; N101-D103 PolarHBondContact O-N 3.5Å
102V93.7Very high93.9Very high56 Ų5666 Ų6634%0.33934%0.344SS..  trans-72.5107.6-177.4-1720000109.9V100 Y185 L188V100-V102 PolarHBondContact O-N 2.98Å; V102-Y185 HydrophobicContact CG1-CD2 3.91Å; V102-Y185 HydrophobicContact CG1-CE2 3.87Å; V102-L188 HydrophobicContact CG2-CB 3.67Å; V102-L188 HydrophobicContact CG2-CD1 4.41Å
103D93.7Very high94Very high41 Ų4163 Ų6322%0.21933%0.33CS..  trans-128.1146175.1-177.81.2000109N101 R105 M106N101-D103 PolarHBondContact O-N 3.5Å; D103-R105 PolarHBondContact O-N 2.9Å; D103-R105 PolarHBondContact OD1-N 3.17Å; D103-R105 WeakPolarHBondContact OD2-CD 3.46Å; D103-R105 VanDerWaalsContact OD2-CG 3.3Å; D103-R105 WeakPolarHBondContact OD2-CG 3.49Å; D103-R105 IonicContact OD2-CZ 3.72Å; D103-R105 IonicContact OD2-NE 3.27Å; D103-R105 PolarHBondContact OD2-NE 3.44Å; D103-M106 WeakPolarHBondContact O-CB 3.49Å; D103-M106 WeakPolarHBondContact O-CG 3.22Å; D103-M106 PolarHBondContact O-N 3.18Å
104S95.1Very high94.3Very high63 Ų6364.6 Ų64.644%0.44134%0.336SS..THydrogen-bonded Turntrans-44.8-27.6169.8630000114.5M106 V107 V108S104-M106 PolarHBondContact O-N 2.87Å; S104-V107 PolarHBondContact O-N 2.67Å; S104-V108 PolarHBondContact O-N 3.33Å; S104-V108 VanDerWaalsContact O-N 3.08Å
105R96.4Very high94.5Very high102 Ų10266.8 Ų66.839%0.38535%0.347SS..Hα-helixtrans-58.6-28.8175.2-64.6179.2-170.31674.8113.4T19 D103 V107 V109 P110T19-R105 HydrophobicContact CG2-CB 4Å; D103-R105 PolarHBondContact O-N 2.9Å; D103-R105 PolarHBondContact OD1-N 3.17Å; D103-R105 WeakPolarHBondContact OD2-CD 3.46Å; D103-R105 VanDerWaalsContact OD2-CG 3.3Å; D103-R105 WeakPolarHBondContact OD2-CG 3.49Å; D103-R105 IonicContact OD2-CZ 3.72Å; D103-R105 IonicContact OD2-NE 3.27Å; D103-R105 PolarHBondContact OD2-NE 3.44Å; R105-V107 PolarHBondContact O-N 3.06Å; R105-V109 HydrophobicContact CB-CG2 4.38Å; R105-V109 WeakPolarHBondContact O-CB 3.44Å; R105-V109 PolarHBondContact O-N 2.99Å; R105-V109 VanDerWaalsContact O-N 3.1Å; R105-P110 WeakPolarHBondContact O-CD 3.39Å
106M96.5Very high94.8Very high2 Ų260.3 Ų60.31%0.0131%0.314CS..Hα-helixtrans-63-17.7175.6-64.8178.261.200113V28 V100 D103 S104 P110 Y185 L188V28-M106 HydrophobicContact CG2-CB 4.46Å; V28-M106 HydrophobicContact CG2-CG 4.45Å; V100-M106 HydrophobicContact CG1-CE 4.08Å; V100-M106 HydrophobicContact CG1-SD 4.23Å; D103-M106 WeakPolarHBondContact O-CB 3.49Å; D103-M106 WeakPolarHBondContact O-CG 3.22Å; D103-M106 PolarHBondContact O-N 3.18Å; S104-M106 PolarHBondContact O-N 2.87Å; M106-P110 WeakPolarHBondContact O-CD 3.37Å; M106-P110 VanDerWaalsContact O-CG 3.25Å; M106-P110 WeakPolarHBondContact O-CG 3.41Å; M106-Y185 HydrophobicContact CB-CD2 4.4Å; M106-L188 HydrophobicContact CE-CD1 3.63Å
107V97.6Very high95.1Very high33 Ų3354.2 Ų54.220%0.229%0.286CS..Hα-helixtrans-106.6-47.2174.8176.80000111.4S104 R105 V109 T111 I182 Y185S104-V107 PolarHBondContact O-N 2.67Å; R105-V107 PolarHBondContact O-N 3.06Å; V107-V109 PolarHBondContact O-N 2.91Å; V107-T111 VanDerWaalsContact O-CB 3.28Å; V107-T111 WeakPolarHBondContact O-CB 3.41Å; V107-T111 PolarHBondContact O-N 3.44Å; V107-T111 PolarHBondContact O-OG1 3.29Å; V107-I182 HydrophobicContact CG1-CG1 4.1Å; V107-Y185 HydrophobicContact CG2-CD1 3.61Å; V107-Y185 HydrophobicContact CG2-CD2 3.93Å; V107-Y185 HydrophobicContact CG2-CE1 4.37Å; V107-Y185 HydrophobicContact CG2-CG 3.35Å
108V98Very high95.6Very high82 Ų8253.1 Ų53.150%0.49728%0.275SS..Hα-helixtrans-62.8-46.9-173.7175.40000111.3S104 T111 L112S104-V108 PolarHBondContact O-N 3.33Å; S104-V108 VanDerWaalsContact O-N 3.08Å; V108-T111 PolarHBondContact O-N 3.25Å; V108-L112 HydrophobicContact CG1-CD1 4.22Å; V108-L112 WeakPolarHBondContact O-CG 3.45Å; V108-L112 PolarHBondContact O-N 2.96Å
109V98.4Very high96Very high23 Ų2351.3 Ų51.314%0.13927%0.269CS..Hα-helixtrans-70.8-47.3-175-179.20000111.7L16 R105 V107 T111 L112 A113L16-V109 HydrophobicContact CD2-CG1 3.85Å; L16-V109 HydrophobicContact CG-CG1 4.03Å; R105-V109 HydrophobicContact CB-CG2 4.38Å; R105-V109 WeakPolarHBondContact O-CB 3.44Å; R105-V109 PolarHBondContact O-N 2.99Å; R105-V109 VanDerWaalsContact O-N 3.1Å; V107-V109 PolarHBondContact O-N 2.91Å; V109-T111 VanDerWaalsContact C-N 3.27Å; V109-T111 PolarHBondContact O-N 3.13Å; V109-L112 PolarHBondContact O-N 3.06Å; V109-A113 WeakPolarHBondContact O-CB 3.41Å; V109-A113 PolarHBondContact O-N 3.35Å
110P98.7Very high96.3Very high0 Ų043.9 Ų43.90%024%0.235CC..Hα-helixtrans-59.3-34.5171.6-30.340.7000113.9L16 V28 Y31 R105 M106 A113 Y114 C181L16-P110 HydrophobicContact CD2-CB 4.44Å; L16-P110 HydrophobicContact CD2-CG 3.86Å; V28-P110 HydrophobicContact CG1-CG 4.47Å; V28-P110 HydrophobicContact CG2-CG 4.43Å; Y31-P110 HydrophobicContact CD1-CB 3.84Å; Y31-P110 HydrophobicContact CD1-CG 4.48Å; Y31-P110 HydrophobicContact CE1-CB 3.95Å; R105-P110 WeakPolarHBondContact O-CD 3.39Å; M106-P110 WeakPolarHBondContact O-CD 3.37Å; M106-P110 VanDerWaalsContact O-CG 3.25Å; M106-P110 WeakPolarHBondContact O-CG 3.41Å; P110-A113 PolarHBondContact O-N 3.42Å; P110-Y114 VanDerWaalsContact O-CB 3.31Å; P110-Y114 WeakPolarHBondContact O-CB 3.43Å; P110-Y114 PolarHBondContact O-N 2.89Å; P110-C181 HydrophobicContact CB-CB 3.9Å; P110-C181 HydrophobicContact CG-CB 4.1Å
111T98.5Very high96.3Very high40 Ų4043.7 Ų43.725%0.24523%0.233CC..Hα-helixtrans-65.7-44.4176.1-58.50000111.8V107 V108 V109 Y114 L115 W178V107-T111 VanDerWaalsContact O-CB 3.28Å; V107-T111 WeakPolarHBondContact O-CB 3.41Å; V107-T111 PolarHBondContact O-N 3.44Å; V107-T111 PolarHBondContact O-OG1 3.29Å; V108-T111 PolarHBondContact O-N 3.25Å; V109-T111 VanDerWaalsContact C-N 3.27Å; V109-T111 PolarHBondContact O-N 3.13Å; T111-Y114 WeakPolarHBondContact O-CB 3.46Å; T111-Y114 PolarHBondContact O-N 3.01Å; T111-L115 WeakPolarHBondContact O-CG 3.49Å; T111-L115 PolarHBondContact O-N 2.76Å; T111-W178 PolarHBondContact OG1-NE1 3.31Å
112L98.1Very high96.1Very high104 Ų10446.8 Ų46.855%0.54524%0.239SC..Hα-helixtrans-63.3-44.7174.2-69.3172.5000111.1V108 V109 Y114 L115 V116V108-L112 HydrophobicContact CG1-CD1 4.22Å; V108-L112 WeakPolarHBondContact O-CG 3.45Å; V108-L112 PolarHBondContact O-N 2.96Å; V109-L112 PolarHBondContact O-N 3.06Å; L112-Y114 VanDerWaalsContact C-N 3.32Å; L112-Y114 PolarHBondContact O-N 2.88Å; L112-L115 PolarHBondContact O-N 3.32Å; L112-V116 WeakPolarHBondContact O-CG2 3.38Å; L112-V116 PolarHBondContact O-N 3.09Å; L112-V116 VanDerWaalsContact O-N 3.09Å
113A98.6Very high96Very high1 Ų146.6 Ų46.61%0.00824%0.24CC..Hα-helixtrans-61.3-39.7177.700000112.3A12 L16 Y31 V109 P110 L115 V116 Q117A12-A113 HydrophobicContact CB-CB 4.06Å; L16-A113 HydrophobicContact CD1-CB 3.71Å; L16-A113 HydrophobicContact CD2-CB 4.48Å; L16-A113 HydrophobicContact CG-CB 4.2Å; Y31-A113 HydrophobicContact CE1-CB 4.16Å; V109-A113 WeakPolarHBondContact O-CB 3.41Å; V109-A113 PolarHBondContact O-N 3.35Å; P110-A113 PolarHBondContact O-N 3.42Å; A113-L115 PolarHBondContact O-N 3.43Å; A113-V116 WeakPolarHBondContact O-CB 3.42Å; A113-V116 PolarHBondContact O-N 2.84Å; A113-Q117 VanDerWaalsContact O-CG 3.26Å; A113-Q117 WeakPolarHBondContact O-CG 3.39Å; A113-Q117 PolarHBondContact O-N 3.38Å
114Y98.4Very high95.9Very high38 Ų3845 Ų4515%0.14923%0.231CC..Hα-helixtrans-57.6-47.6174.3172.4-122.7000111.9Y31 P110 T111 L112 V116 Q117 L118 A174 S175 W178Y31-Y114 WeakPolarHBondContact OH-CA 3.38Å; Y31-Y114 VanDerWaalsContact OH-CB 3.31Å; Y31-Y114 WeakPolarHBondContact OH-CB 3.24Å; P110-Y114 VanDerWaalsContact O-CB 3.31Å; P110-Y114 WeakPolarHBondContact O-CB 3.43Å; P110-Y114 PolarHBondContact O-N 2.89Å; T111-Y114 WeakPolarHBondContact O-CB 3.46Å; T111-Y114 PolarHBondContact O-N 3.01Å; L112-Y114 VanDerWaalsContact C-N 3.32Å; L112-Y114 PolarHBondContact O-N 2.88Å; Y114-V116 VanDerWaalsContact C-N 3.29Å; Y114-V116 PolarHBondContact O-N 3.36Å; Y114-Q117 WeakPolarHBondContact O-CB 3.24Å; Y114-Q117 PolarHBondContact O-N 3.14Å; Y114-Q117 VanDerWaalsContact O-N 3.13Å; Y114-L118 HydrophobicContact CD1-CD1 4.4Å; Y114-L118 HydrophobicContact CD2-CD2 4.49Å; Y114-L118 HydrophobicContact CD2-CG 4.16Å; Y114-L118 HydrophobicContact CE1-CD1 3.77Å; Y114-L118 HydrophobicContact CE1-CG 4.42Å; Y114-L118 HydrophobicContact CE2-CD1 3.9Å; Y114-L118 HydrophobicContact CE2-CD2 3.72Å; Y114-L118 HydrophobicContact CE2-CG 3.71Å; Y114-L118 VanDerWaalsContact CZ-CD1 3.49Å; Y114-L118 WeakPolarHBondContact O-CG 3.26Å; Y114-L118 PolarHBondContact O-N 3.44Å; Y114-A174 HydrophobicContact CD2-CB 4.3Å; Y114-A174 HydrophobicContact CE2-CB 4.48Å; Y114-S175 WeakPolarHBondContact CE2-OG 3.45Å; Y114-S175 PolarHBondContact OH-OG 3.09Å; Y114-W178 HydrophobicContact CD1-CB 4.38Å; Y114-W178 AromaticContact CD1-CD2 3.81Å; Y114-W178 HydrophobicContact CD1-CD2 3.81Å; Y114-W178 HydrophobicContact CD1-CE3 4.18Å; Y114-W178 AromaticContact CD1-CG 3.89Å; Y114-W178 HydrophobicContact CD1-CG 3.89Å; Y114-W178 HydrophobicContact CD2-CB 4.06Å; Y114-W178 HydrophobicContact CD2-CG 4.44Å; Y114-W178 HydrophobicContact CE1-CD2 4.08Å; Y114-W178 AromaticContact CE1-CE3 3.96Å; Y114-W178 HydrophobicContact CE1-CE3 3.96Å; Y114-W178 HydrophobicContact CE1-CZ3 4.37Å; Y114-W178 HydrophobicContact CG-CB 3.89Å; Y114-W178 HydrophobicContact CG-CD2 4.23Å; Y114-W178 AromaticContact CG-CG 3.83Å; Y114-W178 HydrophobicContact CG-CG 3.83Å
115L97.7Very high95.5Very high99 Ų9946.1 Ų46.152%0.51824%0.237SC..Hα-helixtrans-61.1-39.3177.2-64.1176.9000111.8T111 L112 A113 L118 F119T111-L115 WeakPolarHBondContact O-CG 3.49Å; T111-L115 PolarHBondContact O-N 2.76Å; L112-L115 PolarHBondContact O-N 3.32Å; A113-L115 PolarHBondContact O-N 3.43Å; L115-L118 PolarHBondContact O-N 3.02Å; L115-F119 WeakPolarHBondContact O-CB 3.39Å; L115-F119 PolarHBondContact O-N 3.19Å
116V97.8Very high95Very high14 Ų1442.1 Ų42.19%0.08523%0.225CC..Hα-helixtrans-63.4-44.1173.8174.70000111.2L8 A12 L112 A113 Y114 F119 V120L8-V116 HydrophobicContact CB-CG1 4.24Å; L8-V116 HydrophobicContact CD1-CG2 3.9Å; L8-V116 HydrophobicContact CD2-CB 4.28Å; L8-V116 HydrophobicContact CD2-CG1 3.94Å; L8-V116 HydrophobicContact CD2-CG2 3.73Å; L8-V116 HydrophobicContact CG-CB 4.18Å; L8-V116 HydrophobicContact CG-CG1 3.65Å; L8-V116 HydrophobicContact CG-CG2 3.49Å; L8-V116 VanDerWaalsContact CG-CG2 3.49Å; A12-V116 HydrophobicContact CB-CB 4.34Å; A12-V116 HydrophobicContact CB-CG1 4.32Å; A12-V116 HydrophobicContact CB-CG2 4.3Å; L112-V116 WeakPolarHBondContact O-CG2 3.38Å; L112-V116 PolarHBondContact O-N 3.09Å; L112-V116 VanDerWaalsContact O-N 3.09Å; A113-V116 WeakPolarHBondContact O-CB 3.42Å; A113-V116 PolarHBondContact O-N 2.84Å; Y114-V116 VanDerWaalsContact C-N 3.29Å; Y114-V116 PolarHBondContact O-N 3.36Å; V116-F119 WeakPolarHBondContact O-CB 3.37Å; V116-F119 PolarHBondContact O-N 3.21Å; V116-V120 HydrophobicContact CG1-CG2 4.41Å; V116-V120 VanDerWaalsContact O-CG2 3.3Å; V116-V120 WeakPolarHBondContact O-CG2 3.45Å; V116-V120 PolarHBondContact O-N 2.92Å
117Q96.5Very high94.6Very high2 Ų250.4 Ų50.41%0.00926%0.256CS..Hα-helixtrans-62.4-44.8178.2-69.3169.347.300111.4Y31 T35 A113 Y114 F119 V120 I121 A174Y31-Q117 PolarHBondContact OH-NE2 3.3Å; T35-Q117 PolarHBondContact OG1-NE2 3.37Å; A113-Q117 VanDerWaalsContact O-CG 3.26Å; A113-Q117 WeakPolarHBondContact O-CG 3.39Å; A113-Q117 PolarHBondContact O-N 3.38Å; Y114-Q117 WeakPolarHBondContact O-CB 3.24Å; Y114-Q117 PolarHBondContact O-N 3.14Å; Y114-Q117 VanDerWaalsContact O-N 3.13Å; Q117-F119 VanDerWaalsContact C-N 3.33Å; Q117-F119 PolarHBondContact O-N 3.34Å; Q117-V120 PolarHBondContact O-N 2.82Å; Q117-I121 WeakPolarHBondContact O-CD1 3.37Å; Q117-I121 VanDerWaalsContact O-CG1 3.22Å; Q117-I121 WeakPolarHBondContact O-CG1 3.41Å; Q117-I121 PolarHBondContact O-N 2.86Å; Q117-A174 HydrophobicContact CB-CB 4.33Å
118L94.4Very high94.1Very high39 Ų3949.3 Ų49.320%0.20425%0.25CC..Hα-helixtrans-59.5-44.6174-67.4-175.5000111.7Y114 L115 V120 I121 Y122Y114-L118 HydrophobicContact CD1-CD1 4.4Å; Y114-L118 HydrophobicContact CD2-CD2 4.49Å; Y114-L118 HydrophobicContact CD2-CG 4.16Å; Y114-L118 HydrophobicContact CE1-CD1 3.77Å; Y114-L118 HydrophobicContact CE1-CG 4.42Å; Y114-L118 HydrophobicContact CE2-CD1 3.9Å; Y114-L118 HydrophobicContact CE2-CD2 3.72Å; Y114-L118 HydrophobicContact CE2-CG 3.71Å; Y114-L118 VanDerWaalsContact CZ-CD1 3.49Å; Y114-L118 WeakPolarHBondContact O-CG 3.26Å; Y114-L118 PolarHBondContact O-N 3.44Å; L115-L118 PolarHBondContact O-N 3.02Å; L118-V120 VanDerWaalsContact C-N 3.32Å; L118-V120 PolarHBondContact O-N 3.32Å; L118-I121 PolarHBondContact O-N 3.44Å; L118-Y122 HydrophobicContact CB-CD2 4.46Å; L118-Y122 HydrophobicContact CD2-CE2 4.07Å; L118-Y122 VanDerWaalsContact O-CD2 3.25Å; L118-Y122 WeakPolarHBondContact O-CD2 3.31Å; L118-Y122 PolarHBondContact O-N 2.9Å
119F94.5Very high93.6Very high64 Ų6446 Ų4628%0.28123%0.229SC..Hα-helixtrans-58.4-44.7175175.1-97.7000111.4F4 A5 L8 L115 V116 Q117 C123F4-F119 HydrophobicContact CD1-CE1 4.1Å; F4-F119 HydrophobicContact CD1-CZ 4.14Å; F4-F119 HydrophobicContact CE1-CE1 4.12Å; F4-F119 HydrophobicContact CE1-CZ 4.05Å; A5-F119 HydrophobicContact CB-CD1 4.48Å; A5-F119 HydrophobicContact CB-CE1 3.99Å; L8-F119 HydrophobicContact CD2-CD1 4.22Å; L115-F119 WeakPolarHBondContact O-CB 3.39Å; L115-F119 PolarHBondContact O-N 3.19Å; V116-F119 WeakPolarHBondContact O-CB 3.37Å; V116-F119 PolarHBondContact O-N 3.21Å; Q117-F119 VanDerWaalsContact C-N 3.33Å; Q117-F119 PolarHBondContact O-N 3.34Å; F119-C123 HydrophobicContact CD2-CB 3.87Å; F119-C123 VanDerWaalsContact CD2-SG 3.5Å; F119-C123 HydrophobicContact CE2-CB 3.7Å; F119-C123 HydrophobicContact CG-CB 4.38Å; F119-C123 HydrophobicContact CZ-CB 4.08Å; F119-C123 WeakPolarHBondContact O-CA 3.28Å; F119-C123 WeakPolarHBondContact O-CB 3.44Å; F119-C123 PolarHBondContact O-N 3Å
120V94.1Very high93.1Very high9 Ų947 Ų476%0.05524%0.237CC..Hα-helixtrans-62.3-47.2178170.70000111.4A5 S9 L42 V116 Q117 L118 T124A5-V120 HydrophobicContact CB-CG2 4.27Å; S9-V120 VanDerWaalsContact OG-CG2 3.28Å; S9-V120 WeakPolarHBondContact OG-CG2 3.47Å; L42-V120 HydrophobicContact CD1-CG1 3.84Å; L42-V120 HydrophobicContact CD1-CG2 3.92Å; L42-V120 HydrophobicContact CD2-CG1 4.19Å; L42-V120 HydrophobicContact CG-CG1 4.04Å; V116-V120 HydrophobicContact CG1-CG2 4.41Å; V116-V120 VanDerWaalsContact O-CG2 3.3Å; V116-V120 WeakPolarHBondContact O-CG2 3.45Å; V116-V120 PolarHBondContact O-N 2.92Å; Q117-V120 PolarHBondContact O-N 2.82Å; L118-V120 VanDerWaalsContact C-N 3.32Å; L118-V120 PolarHBondContact O-N 3.32Å; V120-T124 VanDerWaalsContact CA-OG1 3.29Å; V120-T124 WeakPolarHBondContact CA-OG1 3.33Å; V120-T124 CarbonylContact O-C 3.57Å; V120-T124 WeakPolarHBondContact O-CA 3.41Å; V120-T124 PolarHBondContact O-N 3Å; V120-T124 PolarHBondContact O-OG1 2.74Å
121I91.6Very high92.6Very high21 Ų2149.9 Ų49.911%0.10825%0.25CS..Hα-helixtrans-62.3-47.7-176.9-68.8164.7000110.8H38 Q117 L118 A171H38-I121 VanDerWaalsContact CE1-CG1 3.46Å; H38-I121 WeakPolarHBondContact CE1-CG1 3.44Å; Q117-I121 WeakPolarHBondContact O-CD1 3.37Å; Q117-I121 VanDerWaalsContact O-CG1 3.22Å; Q117-I121 WeakPolarHBondContact O-CG1 3.41Å; Q117-I121 PolarHBondContact O-N 2.86Å; L118-I121 PolarHBondContact O-N 3.44Å; I121-A171 HydrophobicContact CD1-CB 3.95Å; I121-A171 HydrophobicContact CG2-CB 4.42Å
122Y90.3Very high92.2Very high150 Ų15048 Ų4859%0.58824%0.239SC*.Hα-helixtrans-91.3-33.4-172.4-66.6-63.4000113.9L118L118-Y122 HydrophobicContact CB-CD2 4.46Å; L118-Y122 HydrophobicContact CD2-CE2 4.07Å; L118-Y122 VanDerWaalsContact O-CD2 3.25Å; L118-Y122 WeakPolarHBondContact O-CD2 3.31Å; L118-Y122 PolarHBondContact O-N 2.9Å
123C91Very high91.7Very high51 Ų5143.2 Ų43.235%0.34521%0.214SC..Hα-helixtrans-94-20.7-177.3-55.40000113M1 F119 P125M1-C123 WeakPolarHBondContact CE-O 3.13Å; M1-C123 VanDerWaalsContact SD-O 3.41Å; F119-C123 HydrophobicContact CD2-CB 3.87Å; F119-C123 VanDerWaalsContact CD2-SG 3.5Å; F119-C123 HydrophobicContact CE2-CB 3.7Å; F119-C123 HydrophobicContact CG-CB 4.38Å; F119-C123 HydrophobicContact CZ-CB 4.08Å; F119-C123 WeakPolarHBondContact O-CA 3.28Å; F119-C123 WeakPolarHBondContact O-CB 3.44Å; F119-C123 PolarHBondContact O-N 3Å; C123-P125 WeakPolarHBondContact O-CD 3.37Å
124T91.7Very high91Very high8 Ų847.4 Ų47.45%0.04924%0.236CC..SBendtrans-122.363.3177.540.80000112.8M1 K2 A5 V120 S126M1-T124 HydrophobicContact CE-CG2 4.05Å; M1-T124 HydrophobicContact CG-CG2 3.93Å; K2-T124 HydrophobicContact CG-CG2 4.06Å; A5-T124 HydrophobicContact CB-CG2 3.81Å; V120-T124 VanDerWaalsContact CA-OG1 3.29Å; V120-T124 WeakPolarHBondContact CA-OG1 3.33Å; V120-T124 CarbonylContact O-C 3.57Å; V120-T124 WeakPolarHBondContact O-CA 3.41Å; V120-T124 PolarHBondContact O-N 3Å; V120-T124 PolarHBondContact O-OG1 2.74Å; T124-S126 PolarHBondContact O-N 3.41Å
125P86.7Confident90.3Very high86 Ų8647.2 Ų47.256%0.55824%0.243SC*.  trans-61.3137.5178.427.4-34.8000111C123C123-P125 WeakPolarHBondContact O-CD 3.37Å
126S86.1Confident89.6Confident18 Ų1843.2 Ų43.213%0.12622%0.223CC..  trans-115.9125.8173.755.30000109.4T124 S128 M129 S130T124-S126 PolarHBondContact O-N 3.41Å; S126-S128 VanDerWaalsContact C-N 3.27Å; S126-S128 PolarHBondContact O-N 2.93Å; S126-M129 PolarHBondContact O-N 2.91Å; S126-M129 WeakPolarHBondContact OG-CB 3.43Å; S126-S130 PolarHBondContact O-N 3.31Å; S126-S130 PolarHBondContact O-OG 2.94Å
127R87.2Confident88Confident177 Ų17743.9 Ų43.967%0.66823%0.228SC*.Hα-helixtrans-54.9-42.9-176.9-168.3174.8-171.4-160.9-8.1112.2H131 E262R127-H131 WeakPolarHBondContact O-CB 3.33Å; R127-H131 PolarHBondContact O-N 3.19Å; R127-E262 WeakPolarHBondContact CD-OE1 3.46Å; R127-E262 IonicContact CZ-OE1 2.7Å; R127-E262 IonicContact CZ-OE2 2.64Å; R127-E262 IonicContact NE-OE1 2.84Å; R127-E262 PolarHBondContact NE-OE1 3.46Å; R127-E262 IonicContact NE-OE2 2.76Å; R127-E262 IonicContact NH1-OE1 3.25Å; R127-E262 PolarHBondContact NH1-OE1 3.07Å; R127-E262 IonicContact NH1-OE2 2.82Å; R127-E262 PolarHBondContact NH1-OE2 3.36Å; R127-E262 IonicContact NH2-OE1 2.75Å; R127-E262 PolarHBondContact NH2-OE1 2.62Å; R127-E262 IonicContact NH2-OE2 2.99Å; R127-E262 PolarHBondContact NH2-OE2 2.95Å
128S87.5Confident86.2Confident9 Ų947 Ų476%0.06325%0.25CS..Hα-helixtrans-63.7-50.4177.641.10000113.9D68 S126 S130 H131 V132 F261D68-S128 WeakPolarHBondContact OD1-CB 3.3Å; D68-S128 PolarHBondContact OD1-OG 3.14Å; D68-S128 WeakPolarHBondContact OD2-CB 3.46Å; D68-S128 PolarHBondContact OD2-OG 2.97Å; S126-S128 VanDerWaalsContact C-N 3.27Å; S126-S128 PolarHBondContact O-N 2.93Å; S128-S130 VanDerWaalsContact C-N 3.31Å; S128-S130 PolarHBondContact O-N 3.45Å; S128-H131 WeakPolarHBondContact O-CB 3.27Å; S128-H131 PolarHBondContact O-N 3.47Å; S128-H131 VanDerWaalsContact O-N 3.15Å; S128-V132 WeakPolarHBondContact O-CG2 3.34Å; S128-V132 PolarHBondContact O-N 2.92Å; S128-F261 VanDerWaalsContact CB-CE2 3.43Å
129M88.7Confident84.3Confident13 Ų1351.6 Ų51.66%0.06428%0.275CS..Hα-helixtrans-60.1-44.1178.5-165.759.266.400111.2F37 S41 S126 H131 V132 I133 I170 L215F37-M129 HydrophobicContact CE1-CE 4.08Å; F37-M129 HydrophobicContact CE1-SD 4.43Å; F37-M129 HydrophobicContact CE2-CE 4.31Å; F37-M129 HydrophobicContact CZ-CE 3.46Å; F37-M129 VanDerWaalsContact CZ-CE 3.46Å; F37-M129 HydrophobicContact CZ-SD 3.8Å; S41-M129 WeakPolarHBondContact OG-CE 3.37Å; S126-M129 PolarHBondContact O-N 2.91Å; S126-M129 WeakPolarHBondContact OG-CB 3.43Å; M129-H131 VanDerWaalsContact C-N 3.31Å; M129-H131 PolarHBondContact O-N 3.41Å; M129-V132 PolarHBondContact O-N 2.81Å; M129-I133 HydrophobicContact CG-CD1 3.63Å; M129-I133 HydrophobicContact CG-CG1 4.31Å; M129-I133 VanDerWaalsContact O-CB 3.28Å; M129-I133 WeakPolarHBondContact O-CB 3.29Å; M129-I133 WeakPolarHBondContact O-CD1 3.37Å; M129-I133 WeakPolarHBondContact O-CG1 3.5Å; M129-I133 PolarHBondContact O-N 2.98Å; M129-I133 HydrophobicContact SD-CD1 4.08Å; M129-I133 HydrophobicContact SD-CG1 4.29Å; M129-I170 HydrophobicContact CG-CD1 4.19Å; M129-I170 HydrophobicContact SD-CD1 3.76Å; M129-L215 HydrophobicContact SD-CD2 4.34Å
130S88.1Confident82.5Confident45 Ų4555.3 Ų55.332%0.31529%0.287SS..Hα-helixtrans-61.3-40.7176.2-60.60000112.1S126 S128 N134S126-S130 PolarHBondContact O-N 3.31Å; S126-S130 PolarHBondContact O-OG 2.94Å; S128-S130 VanDerWaalsContact C-N 3.31Å; S128-S130 PolarHBondContact O-N 3.45Å; S130-N134 WeakPolarHBondContact O-CB 3.25Å; S130-N134 PolarHBondContact O-N 2.91Å; S130-N134 VanDerWaalsContact O-N 3.13Å; S130-N134 PolarHBondContact O-ND2 3.41Å; S130-N134 VanDerWaalsContact O-ND2 3.09Å
131H87.8Confident80.7Confident59 Ų5955.6 Ų55.627%0.27329%0.288SS..Hα-helixtrans-63.5-52.5176.4-178.1-86.6000111.8R127 S128 M129 I133 N134 A135 Y218 F261R127-H131 WeakPolarHBondContact O-CB 3.33Å; R127-H131 PolarHBondContact O-N 3.19Å; S128-H131 WeakPolarHBondContact O-CB 3.27Å; S128-H131 PolarHBondContact O-N 3.47Å; S128-H131 VanDerWaalsContact O-N 3.15Å; M129-H131 VanDerWaalsContact C-N 3.31Å; M129-H131 PolarHBondContact O-N 3.41Å; H131-I133 VanDerWaalsContact C-N 3.34Å; H131-I133 PolarHBondContact O-N 2.7Å; H131-N134 PolarHBondContact O-N 2.95Å; H131-A135 WeakPolarHBondContact O-CB 3.34Å; H131-A135 PolarHBondContact O-N 3.39Å; H131-Y218 PolarHBondContact CE1-OH 2.9Å; H131-Y218 VanDerWaalsContact CE1-OH 3.27Å; H131-F261 HydrophobicContact CB-CB 4.34Å; H131-F261 AromaticContact CE1-CD1 3.95Å; H131-F261 PolarHBondContact CE1-O 2.96Å; H131-F261 VanDerWaalsContact CE1-O 3.25Å; H131-F261 WeakPolarHBondContact ND1-CB 3.43Å; H131-F261 AromaticContact ND1-CD1 3.37Å; H131-F261 WeakPolarHBondContact ND1-CD1 3.44Å; H131-F261 AromaticContact ND1-CG 3.65Å; H131-F261 PolarHBondContact NE2-O 3.5Å
132V89.2Confident79.3Confident0 Ų059.9 Ų59.90%031%0.308CS..Hα-helixtrans-61.4-42.6-178.7174.10000111.4V72 S128 M129 A135 S136 L215 Y218 T219 F261V72-V132 HydrophobicContact CG1-CG1 4.16Å; V72-V132 HydrophobicContact CG1-CG2 4.26Å; S128-V132 WeakPolarHBondContact O-CG2 3.34Å; S128-V132 PolarHBondContact O-N 2.92Å; M129-V132 PolarHBondContact O-N 2.81Å; V132-A135 PolarHBondContact O-N 2.9Å; V132-S136 WeakPolarHBondContact O-CB 3.34Å; V132-S136 PolarHBondContact O-N 3.31Å; V132-S136 PolarHBondContact O-OG 2.7Å; V132-L215 HydrophobicContact CG1-CB 4.17Å; V132-L215 HydrophobicContact CG1-CD2 4.46Å; V132-L215 HydrophobicContact CG1-CG 3.88Å; V132-Y218 HydrophobicContact CG1-CD1 4.12Å; V132-Y218 HydrophobicContact CG2-CD1 4.37Å; V132-Y218 HydrophobicContact CG2-CE1 4.42Å; V132-T219 HydrophobicContact CG1-CG2 4.02Å; V132-T219 HydrophobicContact CG2-CG2 3.89Å; V132-F261 HydrophobicContact CG2-CD1 3.86Å; V132-F261 HydrophobicContact CG2-CE1 3.09Å; V132-F261 HydrophobicContact CG2-CE2 4.02Å; V132-F261 HydrophobicContact CG2-CZ 3.17Å
133I87.1Confident78Confident4 Ų458.9 Ų58.92%0.02131%0.308CS..Hα-helixtrans-62.8-48.4179-74.4171.5000111M129 H131 A135 S136 S137 H168 P169 I170 L215M129-I133 HydrophobicContact CG-CD1 3.63Å; M129-I133 HydrophobicContact CG-CG1 4.31Å; M129-I133 VanDerWaalsContact O-CB 3.28Å; M129-I133 WeakPolarHBondContact O-CB 3.29Å; M129-I133 WeakPolarHBondContact O-CD1 3.37Å; M129-I133 WeakPolarHBondContact O-CG1 3.5Å; M129-I133 PolarHBondContact O-N 2.98Å; M129-I133 HydrophobicContact SD-CD1 4.08Å; M129-I133 HydrophobicContact SD-CG1 4.29Å; H131-I133 VanDerWaalsContact C-N 3.34Å; H131-I133 PolarHBondContact O-N 2.7Å; I133-A135 VanDerWaalsContact C-N 3.27Å; I133-A135 PolarHBondContact O-N 3.27Å; I133-S136 PolarHBondContact O-N 3.49Å; I133-S136 PolarHBondContact O-OG 3.19Å; I133-S137 WeakPolarHBondContact O-CB 3.5Å; I133-S137 PolarHBondContact O-N 2.98Å; I133-S137 VanDerWaalsContact O-N 3.15Å; I133-S137 PolarHBondContact O-OG 2.81Å; I133-H168 WeakPolarHBondContact CD1-CE1 3.43Å; I133-H168 WeakPolarHBondContact CD1-NE2 3.44Å; I133-P169 HydrophobicContact CG1-CG 4.46Å; I133-P169 HydrophobicContact CG2-CG 3.72Å; I133-I170 HydrophobicContact CD1-CD1 3.56Å; I133-I170 HydrophobicContact CD1-CG1 3.82Å; I133-I170 HydrophobicContact CG1-CD1 4.24Å; I133-L215 HydrophobicContact CG1-CD2 4.35Å
134N84Confident76.5Confident89 Ų8961.4 Ų61.448%0.47632%0.315SS..Hα-helixtrans-64.5-34.6-179.9-69-21000111.9S130 H131 S137S130-N134 WeakPolarHBondContact O-CB 3.25Å; S130-N134 PolarHBondContact O-N 2.91Å; S130-N134 VanDerWaalsContact O-N 3.13Å; S130-N134 PolarHBondContact O-ND2 3.41Å; S130-N134 VanDerWaalsContact O-ND2 3.09Å; H131-N134 PolarHBondContact O-N 2.95Å; N134-S137 PolarHBondContact O-OG 3.31Å
135A83.9Confident74.9Confident35 Ų3562 Ų6229%0.28932%0.317SS..Hα-helixtrans-80-26.6-179.700000113.6H131 V132 I133 Y218H131-A135 WeakPolarHBondContact O-CB 3.34Å; H131-A135 PolarHBondContact O-N 3.39Å; V132-A135 PolarHBondContact O-N 2.9Å; I133-A135 VanDerWaalsContact C-N 3.27Å; I133-A135 PolarHBondContact O-N 3.27Å; A135-Y218 HydrophobicContact CB-CD1 4.29Å; A135-Y218 HydrophobicContact CB-CD2 4.18Å; A135-Y218 HydrophobicContact CB-CE1 3.69Å; A135-Y218 HydrophobicContact CB-CE2 3.6Å
136S82.7Confident73.7Confident15 Ų1559.5 Ų59.511%0.10530%0.304CS..Hα-helixtrans-93.1-20.7-176590000114.3V132 I133 S138 L215V132-S136 WeakPolarHBondContact O-CB 3.34Å; V132-S136 PolarHBondContact O-N 3.31Å; V132-S136 PolarHBondContact O-OG 2.7Å; I133-S136 PolarHBondContact O-N 3.49Å; I133-S136 PolarHBondContact O-OG 3.19Å; S136-S138 VanDerWaalsContact C-N 3.26Å; S136-S138 PolarHBondContact O-N 2.99Å; S136-L215 VanDerWaalsContact OG-CD1 3.26Å; S136-L215 WeakPolarHBondContact OG-CD1 3.38Å
137S64.4Low72.7Confident27 Ų2762 Ų6219%0.18932%0.316CS..THydrogen-bonded Turntrans-71.6-11.6-173.458.20000115.2I133 N134 N139 Q142I133-S137 WeakPolarHBondContact O-CB 3.5Å; I133-S137 PolarHBondContact O-N 2.98Å; I133-S137 VanDerWaalsContact O-N 3.15Å; I133-S137 PolarHBondContact O-OG 2.81Å; N134-S137 PolarHBondContact O-OG 3.31Å; S137-N139 VanDerWaalsContact C-N 3.35Å; S137-N139 PolarHBondContact O-N 3.12Å; S137-N139 VanDerWaalsContact O-N 3.12Å; S137-Q142 WeakPolarHBondContact O-CB 3.39Å; S137-Q142 PolarHBondContact O-N 3.44Å
138S59.2Low71.5Confident68 Ų6856.6 Ų56.648%0.47630%0.3SS..THydrogen-bonded Turntrans-66.6-19-157.2650000117.3S136S136-S138 VanDerWaalsContact C-N 3.26Å; S136-S138 PolarHBondContact O-N 2.99Å
139N55.1Low70.1Confident135 Ų13557.3 Ų57.372%0.72231%0.305SS*.THydrogen-bonded Turntrans-114.8-48.8-165-71.120.5000116.3S137S137-N139 VanDerWaalsContact C-N 3.35Å; S137-N139 PolarHBondContact O-N 3.12Å; S137-N139 VanDerWaalsContact O-N 3.12Å
140W56.1Low68.9Low142 Ų14264 Ų6454%0.53833%0.33SS..THydrogen-bonded Turntrans-118.7-45.2-176.1169.569.9000113.1Q142 E143 Q144W140-Q142 PolarHBondContact O-N 2.95Å; W140-E143 PolarHBondContact O-N 2.95Å; W140-E143 VanDerWaalsContact O-N 3.07Å; W140-Q144 HydrophobicContact CZ2-CG 4.11Å; W140-Q144 PolarHBondContact O-N 3.47Å; W140-Q144 VanDerWaalsContact O-N 3.16Å
141I57.3Low67.8Low16 Ų1665 Ų658%0.08234%0.337CS..Hα-helixtrans-59.1-40.7177.2-69.5-177.5000110.2E143 Q144 M145 P169 P214I141-E143 VanDerWaalsContact C-N 3.29Å; I141-E143 PolarHBondContact O-N 3.26Å; I141-Q144 PolarHBondContact O-N 2.88Å; I141-M145 HydrophobicContact CG2-CE 3.27Å; I141-M145 HydrophobicContact CG2-CG 3.88Å; I141-M145 HydrophobicContact CG2-SD 3.5Å; I141-M145 VanDerWaalsContact CG2-SD 3.5Å; I141-M145 WeakPolarHBondContact O-CB 2.98Å; I141-M145 WeakPolarHBondContact O-CG 3.42Å; I141-M145 PolarHBondContact O-N 3.36Å; I141-P169 HydrophobicContact CG2-CB 4.43Å; I141-P214 HydrophobicContact CD1-CG 3.53Å; I141-P214 HydrophobicContact CG1-CG 4.36Å
142Q60.9Low66.5Low111 Ų11165 Ų6552%0.51934%0.338SS..Hα-helixtrans-61.2-35.2177179.2174.1-21.200112.9S137 W140 A146S137-Q142 WeakPolarHBondContact O-CB 3.39Å; S137-Q142 PolarHBondContact O-N 3.44Å; W140-Q142 PolarHBondContact O-N 2.95Å; Q142-A146 WeakPolarHBondContact O-CB 3.15Å; Q142-A146 PolarHBondContact O-N 3.01Å
143E63.1Low65.2Low128 Ų12866.6 Ų66.660%0.59835%0.349SS*.Hα-helixtrans-69.1-50.5178.3-166.4165.7-152.300110.6W140 I141 M145 A146 D147W140-E143 PolarHBondContact O-N 2.95Å; W140-E143 VanDerWaalsContact O-N 3.07Å; I141-E143 VanDerWaalsContact C-N 3.29Å; I141-E143 PolarHBondContact O-N 3.26Å; E143-M145 VanDerWaalsContact C-N 3.3Å; E143-M145 PolarHBondContact O-N 3.06Å; E143-A146 PolarHBondContact O-N 3.33Å; E143-D147 PolarHBondContact O-N 3.43Å; E143-D147 VanDerWaalsContact O-N 3.08Å
144Q60.3Low64.1Low105 Ų10570.8 Ų70.849%0.49138%0.379SS..Hα-helixtrans-62.3-37.2175.8-63.5-69.558.300112.4W140 I141 L148W140-Q144 HydrophobicContact CZ2-CG 4.11Å; W140-Q144 PolarHBondContact O-N 3.47Å; W140-Q144 VanDerWaalsContact O-N 3.16Å; I141-Q144 PolarHBondContact O-N 2.88Å; Q144-L148 WeakPolarHBondContact O-CB 3.39Å; Q144-L148 PolarHBondContact O-N 2.84Å
145M57.3Low63.1Low19 Ų1971.7 Ų71.79%0.09439%0.387CS..Hα-helixtrans-71.1-37.2175.7-78.6-177.7174.700112.7I141 E143 D147 L148 S149 F167 P169 L172I141-M145 HydrophobicContact CG2-CE 3.27Å; I141-M145 HydrophobicContact CG2-CG 3.88Å; I141-M145 HydrophobicContact CG2-SD 3.5Å; I141-M145 VanDerWaalsContact CG2-SD 3.5Å; I141-M145 WeakPolarHBondContact O-CB 2.98Å; I141-M145 WeakPolarHBondContact O-CG 3.42Å; I141-M145 PolarHBondContact O-N 3.36Å; E143-M145 VanDerWaalsContact C-N 3.3Å; E143-M145 PolarHBondContact O-N 3.06Å; M145-D147 VanDerWaalsContact C-N 3.26Å; M145-D147 PolarHBondContact O-N 2.85Å; M145-L148 PolarHBondContact O-N 3.49Å; M145-S149 WeakPolarHBondContact O-CB 3.46Å; M145-S149 PolarHBondContact O-N 3.28Å; M145-S149 PolarHBondContact O-OG 2.72Å; M145-F167 HydrophobicContact SD-CB 3.88Å; M145-P169 HydrophobicContact CE-CB 3.49Å; M145-P169 VanDerWaalsContact CE-CB 3.49Å; M145-P169 HydrophobicContact CE-CG 4.23Å; M145-L172 HydrophobicContact CE-CD2 3.89Å; M145-L172 HydrophobicContact CG-CD2 4.09Å
146A62.3Low62.1Low34 Ų3475.4 Ų75.428%0.28140%0.4SS..Hα-helixtrans-61.6-41.9175.600000109.8Q142 E143 S149 R150Q142-A146 WeakPolarHBondContact O-CB 3.15Å; Q142-A146 PolarHBondContact O-N 3.01Å; E143-A146 PolarHBondContact O-N 3.33Å; A146-S149 PolarHBondContact O-OG 3.27Å; A146-R150 WeakPolarHBondContact O-CG 3.13Å; A146-R150 PolarHBondContact O-N 2.92Å
147D65.2Low61Low70 Ų7079.5 Ų79.537%0.37443%0.426SS..Hα-helixtrans-65.3-47.6174.9-73.3-13.7000112.2E143 M145 S149 R150 S151E143-D147 PolarHBondContact O-N 3.43Å; E143-D147 VanDerWaalsContact O-N 3.08Å; M145-D147 VanDerWaalsContact C-N 3.26Å; M145-D147 PolarHBondContact O-N 2.85Å; D147-S149 VanDerWaalsContact C-N 3.32Å; D147-S149 PolarHBondContact O-N 2.8Å; D147-R150 PolarHBondContact O-N 3.27Å; D147-R150 IonicContact OD1-CZ 3.72Å; D147-R150 IonicContact OD1-NH1 3.04Å; D147-R150 PolarHBondContact OD1-NH1 2.96Å; D147-R150 IonicContact OD1-NH2 2.95Å; D147-R150 PolarHBondContact OD1-NH2 2.8Å; D147-S151 PolarHBondContact O-N 3.26Å
148L60.9Low60.8Low65 Ų6581 Ų8134%0.3445%0.446SS..Hα-helixtrans-62.8-40178.1-172.668.3000111.8Q144 M145 R150 S151 L152 L172Q144-L148 WeakPolarHBondContact O-CB 3.39Å; Q144-L148 PolarHBondContact O-N 2.84Å; M145-L148 PolarHBondContact O-N 3.49Å; L148-R150 VanDerWaalsContact C-N 3.35Å; L148-R150 PolarHBondContact O-N 3.43Å; L148-S151 WeakPolarHBondContact O-CB 3.47Å; L148-S151 PolarHBondContact O-N 3.29Å; L148-L152 HydrophobicContact CD2-CD1 4.37Å; L148-L152 HydrophobicContact CG-CD1 3.98Å; L148-L152 HydrophobicContact CG-CG 4.35Å; L148-L152 WeakPolarHBondContact O-CB 3.33Å; L148-L152 WeakPolarHBondContact O-CG 3.18Å; L148-L152 PolarHBondContact O-N 3.24Å; L148-L172 HydrophobicContact CD2-CD1 3.52Å; L148-L172 HydrophobicContact CD2-CD2 3.78Å; L148-L172 HydrophobicContact CD2-CG 4.21Å
149S59.3Low60.6Low23 Ų2380.2 Ų80.216%0.16144%0.436CS..Hα-helixtrans-63.7-40.6177.276.40000111.6M145 A146 D147 S151 L152 C153M145-S149 WeakPolarHBondContact O-CB 3.46Å; M145-S149 PolarHBondContact O-N 3.28Å; M145-S149 PolarHBondContact O-OG 2.72Å; A146-S149 PolarHBondContact O-OG 3.27Å; D147-S149 VanDerWaalsContact C-N 3.32Å; D147-S149 PolarHBondContact O-N 2.8Å; S149-S151 VanDerWaalsContact C-N 3.34Å; S149-L152 PolarHBondContact O-N 3.01Å; S149-C153 WeakPolarHBondContact O-CB 3.16Å; S149-C153 PolarHBondContact O-N 2.88Å; S149-C153 PolarHBondContact O-SG 3.49Å
150R63.8Low60.4Low155 Ų15575.1 Ų75.159%0.58541%0.411SS*.Hα-helixtrans-63.4-43175-81.3-175.2-1011161.4110.7A146 D147 L148 S154A146-R150 WeakPolarHBondContact O-CG 3.13Å; A146-R150 PolarHBondContact O-N 2.92Å; D147-R150 PolarHBondContact O-N 3.27Å; D147-R150 IonicContact OD1-CZ 3.72Å; D147-R150 IonicContact OD1-NH1 3.04Å; D147-R150 PolarHBondContact OD1-NH1 2.96Å; D147-R150 IonicContact OD1-NH2 2.95Å; D147-R150 PolarHBondContact OD1-NH2 2.8Å; L148-R150 VanDerWaalsContact C-N 3.35Å; L148-R150 PolarHBondContact O-N 3.43Å; R150-S154 WeakPolarHBondContact O-CB 3.38Å; R150-S154 PolarHBondContact O-N 2.82Å
151S63.4Low60.1Low65 Ų6573.8 Ų73.846%0.45542%0.418SS..Hα-helixtrans-61.5-52.2175-170.50000111.8D147 L148 S149 C153 S154 V155D147-S151 PolarHBondContact O-N 3.26Å; L148-S151 WeakPolarHBondContact O-CB 3.47Å; L148-S151 PolarHBondContact O-N 3.29Å; S149-S151 VanDerWaalsContact C-N 3.34Å; S151-C153 PolarHBondContact O-N 3.48Å; S151-S154 WeakPolarHBondContact O-CB 3.29Å; S151-S154 PolarHBondContact O-N 3Å; S151-S154 VanDerWaalsContact O-N 3.15Å; S151-S154 PolarHBondContact O-OG 3Å; S151-V155 WeakPolarHBondContact O-CG2 3.48Å; S151-V155 PolarHBondContact O-N 3.21Å
152L61Low59.8Low58 Ų5879.3 Ų79.330%0.30445%0.448SS..Hα-helixtrans-63.5-42.8-180-73.4171.9000112.8L148 S149 S154 V155 M156 L163L148-L152 HydrophobicContact CD2-CD1 4.37Å; L148-L152 HydrophobicContact CG-CD1 3.98Å; L148-L152 HydrophobicContact CG-CG 4.35Å; L148-L152 WeakPolarHBondContact O-CB 3.33Å; L148-L152 WeakPolarHBondContact O-CG 3.18Å; L148-L152 PolarHBondContact O-N 3.24Å; S149-L152 PolarHBondContact O-N 3.01Å; L152-S154 VanDerWaalsContact C-N 3.26Å; L152-S154 PolarHBondContact O-N 3.4Å; L152-V155 PolarHBondContact O-N 3.42Å; L152-M156 PolarHBondContact O-N 2.95Å; L152-L163 HydrophobicContact CD1-CD1 4.27Å
153C62.3Low59.1Low34 Ų3476.2 Ų76.223%0.2344%0.435CS..Hα-helixtrans-64.6-30.7176.2-730000112.1S149 S151 M156 P157 S160S149-C153 WeakPolarHBondContact O-CB 3.16Å; S149-C153 PolarHBondContact O-N 2.88Å; S149-C153 PolarHBondContact O-SG 3.49Å; S151-C153 PolarHBondContact O-N 3.48Å; C153-M156 CarbonylContact O-C 3.47Å; C153-P157 WeakPolarHBondContact O-CA 3.24Å; C153-S160 VanDerWaalsContact SG-CB 3.58Å
154S64.7Low58.1Low92 Ų9275.4 Ų75.464%0.64343%0.434SS*.Hα-helixtrans-70-32.7174.2790000112.7R150 S151 L152R150-S154 WeakPolarHBondContact O-CB 3.38Å; R150-S154 PolarHBondContact O-N 2.82Å; S151-S154 WeakPolarHBondContact O-CB 3.29Å; S151-S154 PolarHBondContact O-N 3Å; S151-S154 VanDerWaalsContact O-N 3.15Å; S151-S154 PolarHBondContact O-OG 3Å; L152-S154 VanDerWaalsContact C-N 3.26Å; L152-S154 PolarHBondContact O-N 3.4Å
155V63.3Low57.4Low109 Ų10975.1 Ų75.166%0.66144%0.441SS*.Hα-helixtrans-82.4-38.5-179.7177.90000111.5S151 L152S151-V155 WeakPolarHBondContact O-CG2 3.48Å; S151-V155 PolarHBondContact O-N 3.21Å; L152-V155 PolarHBondContact O-N 3.42Å
156M62.7Low57.2Low112 Ų11284 Ų8455%0.55247%0.473SS*.  trans-135.393178.8-62.3-158.588.600111L152 C153 G158 L159L152-M156 PolarHBondContact O-N 2.95Å; C153-M156 CarbonylContact O-C 3.47Å; M156-G158 PolarHBondContact O-N 3.46Å; M156-L159 HydrophobicContact CB-CB 3.83Å; M156-L159 HydrophobicContact CB-CD2 4.45Å; M156-L159 VanDerWaalsContact O-CB 3.26Å; M156-L159 WeakPolarHBondContact O-CB 3.42Å; M156-L159 PolarHBondContact O-N 3.14Å
157P58.5Low57.1Low101 Ų10184.8 Ų84.866%0.65647%0.47SS*.THydrogen-bonded Turntrans-61.7-30-175.620.3-31000113.5C153 L159 S160C153-P157 WeakPolarHBondContact O-CA 3.24Å; P157-L159 VanDerWaalsContact C-N 3.27Å; P157-L159 PolarHBondContact O-N 2.94Å; P157-S160 WeakPolarHBondContact O-CB 3.28Å; P157-S160 PolarHBondContact O-N 2.83Å; P157-S160 PolarHBondContact O-OG 3.24Å
158G60.6Low57.6Low58 Ų5883.5 Ų83.560%0.59846%0.462SS*.THydrogen-bonded Turntrans-73.8-14.7176.100000114.5M156 S160 T161M156-G158 PolarHBondContact O-N 3.46Å; G158-S160 VanDerWaalsContact C-N 3.26Å; G158-T161 PolarHBondContact O-OG1 2.84Å
159L54.5Low58.9Low53 Ų5380.6 Ų80.628%0.27745%0.447SS..Hα-helixtrans-77-20.5177.7-154.667.1000111.2M156 P157 T161 L162 L163M156-L159 HydrophobicContact CB-CB 3.83Å; M156-L159 HydrophobicContact CB-CD2 4.45Å; M156-L159 VanDerWaalsContact O-CB 3.26Å; M156-L159 WeakPolarHBondContact O-CB 3.42Å; M156-L159 PolarHBondContact O-N 3.14Å; P157-L159 VanDerWaalsContact C-N 3.27Å; P157-L159 PolarHBondContact O-N 2.94Å; L159-T161 PolarHBondContact O-N 3.3Å; L159-L162 HydrophobicContact CD1-CD2 4.44Å; L159-L162 PolarHBondContact O-N 3.46Å; L159-L163 HydrophobicContact CB-CD1 4.19Å; L159-L163 HydrophobicContact CD1-CD1 4.5Å; L159-L163 HydrophobicContact CD2-CD1 3.35Å; L159-L163 HydrophobicContact CD2-CG 4.22Å; L159-L163 HydrophobicContact CG-CD1 3.38Å; L159-L163 HydrophobicContact CG-CG 3.77Å; L159-L163 VanDerWaalsContact O-CB 3.23Å; L159-L163 WeakPolarHBondContact O-CB 3.1Å; L159-L163 WeakPolarHBondContact O-CG 3.47Å; L159-L163 PolarHBondContact O-N 2.95Å
160S50.4Low60.3Low28 Ų2879.5 Ų79.520%0.19644%0.44CS..Hα-helixtrans-55.5-48.717667.90000111.4C153 P157 G158 L162 L163 L164C153-S160 VanDerWaalsContact SG-CB 3.58Å; P157-S160 WeakPolarHBondContact O-CB 3.28Å; P157-S160 PolarHBondContact O-N 2.83Å; P157-S160 PolarHBondContact O-OG 3.24Å; G158-S160 VanDerWaalsContact C-N 3.26Å; S160-L162 VanDerWaalsContact C-N 3.27Å; S160-L162 PolarHBondContact O-N 3.27Å; S160-L163 PolarHBondContact O-N 3.4Å; S160-L164 WeakPolarHBondContact O-CA 3.41Å; S160-L164 WeakPolarHBondContact O-CB 3.45Å; S160-L164 VanDerWaalsContact O-CD1 3.24Å; S160-L164 WeakPolarHBondContact O-CD1 3.05Å; S160-L164 WeakPolarHBondContact O-CG 3.23Å; S160-L164 PolarHBondContact O-N 2.88Å
161T50.9Low61.6Low113 Ų11372.4 Ų72.469%0.69341%0.414SS*.Hα-helixtrans-67.3-26.9-178.4530000113.5G158 L159G158-T161 PolarHBondContact O-OG1 2.84Å; L159-T161 PolarHBondContact O-N 3.3Å
162L50.6Low62.9Low132 Ų13271.1 Ų71.169%0.69140%0.402SS*.Hα-helixtrans-84.6-31.6175.7-171.363.8000112.8L159 S160L159-L162 HydrophobicContact CD1-CD2 4.44Å; L159-L162 PolarHBondContact O-N 3.46Å; S160-L162 VanDerWaalsContact C-N 3.27Å; S160-L162 PolarHBondContact O-N 3.27Å
163L45.5Very low64.4Low47 Ų4768.4 Ų68.425%0.24639%0.388CS..Hα-helixtrans-95.9-19.7-177.2-72.1177.1000114.5L152 L159 S160 P165 F167L152-L163 HydrophobicContact CD1-CD1 4.27Å; L159-L163 HydrophobicContact CB-CD1 4.19Å; L159-L163 HydrophobicContact CD1-CD1 4.5Å; L159-L163 HydrophobicContact CD2-CD1 3.35Å; L159-L163 HydrophobicContact CD2-CG 4.22Å; L159-L163 HydrophobicContact CG-CD1 3.38Å; L159-L163 HydrophobicContact CG-CG 3.77Å; L159-L163 VanDerWaalsContact O-CB 3.23Å; L159-L163 WeakPolarHBondContact O-CB 3.1Å; L159-L163 WeakPolarHBondContact O-CG 3.47Å; L159-L163 PolarHBondContact O-N 2.95Å; S160-L163 PolarHBondContact O-N 3.4Å; L163-P165 VanDerWaalsContact C-CD 3.42Å; L163-F167 HydrophobicContact CB-CE1 3.7Å; L163-F167 HydrophobicContact CB-CZ 3.65Å; L163-F167 HydrophobicContact CD1-CE1 4Å; L163-F167 HydrophobicContact CD1-CZ 4.28Å; L163-F167 HydrophobicContact CD2-CE1 4.04Å; L163-F167 HydrophobicContact CG-CE1 4.14Å; L163-F167 HydrophobicContact CG-CZ 4.47Å
164L43.6Very low66Low111 Ų11166.8 Ų66.858%0.58138%0.377SS*.  trans-69.3-27.2-173.6-83.7166.8000115.9S160 R166S160-L164 WeakPolarHBondContact O-CA 3.41Å; S160-L164 WeakPolarHBondContact O-CB 3.45Å; S160-L164 VanDerWaalsContact O-CD1 3.24Å; S160-L164 WeakPolarHBondContact O-CD1 3.05Å; S160-L164 WeakPolarHBondContact O-CG 3.23Å; S160-L164 PolarHBondContact O-N 2.88Å; L164-R166 PolarHBondContact O-N 2.98Å
165P44.8Very low67.4Low99 Ų9963.8 Ų63.864%0.64336%0.356SS*.SBendtrans-8280.3178.431-27.1000109.3L163L163-P165 VanDerWaalsContact C-CD 3.42Å
166R53Low68.9Low204 Ų20459.9 Ų59.977%0.7733%0.333SS*.  trans66.593.6169.9-56.2174.8172.8157.4-3.5113.3L164 H168L164-R166 PolarHBondContact O-N 2.98Å; R166-H168 PolarHBondContact O-N 2.95Å
167F59.5Low70.5Confident51 Ų5154.6 Ų54.622%0.22431%0.307CS..  trans-52.3103.7168.7-74.8-83.1000110.2M145 L163 P169M145-F167 HydrophobicContact SD-CB 3.88Å; L163-F167 HydrophobicContact CB-CE1 3.7Å; L163-F167 HydrophobicContact CB-CZ 3.65Å; L163-F167 HydrophobicContact CD1-CE1 4Å; L163-F167 HydrophobicContact CD1-CZ 4.28Å; L163-F167 HydrophobicContact CD2-CE1 4.04Å; L163-F167 HydrophobicContact CG-CE1 4.14Å; L163-F167 HydrophobicContact CG-CZ 4.47Å; F167-P169 WeakPolarHBondContact O-CD 3.3Å
168H77.1Confident72.4Confident44 Ų4452.7 Ų52.720%0.20429%0.287CS..  trans-76.9111.5176.5-168.8-82.4000107.6I133 R166 I170 A171 L172I133-H168 WeakPolarHBondContact CD1-CE1 3.43Å; I133-H168 WeakPolarHBondContact CD1-NE2 3.44Å; R166-H168 PolarHBondContact O-N 2.95Å; H168-I170 WeakPolarHBondContact ND1-CB 3.05Å; H168-I170 PolarHBondContact O-N 2.94Å; H168-A171 HydrophobicContact CB-CB 3.99Å; H168-A171 PolarHBondContact ND1-N 3.27Å; H168-A171 WeakPolarHBondContact O-CA 3.26Å; H168-A171 WeakPolarHBondContact O-CB 3.39Å; H168-A171 PolarHBondContact O-N 2.91Å; H168-L172 PolarHBondContact O-N 3.27Å
169P87Confident74.2Confident3 Ų354.2 Ų54.22%0.01928%0.281CS..Hα-helixtrans-49.3-35.7-177.19.2-24.3000114.2I133 I141 M145 F167 L172 L173 T211I133-P169 HydrophobicContact CG1-CG 4.46Å; I133-P169 HydrophobicContact CG2-CG 3.72Å; I141-P169 HydrophobicContact CG2-CB 4.43Å; M145-P169 HydrophobicContact CE-CB 3.49Å; M145-P169 VanDerWaalsContact CE-CB 3.49Å; M145-P169 HydrophobicContact CE-CG 4.23Å; F167-P169 WeakPolarHBondContact O-CD 3.3Å; P169-L172 PolarHBondContact O-N 3.25Å; P169-L173 WeakPolarHBondContact O-CB 3.46Å; P169-L173 PolarHBondContact O-N 3.02Å; P169-T211 HydrophobicContact CB-CG2 3.89Å
170I90.5Very high76.2Confident1 Ų152.5 Ų52.51%0.00527%0.272CS..Hα-helixtrans-73.2-34.1-179.1-41.1-167.1000111.4F37 M129 I133 H168 L173 A174 L215F37-I170 HydrophobicContact CD1-CD1 4.45Å; F37-I170 HydrophobicContact CD1-CG2 4.06Å; F37-I170 HydrophobicContact CE1-CD1 3.37Å; F37-I170 HydrophobicContact CE1-CG1 4.48Å; F37-I170 HydrophobicContact CE1-CG2 3.86Å; F37-I170 HydrophobicContact CZ-CD1 3.52Å; M129-I170 HydrophobicContact CG-CD1 4.19Å; M129-I170 HydrophobicContact SD-CD1 3.76Å; I133-I170 HydrophobicContact CD1-CD1 3.56Å; I133-I170 HydrophobicContact CD1-CG1 3.82Å; I133-I170 HydrophobicContact CG1-CD1 4.24Å; H168-I170 WeakPolarHBondContact ND1-CB 3.05Å; H168-I170 PolarHBondContact O-N 2.94Å; I170-L173 PolarHBondContact O-N 3.39Å; I170-A174 WeakPolarHBondContact O-CB 3.4Å; I170-A174 PolarHBondContact O-N 2.86Å; I170-L215 HydrophobicContact CD1-CD2 4.3Å
171A90.8Very high78.5Confident6 Ų651.3 Ų51.35%0.0526%0.263CS..Hα-helixtrans-68.5-40.4173.700000110.3I121 H168 A174 S175I121-A171 HydrophobicContact CD1-CB 3.95Å; I121-A171 HydrophobicContact CG2-CB 4.42Å; H168-A171 HydrophobicContact CB-CB 3.99Å; H168-A171 PolarHBondContact ND1-N 3.27Å; H168-A171 WeakPolarHBondContact O-CA 3.26Å; H168-A171 WeakPolarHBondContact O-CB 3.39Å; H168-A171 PolarHBondContact O-N 2.91Å; A171-A174 WeakPolarHBondContact O-CB 3.44Å; A171-A174 PolarHBondContact O-N 3.01Å; A171-S175 PolarHBondContact O-N 3.4Å; A171-S175 PolarHBondContact O-OG 3.23Å
172L89.3Confident80.8Confident37 Ų3747.5 Ų47.519%0.19424%0.238CC..Hα-helixtrans-61.8-46.1175-17767.4000111.4M145 L148 H168 P169 A174 S175 C176M145-L172 HydrophobicContact CE-CD2 3.89Å; M145-L172 HydrophobicContact CG-CD2 4.09Å; L148-L172 HydrophobicContact CD2-CD1 3.52Å; L148-L172 HydrophobicContact CD2-CD2 3.78Å; L148-L172 HydrophobicContact CD2-CG 4.21Å; H168-L172 PolarHBondContact O-N 3.27Å; P169-L172 PolarHBondContact O-N 3.25Å; L172-A174 VanDerWaalsContact C-N 3.32Å; L172-A174 PolarHBondContact O-N 3.15Å; L172-S175 PolarHBondContact O-N 2.93Å; L172-C176 WeakPolarHBondContact O-CB 3.47Å; L172-C176 PolarHBondContact O-N 3.4Å; L172-C176 PolarHBondContact O-SG 3.41Å; L172-C176 VanDerWaalsContact O-SG 3.33Å
173L92.7Very high82.9Confident2 Ų244 Ų441%0.0122%0.224CC..Hα-helixtrans-58.9-43.2175.8-178.964.1000111.8V34 P169 I170 G177 L204 M207 L208 T211 M212V34-L173 HydrophobicContact CG1-CD2 4.44Å; V34-L173 HydrophobicContact CG1-CG 4.38Å; V34-L173 HydrophobicContact CG2-CD2 4.26Å; V34-L173 HydrophobicContact CG2-CG 4.22Å; P169-L173 WeakPolarHBondContact O-CB 3.46Å; P169-L173 PolarHBondContact O-N 3.02Å; I170-L173 PolarHBondContact O-N 3.39Å; L173-G177 PolarHBondContact O-N 2.7Å; L173-L204 HydrophobicContact CD1-CD1 4.28Å; L173-M207 HydrophobicContact CD1-CB 3.93Å; L173-L208 HydrophobicContact CD1-CB 4.42Å; L173-L208 HydrophobicContact CD2-CB 4.46Å; L173-L208 HydrophobicContact CD2-CD1 3.66Å; L173-T211 HydrophobicContact CD2-CG2 4.22Å; L173-M212 HydrophobicContact CD2-CE 3.97Å
174A95.3Very high85.4Confident0 Ų041.8 Ų41.80%021%0.213CC..Hα-helixtrans-61.3-44.7176.100000112.3Y31 Y114 Q117 I170 A171 L172 W178Y31-A174 WeakPolarHBondContact CE2-O 3.18Å; Y31-A174 PolarHBondContact OH-O 2.95Å; Y114-A174 HydrophobicContact CD2-CB 4.3Å; Y114-A174 HydrophobicContact CE2-CB 4.48Å; Q117-A174 HydrophobicContact CB-CB 4.33Å; I170-A174 WeakPolarHBondContact O-CB 3.4Å; I170-A174 PolarHBondContact O-N 2.86Å; A171-A174 WeakPolarHBondContact O-CB 3.44Å; A171-A174 PolarHBondContact O-N 3.01Å; L172-A174 VanDerWaalsContact C-N 3.32Å; L172-A174 PolarHBondContact O-N 3.15Å; A174-W178 WeakPolarHBondContact O-CB 3.19Å; A174-W178 PolarHBondContact O-N 2.82Å
175S94.6Very high87.9Confident29 Ų2939.4 Ų39.420%0.20320%0.197CC..Hα-helixtrans-68-46178.6-57.20000112.5Y114 A171 L172 W178 L179Y114-S175 WeakPolarHBondContact CE2-OG 3.45Å; Y114-S175 PolarHBondContact OH-OG 3.09Å; A171-S175 PolarHBondContact O-N 3.4Å; A171-S175 PolarHBondContact O-OG 3.23Å; L172-S175 PolarHBondContact O-N 2.93Å; S175-W178 PolarHBondContact O-N 2.9Å; S175-L179 WeakPolarHBondContact O-CG 3.03Å; S175-L179 PolarHBondContact O-N 3.41Å
176C94.2Very high90.3Very high27 Ų2740.8 Ų40.818%0.18219%0.193CC..Hα-helixtrans-63.3-43.8176.9-70.60000111.2L172 W178 L179 I180 M207L172-C176 WeakPolarHBondContact O-CB 3.47Å; L172-C176 PolarHBondContact O-N 3.4Å; L172-C176 PolarHBondContact O-SG 3.41Å; L172-C176 VanDerWaalsContact O-SG 3.33Å; C176-W178 VanDerWaalsContact C-N 3.32Å; C176-W178 PolarHBondContact O-N 3.06Å; C176-L179 PolarHBondContact O-N 2.97Å; C176-I180 WeakPolarHBondContact O-CB 2.95Å; C176-I180 VanDerWaalsContact O-CG1 3.24Å; C176-I180 WeakPolarHBondContact O-CG1 3.18Å; C176-I180 PolarHBondContact O-N 3.41Å; C176-M207 HydrophobicContact CB-CE 3.43Å; C176-M207 VanDerWaalsContact CB-CE 3.43Å; C176-M207 HydrophobicContact CB-SD 4.41Å
177G97.5Very high92.3Very high0 Ų034 Ų340%017%0.171CC..Hα-helixtrans-61.3-39.7176.300000112.9Y31 L173 I180 C181Y31-G177 VanDerWaalsContact CE2-C 3.42Å; L173-G177 PolarHBondContact O-N 2.7Å; G177-I180 PolarHBondContact O-N 3.22Å; G177-C181 PolarHBondContact O-N 3.31Å; G177-C181 PolarHBondContact O-SG 3.44Å
178W98.2Very high94Very high62 Ų6232.4 Ų32.424%0.23517%0.165CC..Hα-helixtrans-63.1-46.8174.4169.766.6000112.4Y31 T111 Y114 A174 S175 C176 I180 C181 I182Y31-W178 HydrophobicContact CE2-CB 4.48Å; Y31-W178 VanDerWaalsContact CE2-N 3.34Å; T111-W178 PolarHBondContact OG1-NE1 3.31Å; Y114-W178 HydrophobicContact CD1-CB 4.38Å; Y114-W178 AromaticContact CD1-CD2 3.81Å; Y114-W178 HydrophobicContact CD1-CD2 3.81Å; Y114-W178 HydrophobicContact CD1-CE3 4.18Å; Y114-W178 AromaticContact CD1-CG 3.89Å; Y114-W178 HydrophobicContact CD1-CG 3.89Å; Y114-W178 HydrophobicContact CD2-CB 4.06Å; Y114-W178 HydrophobicContact CD2-CG 4.44Å; Y114-W178 HydrophobicContact CE1-CD2 4.08Å; Y114-W178 AromaticContact CE1-CE3 3.96Å; Y114-W178 HydrophobicContact CE1-CE3 3.96Å; Y114-W178 HydrophobicContact CE1-CZ3 4.37Å; Y114-W178 HydrophobicContact CG-CB 3.89Å; Y114-W178 HydrophobicContact CG-CD2 4.23Å; Y114-W178 AromaticContact CG-CG 3.83Å; Y114-W178 HydrophobicContact CG-CG 3.83Å; A174-W178 WeakPolarHBondContact O-CB 3.19Å; A174-W178 PolarHBondContact O-N 2.82Å; S175-W178 PolarHBondContact O-N 2.9Å; C176-W178 VanDerWaalsContact C-N 3.32Å; C176-W178 PolarHBondContact O-N 3.06Å; W178-I180 VanDerWaalsContact C-N 3.31Å; W178-I180 PolarHBondContact O-N 3.26Å; W178-C181 WeakPolarHBondContact O-CB 3.47Å; W178-C181 PolarHBondContact O-N 3.36Å; W178-I182 HydrophobicContact CD2-CD1 4.03Å; W178-I182 HydrophobicContact CH2-CD1 4.03Å; W178-I182 HydrophobicContact CZ2-CD1 3.33Å; W178-I182 PolarHBondContact O-N 2.81Å; W178-I182 VanDerWaalsContact O-N 3.09Å
179L97.9Very high94.6Very high90 Ų9033.2 Ų33.247%0.47118%0.176SC..Hα-helixtrans-62.7-37.7176.4-71.6173.3000112.3S175 C176 I182 S183S175-L179 WeakPolarHBondContact O-CG 3.03Å; S175-L179 PolarHBondContact O-N 3.41Å; C176-L179 PolarHBondContact O-N 2.97Å; L179-I182 PolarHBondContact O-N 3.15Å; L179-S183 WeakPolarHBondContact O-CB 3.35Å; L179-S183 PolarHBondContact O-N 2.88Å; L179-S183 PolarHBondContact O-OG 2.91Å
180I97.9Very high94.7Very high17 Ų1737.3 Ų37.39%0.08720%0.197CC..Hα-helixtrans-65-42.9175.7-71.8168.5000110.5V27 C176 G177 W178 I182 S183 D184 L200 L203 L204 M207V27-I180 HydrophobicContact CG1-CG2 3.8Å; C176-I180 WeakPolarHBondContact O-CB 2.95Å; C176-I180 VanDerWaalsContact O-CG1 3.24Å; C176-I180 WeakPolarHBondContact O-CG1 3.18Å; C176-I180 PolarHBondContact O-N 3.41Å; G177-I180 PolarHBondContact O-N 3.22Å; W178-I180 VanDerWaalsContact C-N 3.31Å; W178-I180 PolarHBondContact O-N 3.26Å; I180-I182 VanDerWaalsContact C-N 3.33Å; I180-I182 PolarHBondContact O-N 3.19Å; I180-S183 PolarHBondContact O-N 3.21Å; I180-D184 WeakPolarHBondContact O-CB 3.34Å; I180-D184 PolarHBondContact O-N 2.93Å; I180-L200 HydrophobicContact CG2-CB 3.82Å; I180-L200 HydrophobicContact CG2-CD1 4.32Å; I180-L200 HydrophobicContact CG2-CD2 4.25Å; I180-L200 HydrophobicContact CG2-CG 4.36Å; I180-L203 HydrophobicContact CD1-CD2 4.09Å; I180-L203 HydrophobicContact CD1-CG 4.29Å; I180-L204 HydrophobicContact CD1-CB 4.14Å; I180-L204 HydrophobicContact CD1-CD1 4.22Å; I180-M207 HydrophobicContact CD1-SD 4.09Å
181C98.2Very high94.2Very high2 Ų243.6 Ų43.61%0.01423%0.231CC..Hα-helixtrans-59.4-42.6174.9-65.40000112.2V27 P110 G177 W178 Y185V27-C181 HydrophobicContact CG1-CB 4.49Å; P110-C181 HydrophobicContact CB-CB 3.9Å; P110-C181 HydrophobicContact CG-CB 4.1Å; G177-C181 PolarHBondContact O-N 3.31Å; G177-C181 PolarHBondContact O-SG 3.44Å; W178-C181 WeakPolarHBondContact O-CB 3.47Å; W178-C181 PolarHBondContact O-N 3.36Å; C181-Y185 PolarHBondContact O-N 3.48Å; C181-Y185 VanDerWaalsContact O-N 3.15Å
182I97.9Very high93.9Very high34 Ų3451.6 Ų51.617%0.17427%0.267CS..Hα-helixtrans-63.3-48.3176.3-71.2174.8000110.9V107 W178 L179 I180 D184 Y185 F186V107-I182 HydrophobicContact CG1-CG1 4.1Å; W178-I182 HydrophobicContact CD2-CD1 4.03Å; W178-I182 HydrophobicContact CH2-CD1 4.03Å; W178-I182 HydrophobicContact CZ2-CD1 3.33Å; W178-I182 PolarHBondContact O-N 2.81Å; W178-I182 VanDerWaalsContact O-N 3.09Å; L179-I182 PolarHBondContact O-N 3.15Å; I180-I182 VanDerWaalsContact C-N 3.33Å; I180-I182 PolarHBondContact O-N 3.19Å; I182-D184 VanDerWaalsContact C-N 3.29Å; I182-D184 PolarHBondContact O-N 3.44Å; I182-Y185 PolarHBondContact O-N 3.02Å; I182-F186 HydrophobicContact CG2-CD2 3.74Å; I182-F186 HydrophobicContact CG2-CE2 3.53Å; I182-F186 WeakPolarHBondContact O-CD2 3.47Å; I182-F186 PolarHBondContact O-N 3.19Å
183S96.2Very high93.8Very high57 Ų5755.2 Ų55.240%0.39928%0.281SS..Hα-helixtrans-61.8-41.6-178.5-56.30000111L179 I180 F186 L187L179-S183 WeakPolarHBondContact O-CB 3.35Å; L179-S183 PolarHBondContact O-N 2.88Å; L179-S183 PolarHBondContact O-OG 2.91Å; I180-S183 PolarHBondContact O-N 3.21Å; S183-F186 PolarHBondContact O-N 3.42Å; S183-L187 WeakPolarHBondContact O-CB 3.28Å; S183-L187 VanDerWaalsContact O-CG 3.31Å; S183-L187 WeakPolarHBondContact O-CG 3.33Å; S183-L187 PolarHBondContact O-N 3.12Å
184D96.5Very high93.4Very high1 Ų161.8 Ų61.81%0.00531%0.31CS..Hα-helixtrans-62-45.1178-170.352.3000112.3V27 I180 I182 F186 L187 L188 S196 D197 L200V27-D184 HydrophobicContact CG1-CB 4.43Å; V27-D184 HydrophobicContact CG2-CB 4.29Å; I180-D184 WeakPolarHBondContact O-CB 3.34Å; I180-D184 PolarHBondContact O-N 2.93Å; I182-D184 VanDerWaalsContact C-N 3.29Å; I182-D184 PolarHBondContact O-N 3.44Å; D184-F186 VanDerWaalsContact C-N 3.33Å; D184-F186 PolarHBondContact O-N 2.72Å; D184-L187 PolarHBondContact O-N 3.42Å; D184-L188 WeakPolarHBondContact O-CB 3.34Å; D184-L188 WeakPolarHBondContact O-CG 3.45Å; D184-L188 PolarHBondContact O-N 3.24Å; D184-L188 VanDerWaalsContact OD2-CD1 3.27Å; D184-L188 WeakPolarHBondContact OD2-CD1 3.3Å; D184-S196 PolarHBondContact OD1-OG 3.23Å; D184-D197 VanDerWaalsContact OD1-CA 3.26Å; D184-D197 WeakPolarHBondContact OD1-CA 3.41Å; D184-D197 PolarHBondContact OD1-N 2.89Å; D184-L200 HydrophobicContact CB-CD1 3.59Å
185Y96.6Very high93.1Very high62 Ų6266.2 Ų66.224%0.24333%0.331CS..Hα-helixtrans-56.8-45.7174.9171.6-95.6000112.4V102 M106 V107 C181 I182 S189V102-Y185 HydrophobicContact CG1-CD2 3.91Å; V102-Y185 HydrophobicContact CG1-CE2 3.87Å; M106-Y185 HydrophobicContact CB-CD2 4.4Å; V107-Y185 HydrophobicContact CG2-CD1 3.61Å; V107-Y185 HydrophobicContact CG2-CD2 3.93Å; V107-Y185 HydrophobicContact CG2-CE1 4.37Å; V107-Y185 HydrophobicContact CG2-CG 3.35Å; C181-Y185 PolarHBondContact O-N 3.48Å; C181-Y185 VanDerWaalsContact O-N 3.15Å; I182-Y185 PolarHBondContact O-N 3.02Å; Y185-S189 WeakPolarHBondContact O-CB 3.27Å; Y185-S189 PolarHBondContact O-N 3.26Å; Y185-S189 PolarHBondContact O-OG 3.2Å
186F95.8Very high93Very high128 Ų12865.3 Ų65.356%0.56132%0.324SS*.Hα-helixtrans-67.2-37.7178.3-76.1-64.6000112.3I182 S183 D184 N190I182-F186 HydrophobicContact CG2-CD2 3.74Å; I182-F186 HydrophobicContact CG2-CE2 3.53Å; I182-F186 WeakPolarHBondContact O-CD2 3.47Å; I182-F186 PolarHBondContact O-N 3.19Å; S183-F186 PolarHBondContact O-N 3.42Å; D184-F186 VanDerWaalsContact C-N 3.33Å; D184-F186 PolarHBondContact O-N 2.72Å; F186-N190 PolarHBondContact O-ND2 3.42Å
187L95.1Very high93.1Very high60 Ų6064 Ų6431%0.31432%0.315SS..Hα-helixtrans-68.7-46.9177.6-72.3172.3000111.7S183 D184 S189 N190 F193 S196 L200S183-L187 WeakPolarHBondContact O-CB 3.28Å; S183-L187 VanDerWaalsContact O-CG 3.31Å; S183-L187 WeakPolarHBondContact O-CG 3.33Å; S183-L187 PolarHBondContact O-N 3.12Å; D184-L187 PolarHBondContact O-N 3.42Å; L187-S189 PolarHBondContact O-N 2.97Å; L187-N190 WeakPolarHBondContact O-CA 3.49Å; L187-N190 WeakPolarHBondContact O-CB 3.42Å; L187-N190 PolarHBondContact O-N 3.18Å; L187-N190 VanDerWaalsContact O-O 3.06Å; L187-F193 HydrophobicContact CB-CB 4.25Å; L187-F193 HydrophobicContact CD2-CD2 4.08Å; L187-F193 HydrophobicContact CD2-CE2 4.44Å; L187-F193 HydrophobicContact CD2-CG 4.28Å; L187-S196 WeakPolarHBondContact CB-OG 3.5Å; L187-S196 VanDerWaalsContact CD1-OG 3.31Å; L187-S196 WeakPolarHBondContact CD1-OG 3.38Å; L187-L200 HydrophobicContact CD1-CD1 4.02Å
188L94Very high93Very high19 Ų1964 Ų6410%0.09932%0.315CS..Hα-helixtrans-65.7-27177.3-69.9171.6000113.1V100 V102 M106 D184 N190 D197V100-L188 HydrophobicContact CB-CD1 4.3Å; V100-L188 HydrophobicContact CG1-CD1 3.85Å; V102-L188 HydrophobicContact CG2-CB 3.67Å; V102-L188 HydrophobicContact CG2-CD1 4.41Å; M106-L188 HydrophobicContact CE-CD1 3.63Å; D184-L188 WeakPolarHBondContact O-CB 3.34Å; D184-L188 WeakPolarHBondContact O-CG 3.45Å; D184-L188 PolarHBondContact O-N 3.24Å; D184-L188 VanDerWaalsContact OD2-CD1 3.27Å; D184-L188 WeakPolarHBondContact OD2-CD1 3.3Å; L188-N190 PolarHBondContact O-N 2.88Å; L188-D197 HydrophobicContact CD1-CB 4.28Å; L188-D197 HydrophobicContact CD2-CB 4.38Å
189S90.5Very high92.9Very high61 Ų6166 Ų6643%0.42733%0.33SS..THydrogen-bonded Turntrans-64.7-17.1171.3-61.80000112.6Y185 L187Y185-S189 WeakPolarHBondContact O-CB 3.27Å; Y185-S189 PolarHBondContact O-N 3.26Å; Y185-S189 PolarHBondContact O-OG 3.2Å; L187-S189 PolarHBondContact O-N 2.97Å
190N89.7Confident92.8Very high88 Ų8863 Ų6347%0.47132%0.315SS..SBendtrans-97.4120.2171.5-61.8-70000109.3F186 L187 L188 H192 F193F186-N190 PolarHBondContact O-ND2 3.42Å; L187-N190 WeakPolarHBondContact O-CA 3.49Å; L187-N190 WeakPolarHBondContact O-CB 3.42Å; L187-N190 PolarHBondContact O-N 3.18Å; L187-N190 VanDerWaalsContact O-O 3.06Å; L188-N190 PolarHBondContact O-N 2.88Å; N190-H192 PolarHBondContact O-N 2.85Å; N190-F193 HydrophobicContact CB-CD2 4.05Å; N190-F193 PolarHBondContact O-N 2.75Å
191D78.5Confident92.8Very high134 Ų13462.2 Ų62.272%0.71731%0.311SS*.THydrogen-bonded Turntrans-54.8-18.8-176.7-77.6-37.5000115.1
192H84.8Confident92.7Very high173 Ų17363.7 Ų63.780%0.80132%0.318SS*.THydrogen-bonded Turntrans-75.9-23.7-178.8-69.5-110.6000113.7N190N190-H192 PolarHBondContact O-N 2.85Å
193F88.2Confident92.6Very high113 Ų11366.2 Ų66.250%0.49633%0.331SS..  trans-11345.1-169.6-61.3-72.2000113.3L187 N190 Q195 S196L187-F193 HydrophobicContact CB-CB 4.25Å; L187-F193 HydrophobicContact CD2-CD2 4.08Å; L187-F193 HydrophobicContact CD2-CE2 4.44Å; L187-F193 HydrophobicContact CD2-CG 4.28Å; N190-F193 HydrophobicContact CB-CD2 4.05Å; N190-F193 PolarHBondContact O-N 2.75Å; F193-Q195 PolarHBondContact O-N 2.81Å; F193-S196 WeakPolarHBondContact O-CB 3.08Å; F193-S196 PolarHBondContact O-N 3.26Å
194K83.2Confident92.7Very high140 Ų14063.5 Ų63.561%0.60931%0.312SS*.THydrogen-bonded Turntrans-59.9-28.2179.9-63.9-171.2178.4-171.70114.3S196K194-S196 VanDerWaalsContact C-N 3.31Å
195Q89Confident92.7Very high94 Ų9463.4 Ų63.444%0.43931%0.312SS..THydrogen-bonded Turntrans-86.12.6177.9-66.1-178.7-11.200113.7S97 F193 D197 A198 L199S97-Q195 PolarHBondContact OG-NE2 3.41Å; F193-Q195 PolarHBondContact O-N 2.81Å; Q195-D197 VanDerWaalsContact C-N 3.32Å; Q195-D197 PolarHBondContact O-N 3.39Å; Q195-A198 PolarHBondContact O-N 2.81Å; Q195-L199 PolarHBondContact O-N 3.2Å
196S93.3Very high92.5Very high9 Ų963.9 Ų63.96%0.06332%0.324CS..Hα-helixtrans-54-47.6-180172.90000112.3D184 L187 F193 K194 A198 L199 L200D184-S196 PolarHBondContact OD1-OG 3.23Å; L187-S196 WeakPolarHBondContact CB-OG 3.5Å; L187-S196 VanDerWaalsContact CD1-OG 3.31Å; L187-S196 WeakPolarHBondContact CD1-OG 3.38Å; F193-S196 WeakPolarHBondContact O-CB 3.08Å; F193-S196 PolarHBondContact O-N 3.26Å; K194-S196 VanDerWaalsContact C-N 3.31Å; S196-A198 VanDerWaalsContact C-N 3.31Å; S196-A198 PolarHBondContact O-N 2.66Å; S196-L199 PolarHBondContact O-N 3.17Å; S196-L199 VanDerWaalsContact O-N 3.15Å; S196-L200 WeakPolarHBondContact O-CB 3.5Å; S196-L200 PolarHBondContact O-N 3.19Å; S196-L200 WeakPolarHBondContact OG-CD1 3.3Å
197D95.6Very high92.4Very high0 Ų060.5 Ų60.50%031%0.311CS..Hα-helixtrans-57.9-43.9-175.5-179.872.2000111.3S25 L26 V27 Q93 V100 D184 L188 Q195 C201S25-D197 WeakPolarHBondContact CA-OD1 3.5Å; S25-D197 WeakPolarHBondContact CB-OD1 3.49Å; S25-D197 PolarHBondContact OG-OD1 3.15Å; L26-D197 PolarHBondContact N-OD1 3.04Å; L26-D197 PolarHBondContact N-OD2 3.34Å; V27-D197 WeakPolarHBondContact CG2-O 3.48Å; V27-D197 WeakPolarHBondContact CG2-OD1 3.47Å; V27-D197 PolarHBondContact N-OD1 3.47Å; V27-D197 VanDerWaalsContact N-OD1 3.17Å; Q93-D197 PolarHBondContact NE2-OD2 2.84Å; Q93-D197 VanDerWaalsContact NE2-OD2 3.11Å; Q93-D197 PolarHBondContact OE1-OD2 3.45Å; V100-D197 HydrophobicContact CG2-CB 3.98Å; D184-D197 VanDerWaalsContact OD1-CA 3.26Å; D184-D197 WeakPolarHBondContact OD1-CA 3.41Å; D184-D197 PolarHBondContact OD1-N 2.89Å; L188-D197 HydrophobicContact CD1-CB 4.28Å; L188-D197 HydrophobicContact CD2-CB 4.38Å; Q195-D197 VanDerWaalsContact C-N 3.32Å; Q195-D197 PolarHBondContact O-N 3.39Å; D197-C201 WeakPolarHBondContact O-CA 3.44Å; D197-C201 WeakPolarHBondContact O-CB 3.25Å; D197-C201 PolarHBondContact O-N 2.96Å
198A95.9Very high92.5Very high0 Ų057.7 Ų57.70%030%0.296CS..Hα-helixtrans-64.7-44.2178.500000112.5Q93 I94 Q195 S196 C201 L202Q93-A198 HydrophobicContact CB-CB 4.02Å; Q93-A198 HydrophobicContact CG-CB 3.97Å; I94-A198 HydrophobicContact CG1-CB 3.76Å; Q195-A198 PolarHBondContact O-N 2.81Å; S196-A198 VanDerWaalsContact C-N 3.31Å; S196-A198 PolarHBondContact O-N 2.66Å; A198-C201 WeakPolarHBondContact O-CB 3.42Å; A198-C201 PolarHBondContact O-N 3.5Å; A198-L202 WeakPolarHBondContact O-CG 3.48Å; A198-L202 PolarHBondContact O-N 2.86Å
199L95.5Very high92.5Very high103 Ų10358.7 Ų58.754%0.53930%0.301SS..Hα-helixtrans-67.4-45.4-179.8-67176.3000112.1I94 Q195 S196 C201 L202 L203I94-L199 HydrophobicContact CD1-CD2 4.16Å; Q195-L199 PolarHBondContact O-N 3.2Å; S196-L199 PolarHBondContact O-N 3.17Å; S196-L199 VanDerWaalsContact O-N 3.15Å; L199-C201 VanDerWaalsContact C-N 3.31Å; L199-L202 PolarHBondContact O-N 2.77Å; L199-L203 PolarHBondContact O-N 3.41Å; L199-L203 VanDerWaalsContact O-N 3.07Å
200L97Very high92.5Very high29 Ų2956.6 Ų56.615%0.15229%0.29CS..Hα-helixtrans-69.2-31.7178.1-73.3-177.2000112.1V27 I180 D184 L187 S196 L203 L204V27-L200 HydrophobicContact CG2-CB 3.7Å; I180-L200 HydrophobicContact CG2-CB 3.82Å; I180-L200 HydrophobicContact CG2-CD1 4.32Å; I180-L200 HydrophobicContact CG2-CD2 4.25Å; I180-L200 HydrophobicContact CG2-CG 4.36Å; D184-L200 HydrophobicContact CB-CD1 3.59Å; L187-L200 HydrophobicContact CD1-CD1 4.02Å; S196-L200 WeakPolarHBondContact O-CB 3.5Å; S196-L200 PolarHBondContact O-N 3.19Å; S196-L200 WeakPolarHBondContact OG-CD1 3.3Å; L200-L203 HydrophobicContact CD2-CD2 4.3Å; L200-L203 PolarHBondContact O-N 3.26Å; L200-L204 WeakPolarHBondContact O-CB 3.42Å; L200-L204 PolarHBondContact O-N 2.95Å
201C97.1Very high92.5Very high0 Ų053.4 Ų53.40%027%0.273CS..Hα-helixtrans-61.3-51.6170.8167.40000111L26 V27 V86 D197 A198 L199 L203 L204 A205L26-C201 HydrophobicContact CB-CB 3.75Å; L26-C201 VanDerWaalsContact CB-SG 3.53Å; V27-C201 HydrophobicContact CG2-CB 4.12Å; V86-C201 WeakPolarHBondContact CG1-SG 3.11Å; D197-C201 WeakPolarHBondContact O-CA 3.44Å; D197-C201 WeakPolarHBondContact O-CB 3.25Å; D197-C201 PolarHBondContact O-N 2.96Å; A198-C201 WeakPolarHBondContact O-CB 3.42Å; A198-C201 PolarHBondContact O-N 3.5Å; L199-C201 VanDerWaalsContact C-N 3.31Å; C201-L203 VanDerWaalsContact C-N 3.25Å; C201-L203 PolarHBondContact O-N 2.82Å; C201-L204 PolarHBondContact O-N 3.09Å; C201-A205 VanDerWaalsContact O-CB 3.3Å; C201-A205 WeakPolarHBondContact O-CB 3.24Å; C201-A205 PolarHBondContact O-N 3.37Å
202L97.1Very high93.2Very high33 Ų3347 Ų4717%0.17324%0.239CC..Hα-helixtrans-59.3-39.2178.6-69.3178000111.8V87 L91 I94 A198 L199 S206V87-L202 HydrophobicContact CB-CD2 4.24Å; V87-L202 HydrophobicContact CG1-CD2 3.89Å; V87-L202 HydrophobicContact CG2-CD2 4.32Å; L91-L202 HydrophobicContact CD2-CD1 4Å; L91-L202 HydrophobicContact CD2-CD2 4.41Å; L91-L202 HydrophobicContact CG-CD2 4.25Å; I94-L202 HydrophobicContact CD1-CD1 3.59Å; A198-L202 WeakPolarHBondContact O-CG 3.48Å; A198-L202 PolarHBondContact O-N 2.86Å; L199-L202 PolarHBondContact O-N 2.77Å; L202-S206 VanDerWaalsContact O-CB 3.27Å; L202-S206 WeakPolarHBondContact O-CB 3.46Å; L202-S206 PolarHBondContact O-N 3.24Å; L202-S206 PolarHBondContact O-OG 3.06Å
203L96Very high93.5Very high86 Ų8645 Ų4545%0.4523%0.225SC..Hα-helixtrans-60.5-54.8173.9177.262.3000111.3I180 L199 L200 C201 A205 S206 M207I180-L203 HydrophobicContact CD1-CD2 4.09Å; I180-L203 HydrophobicContact CD1-CG 4.29Å; L199-L203 PolarHBondContact O-N 3.41Å; L199-L203 VanDerWaalsContact O-N 3.07Å; L200-L203 HydrophobicContact CD2-CD2 4.3Å; L200-L203 PolarHBondContact O-N 3.26Å; C201-L203 VanDerWaalsContact C-N 3.25Å; C201-L203 PolarHBondContact O-N 2.82Å; L203-A205 PolarHBondContact O-N 3.25Å; L203-S206 PolarHBondContact O-N 2.76Å; L203-M207 HydrophobicContact CD1-SD 4.44Å; L203-M207 HydrophobicContact CG-SD 4.34Å; L203-M207 WeakPolarHBondContact O-CG 2.98Å; L203-M207 PolarHBondContact O-N 2.84Å
204L96.9Very high93.6Very high0 Ų040.9 Ų40.90%021%0.21CC..Hα-helixtrans-65.1-38.2-177.3-17754.3000112.1V27 V30 Y31 L173 I180 L200 C201 M207 L208V27-L204 HydrophobicContact CG1-CD2 4.46Å; V30-L204 HydrophobicContact CB-CB 4.48Å; V30-L204 HydrophobicContact CB-CD2 3.98Å; V30-L204 HydrophobicContact CB-CG 4.07Å; V30-L204 HydrophobicContact CG1-CB 4.17Å; V30-L204 HydrophobicContact CG1-CD2 4.05Å; V30-L204 HydrophobicContact CG1-CG 3.63Å; Y31-L204 HydrophobicContact CD2-CD2 4.4Å; L173-L204 HydrophobicContact CD1-CD1 4.28Å; I180-L204 HydrophobicContact CD1-CB 4.14Å; I180-L204 HydrophobicContact CD1-CD1 4.22Å; L200-L204 WeakPolarHBondContact O-CB 3.42Å; L200-L204 PolarHBondContact O-N 2.95Å; C201-L204 PolarHBondContact O-N 3.09Å; L204-M207 PolarHBondContact O-N 3.13Å; L204-L208 WeakPolarHBondContact O-CB 3.23Å; L204-L208 PolarHBondContact O-N 3.46Å
205A97.8Very high94.1Very high0 Ų034.2 Ų34.20%018%0.181CC..Hα-helixtrans-66.3-40.3176.900000111.4V30 V87 C201 L203 M207 L208 I209V30-A205 HydrophobicContact CG1-CB 4.18Å; V30-A205 HydrophobicContact CG2-CB 4.02Å; V87-A205 HydrophobicContact CG2-CB 3.55Å; C201-A205 VanDerWaalsContact O-CB 3.3Å; C201-A205 WeakPolarHBondContact O-CB 3.24Å; C201-A205 PolarHBondContact O-N 3.37Å; L203-A205 PolarHBondContact O-N 3.25Å; A205-M207 VanDerWaalsContact C-N 3.34Å; A205-M207 PolarHBondContact O-N 3.35Å; A205-L208 PolarHBondContact O-N 2.99Å; A205-I209 WeakPolarHBondContact O-CG1 2.94Å; A205-I209 PolarHBondContact O-N 2.79Å
206S92.7Very high94.3Very high72 Ų7229.8 Ų29.850%0.50316%0.161SC..Hα-helixtrans-63.5-40.6174-59.50000111.7L202 L203 I209 G210L202-S206 VanDerWaalsContact O-CB 3.27Å; L202-S206 WeakPolarHBondContact O-CB 3.46Å; L202-S206 PolarHBondContact O-N 3.24Å; L202-S206 PolarHBondContact O-OG 3.06Å; L203-S206 PolarHBondContact O-N 2.76Å; S206-I209 PolarHBondContact O-N 2.96Å; S206-G210 PolarHBondContact O-N 2.9Å
207M93.7Very high94.2Very high57 Ų5732.5 Ų32.528%0.28117%0.174SC..Hα-helixtrans-62.9-42.3174.1-69.1178.269.100111.9L173 C176 I180 L203 L204 A205 T211L173-M207 HydrophobicContact CD1-CB 3.93Å; C176-M207 HydrophobicContact CB-CE 3.43Å; C176-M207 VanDerWaalsContact CB-CE 3.43Å; C176-M207 HydrophobicContact CB-SD 4.41Å; I180-M207 HydrophobicContact CD1-SD 4.09Å; L203-M207 HydrophobicContact CD1-SD 4.44Å; L203-M207 HydrophobicContact CG-SD 4.34Å; L203-M207 WeakPolarHBondContact O-CG 2.98Å; L203-M207 PolarHBondContact O-N 2.84Å; L204-M207 PolarHBondContact O-N 3.13Å; A205-M207 VanDerWaalsContact C-N 3.34Å; A205-M207 PolarHBondContact O-N 3.35Å; M207-T211 VanDerWaalsContact O-CB 3.29Å; M207-T211 WeakPolarHBondContact O-CB 3.49Å; M207-T211 PolarHBondContact O-N 2.94Å; M207-T211 PolarHBondContact O-OG1 2.68Å
208L95.8Very high94Very high0 Ų034 Ų340%018%0.18CC..Hα-helixtrans-61.9-49.7176.3173.159.8000111.1V30 L33 V34 V79 A83 L173 L204 A205 T211 M212V30-L208 HydrophobicContact CG1-CD2 4.07Å; L33-L208 HydrophobicContact CB-CD2 3.92Å; L33-L208 HydrophobicContact CD1-CD2 4.46Å; V34-L208 HydrophobicContact CG2-CD1 4.26Å; V34-L208 HydrophobicContact CG2-CD2 4.46Å; V79-L208 HydrophobicContact CG1-CD1 3.66Å; V79-L208 HydrophobicContact CG1-CD2 3.76Å; V79-L208 HydrophobicContact CG1-CG 4.04Å; A83-L208 HydrophobicContact CB-CD2 3.79Å; A83-L208 HydrophobicContact CB-CG 4.29Å; L173-L208 HydrophobicContact CD1-CB 4.42Å; L173-L208 HydrophobicContact CD2-CB 4.46Å; L173-L208 HydrophobicContact CD2-CD1 3.66Å; L204-L208 WeakPolarHBondContact O-CB 3.23Å; L204-L208 PolarHBondContact O-N 3.46Å; A205-L208 PolarHBondContact O-N 2.99Å; L208-T211 PolarHBondContact O-N 3.37Å; L208-M212 HydrophobicContact CD1-CE 4.15Å; L208-M212 HydrophobicContact CD1-CG 3.83Å; L208-M212 WeakPolarHBondContact O-CB 3.43Å; L208-M212 VanDerWaalsContact O-CG 3.28Å; L208-M212 WeakPolarHBondContact O-CG 3.47Å; L208-M212 PolarHBondContact O-N 3.29Å
209I94.5Very high93.9Very high40 Ų4034 Ų3421%0.20518%0.18CC..Hα-helixtrans-61.1-50.6177.9-66.9165.3000110.4A83 L84 V87 A205 S206 T211 M212 Y213A83-I209 HydrophobicContact CB-CD1 4Å; A83-I209 HydrophobicContact CB-CG1 3.71Å; L84-I209 HydrophobicContact CD2-CD1 3.8Å; L84-I209 HydrophobicContact CG-CD1 4.23Å; V87-I209 HydrophobicContact CG2-CD1 4.39Å; A205-I209 WeakPolarHBondContact O-CG1 2.94Å; A205-I209 PolarHBondContact O-N 2.79Å; S206-I209 PolarHBondContact O-N 2.96Å; I209-T211 PolarHBondContact O-N 3.37Å; I209-M212 PolarHBondContact O-N 3.49Å; I209-M212 VanDerWaalsContact O-N 3.14Å; I209-Y213 VanDerWaalsContact O-CB 3.23Å; I209-Y213 WeakPolarHBondContact O-CB 3.17Å; I209-Y213 PolarHBondContact O-N 3.33Å
210G89.8Confident93.9Very high18 Ų1829.6 Ų29.619%0.18616%0.16CC..Hα-helixtrans-60.1-32.3179.500000113.2S206 P214S206-G210 PolarHBondContact O-N 2.9Å; G210-P214 WeakPolarHBondContact O-CD 3.16Å
211T90.3Very high93.7Very high20 Ų2035.1 Ų35.112%0.12318%0.179CC..Hα-helixtrans-73.6-44.5174.6-57.40000111.7P169 L173 M207 L208 I209 P214 L215P169-T211 HydrophobicContact CB-CG2 3.89Å; L173-T211 HydrophobicContact CD2-CG2 4.22Å; M207-T211 VanDerWaalsContact O-CB 3.29Å; M207-T211 WeakPolarHBondContact O-CB 3.49Å; M207-T211 PolarHBondContact O-N 2.94Å; M207-T211 PolarHBondContact O-OG1 2.68Å; L208-T211 PolarHBondContact O-N 3.37Å; I209-T211 PolarHBondContact O-N 3.37Å; T211-P214 WeakPolarHBondContact O-CD 3.42Å; T211-P214 WeakPolarHBondContact O-CG 3.15Å; T211-L215 WeakPolarHBondContact O-CD1 3.37Å
212M93.4Very high93.5Very high1 Ų135.3 Ų35.31%0.00518%0.179CC..Hα-helixtrans-80.7-25.9-174.1-65.2-59.4145.600113.7F37 T76 Q80 L173 L208 I209 L215 A216F37-M212 HydrophobicContact CD1-CE 4.3Å; F37-M212 HydrophobicContact CD2-CE 3.92Å; F37-M212 HydrophobicContact CD2-SD 3.65Å; F37-M212 HydrophobicContact CE1-CE 4.36Å; F37-M212 HydrophobicContact CE2-CE 3.94Å; F37-M212 HydrophobicContact CE2-SD 3.47Å; F37-M212 WeakPolarHBondContact CE2-SD 3.43Å; F37-M212 HydrophobicContact CG-CE 4.1Å; F37-M212 HydrophobicContact CG-SD 4.42Å; F37-M212 HydrophobicContact CZ-CE 4.16Å; F37-M212 HydrophobicContact CZ-SD 4.13Å; T76-M212 HydrophobicContact CG2-SD 3.99Å; Q80-M212 HydrophobicContact CG-CB 3.58Å; Q80-M212 PolarHBondContact NE2-O 3.15Å; L173-M212 HydrophobicContact CD2-CE 3.97Å; L208-M212 HydrophobicContact CD1-CE 4.15Å; L208-M212 HydrophobicContact CD1-CG 3.83Å; L208-M212 WeakPolarHBondContact O-CB 3.43Å; L208-M212 VanDerWaalsContact O-CG 3.28Å; L208-M212 WeakPolarHBondContact O-CG 3.47Å; L208-M212 PolarHBondContact O-N 3.29Å; I209-M212 PolarHBondContact O-N 3.49Å; I209-M212 VanDerWaalsContact O-N 3.14Å; M212-L215 WeakPolarHBondContact O-CB 3.49Å; M212-L215 PolarHBondContact O-N 3.27Å; M212-L215 HydrophobicContact SD-CD2 4.37Å; M212-A216 WeakPolarHBondContact O-CB 3.21Å; M212-A216 PolarHBondContact O-N 3.32Å
213Y91.4Very high93.3Very high129 Ų12936.2 Ų36.251%0.50618%0.184SC..Hα-helixtrans-56.9-52.1-179.7-178.5-108.2000114.1I209 L215 A216 L217I209-Y213 VanDerWaalsContact O-CB 3.23Å; I209-Y213 WeakPolarHBondContact O-CB 3.17Å; I209-Y213 PolarHBondContact O-N 3.33Å; Y213-L215 VanDerWaalsContact C-N 3.29Å; Y213-L215 PolarHBondContact O-N 3.32Å; Y213-A216 PolarHBondContact O-N 3.16Å; Y213-L217 HydrophobicContact CD1-CD1 3.9Å; Y213-L217 HydrophobicContact CD1-CG 4.42Å; Y213-L217 HydrophobicContact CD2-CG 4.45Å; Y213-L217 HydrophobicContact CE1-CD1 3.3Å; Y213-L217 HydrophobicContact CE1-CG 4.06Å; Y213-L217 HydrophobicContact CE2-CD1 4.16Å; Y213-L217 HydrophobicContact CE2-CD2 4.27Å; Y213-L217 HydrophobicContact CE2-CG 4.07Å; Y213-L217 VanDerWaalsContact CZ-CD1 3.46Å; Y213-L217 WeakPolarHBondContact O-CG 3.45Å; Y213-L217 PolarHBondContact O-N 3.37Å
214P90.4Very high93.2Very high27 Ų2739 Ų3918%0.17520%0.199CC..Hα-helixtrans-64.9-32.2177.624-32.8000112.8I141 G210 T211 Y218I141-P214 HydrophobicContact CD1-CG 3.53Å; I141-P214 HydrophobicContact CG1-CG 4.36Å; G210-P214 WeakPolarHBondContact O-CD 3.16Å; T211-P214 WeakPolarHBondContact O-CD 3.42Å; T211-P214 WeakPolarHBondContact O-CG 3.15Å; P214-Y218 VanDerWaalsContact O-CB 3.3Å; P214-Y218 WeakPolarHBondContact O-CB 3.37Å; P214-Y218 PolarHBondContact O-N 3.35Å
215L92.1Very high92.9Very high0 Ų044 Ų440%022%0.222CC..Hα-helixtrans-64.6-44.2174.2-84.466.2000110.9T76 M129 V132 I133 S136 I170 T211 M212 Y213 T219T76-L215 HydrophobicContact CG2-CB 3.92Å; T76-L215 HydrophobicContact CG2-CD2 4.28Å; M129-L215 HydrophobicContact SD-CD2 4.34Å; V132-L215 HydrophobicContact CG1-CB 4.17Å; V132-L215 HydrophobicContact CG1-CD2 4.46Å; V132-L215 HydrophobicContact CG1-CG 3.88Å; I133-L215 HydrophobicContact CG1-CD2 4.35Å; S136-L215 VanDerWaalsContact OG-CD1 3.26Å; S136-L215 WeakPolarHBondContact OG-CD1 3.38Å; I170-L215 HydrophobicContact CD1-CD2 4.3Å; T211-L215 WeakPolarHBondContact O-CD1 3.37Å; M212-L215 WeakPolarHBondContact O-CB 3.49Å; M212-L215 PolarHBondContact O-N 3.27Å; M212-L215 HydrophobicContact SD-CD2 4.37Å; Y213-L215 VanDerWaalsContact C-N 3.29Å; Y213-L215 PolarHBondContact O-N 3.32Å; L215-T219 WeakPolarHBondContact O-CG2 3.18Å; L215-T219 PolarHBondContact O-N 3.12Å; L215-T219 PolarHBondContact O-OG1 3.42Å
216A94.1Very high92.5Very high2 Ų245.8 Ų45.82%0.01724%0.237CC..Hα-helixtrans-68.4-41.2178.100000112.3F73 M77 M212 Y213 T219 G220F73-A216 WeakPolarHBondContact CD2-O 3.49Å; M77-A216 HydrophobicContact CE-CB 3.38Å; M212-A216 WeakPolarHBondContact O-CB 3.21Å; M212-A216 PolarHBondContact O-N 3.32Å; Y213-A216 PolarHBondContact O-N 3.16Å; A216-T219 WeakPolarHBondContact CA-OG1 3.11Å; A216-T219 PolarHBondContact O-OG1 3.09Å; A216-G220 WeakPolarHBondContact O-CA 3.2Å; A216-G220 PolarHBondContact O-N 3.25Å
217L91.7Very high92.3Very high66 Ų6644.3 Ų44.335%0.34623%0.226SC..Hα-helixtrans-62.5-44.3174.9-76.9-177.4000112Y213 G220 R221Y213-L217 HydrophobicContact CD1-CD1 3.9Å; Y213-L217 HydrophobicContact CD1-CG 4.42Å; Y213-L217 HydrophobicContact CD2-CG 4.45Å; Y213-L217 HydrophobicContact CE1-CD1 3.3Å; Y213-L217 HydrophobicContact CE1-CG 4.06Å; Y213-L217 HydrophobicContact CE2-CD1 4.16Å; Y213-L217 HydrophobicContact CE2-CD2 4.27Å; Y213-L217 HydrophobicContact CE2-CG 4.07Å; Y213-L217 VanDerWaalsContact CZ-CD1 3.46Å; Y213-L217 WeakPolarHBondContact O-CG 3.45Å; Y213-L217 PolarHBondContact O-N 3.37Å; L217-G220 PolarHBondContact O-N 3.27Å; L217-R221 WeakPolarHBondContact O-CG 3.33Å; L217-R221 PolarHBondContact O-N 3.07Å
218Y91.2Very high91.7Very high30 Ų3042.1 Ų42.112%0.11822%0.216CC..Hα-helixtrans-62.5-49.7179.6178.8-101.1000111.4H131 V132 A135 P214 G220 R221 I222 F261H131-Y218 PolarHBondContact CE1-OH 2.9Å; H131-Y218 VanDerWaalsContact CE1-OH 3.27Å; V132-Y218 HydrophobicContact CG1-CD1 4.12Å; V132-Y218 HydrophobicContact CG2-CD1 4.37Å; V132-Y218 HydrophobicContact CG2-CE1 4.42Å; A135-Y218 HydrophobicContact CB-CD1 4.29Å; A135-Y218 HydrophobicContact CB-CD2 4.18Å; A135-Y218 HydrophobicContact CB-CE1 3.69Å; A135-Y218 HydrophobicContact CB-CE2 3.6Å; P214-Y218 VanDerWaalsContact O-CB 3.3Å; P214-Y218 WeakPolarHBondContact O-CB 3.37Å; P214-Y218 PolarHBondContact O-N 3.35Å; Y218-G220 VanDerWaalsContact C-N 3.35Å; Y218-G220 PolarHBondContact O-N 3.17Å; Y218-R221 WeakPolarHBondContact O-CB 3.47Å; Y218-R221 PolarHBondContact O-N 2.95Å; Y218-I222 HydrophobicContact CD1-CD1 4.2Å; Y218-I222 HydrophobicContact CE1-CD1 3.6Å; Y218-I222 PolarHBondContact O-N 3.42Å; Y218-F261 HydrophobicContact CE1-CD1 4.47Å; Y218-F261 HydrophobicContact CE1-CE1 4.39Å
219T94.3Very high91.1Very high0 Ų047 Ų470%025%0.25CC..Hα-helixtrans-66.2-37.1177.549.90000112.3V69 V72 V132 L215 A216 R221 I222 L223 F261V69-T219 HydrophobicContact CG1-CG2 4.46Å; V69-T219 WeakPolarHBondContact CG1-O 3.45Å; V72-T219 HydrophobicContact CB-CG2 4Å; V72-T219 HydrophobicContact CG1-CG2 3.83Å; V132-T219 HydrophobicContact CG1-CG2 4.02Å; V132-T219 HydrophobicContact CG2-CG2 3.89Å; L215-T219 WeakPolarHBondContact O-CG2 3.18Å; L215-T219 PolarHBondContact O-N 3.12Å; L215-T219 PolarHBondContact O-OG1 3.42Å; A216-T219 WeakPolarHBondContact CA-OG1 3.11Å; A216-T219 PolarHBondContact O-OG1 3.09Å; T219-R221 VanDerWaalsContact C-N 3.34Å; T219-R221 PolarHBondContact O-N 3.14Å; T219-I222 PolarHBondContact O-N 3.31Å; T219-L223 WeakPolarHBondContact O-CG 3.26Å; T219-L223 PolarHBondContact O-N 3.15Å; T219-F261 HydrophobicContact CG2-CE1 4.12Å; T219-F261 HydrophobicContact CG2-CZ 4.12Å
220G94.8Very high90.4Very high11 Ų1151.2 Ų51.211%0.11327%0.269CS..Hα-helixtrans-59.6-40.6173.300000112.8A216 L217 Y218 I222 L223 L224A216-G220 WeakPolarHBondContact O-CA 3.2Å; A216-G220 PolarHBondContact O-N 3.25Å; L217-G220 PolarHBondContact O-N 3.27Å; Y218-G220 VanDerWaalsContact C-N 3.35Å; Y218-G220 PolarHBondContact O-N 3.17Å; G220-I222 VanDerWaalsContact C-N 3.33Å; G220-I222 PolarHBondContact O-N 3.34Å; G220-L223 PolarHBondContact O-N 3.43Å; G220-L224 WeakPolarHBondContact O-CB 3.08Å; G220-L224 VanDerWaalsContact O-CG 3.3Å; G220-L224 WeakPolarHBondContact O-CG 3.21Å; G220-L224 PolarHBondContact O-N 2.91Å
221R92.5Very high90.2Very high146 Ų14651.2 Ų51.255%0.55127%0.265SS*.Hα-helixtrans-61-40.1174.3-76.8178.8177.4119.8-1.3112.7L217 Y218 T219 L224 Q225 A226L217-R221 WeakPolarHBondContact O-CG 3.33Å; L217-R221 PolarHBondContact O-N 3.07Å; Y218-R221 WeakPolarHBondContact O-CB 3.47Å; Y218-R221 PolarHBondContact O-N 2.95Å; T219-R221 VanDerWaalsContact C-N 3.34Å; T219-R221 PolarHBondContact O-N 3.14Å; R221-L224 CarbonylContact O-C 3.59Å; R221-L224 PolarHBondContact O-N 2.96Å; R221-Q225 PolarHBondContact O-N 2.94Å; R221-A226 HydrophobicContact CB-CB 4.08Å; R221-A226 VanDerWaalsContact O-CB 3.25Å; R221-A226 WeakPolarHBondContact O-CB 3.5Å; R221-A226 PolarHBondContact O-N 3.3Å
222I92.5Very high90.1Very high3 Ų353.7 Ų53.72%0.01528%0.277CS..Hα-helixtrans-66.2-41.9175.9-59.9172.9000110.6V69 Y218 T219 G220 L224 Q225 Q258 F261V69-I222 HydrophobicContact CB-CG2 4.39Å; V69-I222 HydrophobicContact CG1-CB 3.73Å; V69-I222 HydrophobicContact CG1-CD1 4.37Å; V69-I222 HydrophobicContact CG1-CG2 3.73Å; V69-I222 HydrophobicContact CG2-CG2 3.9Å; Y218-I222 HydrophobicContact CD1-CD1 4.2Å; Y218-I222 HydrophobicContact CE1-CD1 3.6Å; Y218-I222 PolarHBondContact O-N 3.42Å; T219-I222 PolarHBondContact O-N 3.31Å; G220-I222 VanDerWaalsContact C-N 3.33Å; G220-I222 PolarHBondContact O-N 3.34Å; I222-L224 VanDerWaalsContact C-N 3.28Å; I222-L224 PolarHBondContact O-N 3.33Å; I222-Q225 PolarHBondContact O-N 3.02Å; I222-Q258 HydrophobicContact CD1-CG 4.33Å; I222-Q258 HydrophobicContact CG1-CB 4.29Å; I222-Q258 HydrophobicContact CG1-CG 4.07Å; I222-Q258 HydrophobicContact CG2-CB 4.22Å; I222-Q258 HydrophobicContact CG2-CG 4.04Å; I222-F261 HydrophobicContact CD1-CD1 3.81Å; I222-F261 HydrophobicContact CD1-CE1 3.79Å
223L93Very high90Very high52 Ų5257.3 Ų57.327%0.27230%0.3SS..Hα-helixtrans-62.9-36.8176-67.8177000112.2V69 L70 F73 T219 G220 Q225V69-L223 HydrophobicContact CB-CD2 4.33Å; V69-L223 HydrophobicContact CG1-CD2 3.95Å; V69-L223 HydrophobicContact CG1-CG 3.94Å; L70-L223 HydrophobicContact CB-CD2 4.25Å; L70-L223 HydrophobicContact CD1-CD1 4.16Å; L70-L223 HydrophobicContact CD1-CD2 4.5Å; F73-L223 HydrophobicContact CB-CD1 3.79Å; F73-L223 HydrophobicContact CD1-CD1 3.73Å; F73-L223 HydrophobicContact CD2-CD1 4.27Å; F73-L223 HydrophobicContact CE1-CD1 4.4Å; F73-L223 HydrophobicContact CG-CD1 3.65Å; T219-L223 WeakPolarHBondContact O-CG 3.26Å; T219-L223 PolarHBondContact O-N 3.15Å; G220-L223 PolarHBondContact O-N 3.43Å; L223-Q225 PolarHBondContact O-N 3.28Å
224L93.5Very high90Very high144 Ų14455.8 Ų55.875%0.75430%0.298SS*.THydrogen-bonded Turntrans-75.76.8173.7-68.4173.6000113.8G220 R221 I222 A226G220-L224 WeakPolarHBondContact O-CB 3.08Å; G220-L224 VanDerWaalsContact O-CG 3.3Å; G220-L224 WeakPolarHBondContact O-CG 3.21Å; G220-L224 PolarHBondContact O-N 2.91Å; R221-L224 CarbonylContact O-C 3.59Å; R221-L224 PolarHBondContact O-N 2.96Å; I222-L224 VanDerWaalsContact C-N 3.28Å; I222-L224 PolarHBondContact O-N 3.33Å; L224-A226 VanDerWaalsContact C-N 3.26Å; L224-A226 PolarHBondContact O-N 3.41Å
225Q91.3Very high90Very high106 Ų10654.6 Ų54.650%0.49529%0.29SS..THydrogen-bonded Turntrans59.535.9178.6-56.1179.4-2300112.7R221 I222 L223 W257R221-Q225 PolarHBondContact O-N 2.94Å; I222-Q225 PolarHBondContact O-N 3.02Å; L223-Q225 PolarHBondContact O-N 3.28Å; Q225-W257 HydrophobicContact CB-CB 3.78Å; Q225-W257 HydrophobicContact CB-CG 4.07Å; Q225-W257 WeakPolarHBondContact O-CB 3.48Å
226A90.2Very high90Very high37 Ų3758.5 Ų58.531%0.30631%0.309SS..PPolyproline II helixtrans-71.8145.5174.300000111.3R221 L224 Q258R221-A226 HydrophobicContact CB-CB 4.08Å; R221-A226 VanDerWaalsContact O-CB 3.25Å; R221-A226 WeakPolarHBondContact O-CB 3.5Å; R221-A226 PolarHBondContact O-N 3.3Å; L224-A226 VanDerWaalsContact C-N 3.26Å; L224-A226 PolarHBondContact O-N 3.41Å; A226-Q258 PolarHBondContact O-N 3.35Å; A226-Q258 VanDerWaalsContact O-N 3.07Å
227C87.1Confident90Very high41 Ų4164.7 Ų64.728%0.27734%0.335SS..PPolyproline II helixtrans-73.7131.6165.8-171.60000109.5S229 F256C227-S229 PolarHBondContact O-N 3.35Å; C227-F256 WeakPolarHBondContact CB-O 3.5Å
228P82.8Confident90Very high12 Ų1262 Ų628%0.07832%0.322CS..PPolyproline II helixtrans-68.4130.1176.725.7-28.5000110.6H230 V231 L232 M264P228-H230 PolarHBondContact O-N 3.3Å; P228-H230 VanDerWaalsContact O-N 3.09Å; P228-V231 HydrophobicContact CB-CG2 4.45Å; P228-V231 HydrophobicContact CG-CB 4.1Å; P228-V231 HydrophobicContact CG-CG2 3.8Å; P228-V231 PolarHBondContact O-N 2.8Å; P228-V231 VanDerWaalsContact O-N 3.11Å; P228-L232 PolarHBondContact O-N 3.18Å; P228-M264 VanDerWaalsContact CD-SD 3.58Å; P228-M264 HydrophobicContact CG-CE 3.81Å; P228-M264 HydrophobicContact CG-SD 3.53Å; P228-M264 VanDerWaalsContact CG-SD 3.53Å
229S81.6Confident90.2Very high101 Ų10161.4 Ų61.471%0.70632%0.32SS*.THydrogen-bonded Turntrans-62.6-20.6-173.655.30000115C227 P233C227-S229 PolarHBondContact O-N 3.35Å; S229-P233 WeakPolarHBondContact O-CD 3.37Å
230H81.4Confident90.1Very high130 Ų13069.3 Ų69.360%0.60235%0.35SS*.THydrogen-bonded Turntrans-81.6-26.5178.562.3-87.4000113.1P228P228-H230 PolarHBondContact O-N 3.3Å; P228-H230 VanDerWaalsContact O-N 3.09Å
231V85.5Confident90.1Very high17 Ų1772 Ų7210%0.10336%0.36CS..THydrogen-bonded Turntrans-88.8-27.2178.5-173.70000111.1P228 E234 L235 Y292P228-V231 HydrophobicContact CB-CG2 4.45Å; P228-V231 HydrophobicContact CG-CB 4.1Å; P228-V231 HydrophobicContact CG-CG2 3.8Å; P228-V231 PolarHBondContact O-N 2.8Å; P228-V231 VanDerWaalsContact O-N 3.11Å; V231-E234 PolarHBondContact O-N 2.82Å; V231-E234 VanDerWaalsContact O-N 3.11Å; V231-L235 WeakPolarHBondContact O-CB 3.2Å; V231-L235 PolarHBondContact O-N 2.69Å; V231-Y292 HydrophobicContact CG1-CD1 4.31Å
232L87.8Confident90.1Very high73 Ų7365 Ų6538%0.38233%0.334SS..Hα-helixtrans-50.4-47.4-176.2-17667.4000113.9P228 E234 L235 E236P228-L232 PolarHBondContact O-N 3.18Å; L232-E234 VanDerWaalsContact C-N 3.35Å; L232-E234 PolarHBondContact O-N 3.08Å; L232-L235 PolarHBondContact O-N 3.24Å; L232-E236 HydrophobicContact CD1-CG 4.46Å; L232-E236 WeakPolarHBondContact O-CG 3.25Å; L232-E236 PolarHBondContact O-N 2.95Å
233P90.4Very high90.2Very high76 Ų7667.3 Ų67.349%0.49435%0.349SS..Hα-helixtrans-66.2-34.7-179.2-20.534000113.7S229 K237S229-P233 WeakPolarHBondContact O-CD 3.37Å; P233-K237 PolarHBondContact O-N 3.07Å; P233-K237 VanDerWaalsContact O-N 3.14Å
234E91.1Very high90.2Very high97 Ų9770.2 Ų70.245%0.45337%0.37SS..Hα-helixtrans-70.7-40177.9-62.4-177.5156.300110.4V231 L232 K237 C238 Y292V231-E234 PolarHBondContact O-N 2.82Å; V231-E234 VanDerWaalsContact O-N 3.11Å; L232-E234 VanDerWaalsContact C-N 3.35Å; L232-E234 PolarHBondContact O-N 3.08Å; E234-K237 WeakPolarHBondContact O-CB 3.46Å; E234-K237 PolarHBondContact O-N 2.68Å; E234-C238 PolarHBondContact O-N 2.93Å; E234-C238 PolarHBondContact O-SG 3.09Å; E234-Y292 HydrophobicContact CB-CD1 4.41Å; E234-Y292 HydrophobicContact CB-CE1 3.88Å; E234-Y292 VanDerWaalsContact OE2-CE1 3.23Å; E234-Y292 WeakPolarHBondContact OE2-CE1 3.44Å
235L91.4Very high90.1Very high2 Ų264.4 Ų64.41%0.0134%0.339CS..Hα-helixtrans-66.5-43.9177.5-167.256000112.1V231 L232 K237 C238 L239 F256 L289 V293V231-L235 WeakPolarHBondContact O-CB 3.2Å; V231-L235 PolarHBondContact O-N 2.69Å; L232-L235 PolarHBondContact O-N 3.24Å; L235-K237 VanDerWaalsContact C-N 3.25Å; L235-K237 PolarHBondContact O-N 3.08Å; L235-C238 WeakPolarHBondContact O-CB 3.24Å; L235-C238 PolarHBondContact O-N 2.95Å; L235-C238 VanDerWaalsContact O-N 3.15Å; L235-L239 WeakPolarHBondContact O-CG 3.44Å; L235-L239 PolarHBondContact O-N 3.1Å; L235-F256 HydrophobicContact CD1-CD1 4.24Å; L235-F256 HydrophobicContact CD1-CE1 3.82Å; L235-F256 HydrophobicContact CD1-CE2 4.11Å; L235-F256 HydrophobicContact CD1-CZ 3.73Å; L235-F256 HydrophobicContact CD2-CB 3.65Å; L235-F256 HydrophobicContact CD2-CD1 3.64Å; L235-F256 HydrophobicContact CD2-CD2 3.21Å; L235-F256 HydrophobicContact CD2-CE1 3.99Å; L235-F256 HydrophobicContact CD2-CE2 3.57Å; L235-F256 HydrophobicContact CD2-CG 3.23Å; L235-F256 HydrophobicContact CD2-CZ 3.93Å; L235-F256 HydrophobicContact CG-CD1 4.39Å; L235-F256 HydrophobicContact CG-CD2 3.92Å; L235-F256 HydrophobicContact CG-CE1 4.24Å; L235-F256 HydrophobicContact CG-CE2 3.71Å; L235-F256 HydrophobicContact CG-CG 4.22Å; L235-F256 HydrophobicContact CG-CZ 3.88Å; L235-L289 HydrophobicContact CD1-CD2 3.57Å; L235-V293 HydrophobicContact CD1-CG2 4.13Å
236E92.3Very high90.1Very high83 Ų8365.3 Ų65.339%0.38835%0.347SS..Hα-helixtrans-58.2-38.9172.4-76.1179.4-165.400111.8L232 L239 R240L232-E236 HydrophobicContact CD1-CG 4.46Å; L232-E236 WeakPolarHBondContact O-CG 3.25Å; L232-E236 PolarHBondContact O-N 2.95Å; E236-L239 PolarHBondContact O-N 3.27Å; E236-R240 VanDerWaalsContact O-CG 3.27Å; E236-R240 WeakPolarHBondContact O-CG 3.49Å; E236-R240 PolarHBondContact O-N 2.84Å; E236-R240 IonicContact OE2-NH2 3.31Å
237K93.5Very high90.1Very high132 Ų13263.7 Ų63.757%0.57433%0.334SS*.Hα-helixtrans-63.7-47.3174.8-177.6-172.9172.2-169.80111P233 E234 L235 L239 R240 E241P233-K237 PolarHBondContact O-N 3.07Å; P233-K237 VanDerWaalsContact O-N 3.14Å; E234-K237 WeakPolarHBondContact O-CB 3.46Å; E234-K237 PolarHBondContact O-N 2.68Å; L235-K237 VanDerWaalsContact C-N 3.25Å; L235-K237 PolarHBondContact O-N 3.08Å; K237-L239 VanDerWaalsContact C-N 3.33Å; K237-L239 PolarHBondContact O-N 2.93Å; K237-R240 PolarHBondContact O-N 3.43Å; K237-E241 WeakPolarHBondContact CE-OE1 3.35Å; K237-E241 PolarHBondContact O-N 2.9Å
238C92.9Very high90.4Very high9 Ų962.5 Ų62.56%0.06133%0.326CS..Hα-helixtrans-60.1-42.2176.9-720000112.1E234 L235 R240 E241 V242 L289 Y292E234-C238 PolarHBondContact O-N 2.93Å; E234-C238 PolarHBondContact O-SG 3.09Å; L235-C238 WeakPolarHBondContact O-CB 3.24Å; L235-C238 PolarHBondContact O-N 2.95Å; L235-C238 VanDerWaalsContact O-N 3.15Å; C238-R240 VanDerWaalsContact C-N 3.34Å; C238-R240 PolarHBondContact O-N 3.2Å; C238-E241 WeakPolarHBondContact O-CB 3.05Å; C238-E241 PolarHBondContact O-N 2.99Å; C238-E241 VanDerWaalsContact O-N 3.16Å; C238-V242 WeakPolarHBondContact O-CG2 3.4Å; C238-V242 PolarHBondContact O-N 3.11Å; C238-L289 HydrophobicContact CB-CD2 3.89Å; C238-Y292 WeakPolarHBondContact SG-CE2 3.49Å
239L93.7Very high90.8Very high17 Ų1766.5 Ų66.59%0.08935%0.346CS..Hα-helixtrans-62.7-37.8176-73.5-178.1000113L235 E236 K237 E241 V242 S243 V251 D254 F256 V268 L289L235-L239 WeakPolarHBondContact O-CG 3.44Å; L235-L239 PolarHBondContact O-N 3.1Å; E236-L239 PolarHBondContact O-N 3.27Å; K237-L239 VanDerWaalsContact C-N 3.33Å; K237-L239 PolarHBondContact O-N 2.93Å; L239-E241 VanDerWaalsContact C-N 3.32Å; L239-V242 WeakPolarHBondContact O-CB 3.29Å; L239-V242 PolarHBondContact O-N 3.46Å; L239-S243 PolarHBondContact O-N 2.92Å; L239-V251 HydrophobicContact CD2-CG1 4.21Å; L239-D254 HydrophobicContact CD1-CB 3.92Å; L239-D254 WeakPolarHBondContact CD1-OD2 3.19Å; L239-F256 HydrophobicContact CD1-CE2 3.89Å; L239-F256 HydrophobicContact CD1-CZ 4.39Å; L239-F256 HydrophobicContact CD2-CE2 4.46Å; L239-F256 HydrophobicContact CD2-CZ 4.15Å; L239-F256 HydrophobicContact CG-CE2 4.42Å; L239-F256 HydrophobicContact CG-CZ 4.46Å; L239-V268 HydrophobicContact CD2-CG1 4.2Å; L239-V268 HydrophobicContact CD2-CG2 4.33Å; L239-L289 HydrophobicContact CD2-CD1 4.44Å; L239-L289 HydrophobicContact CD2-CD2 4.33Å
240R93.6Very high91.3Very high166 Ų16665.8 Ų65.863%0.62633%0.331SS*.Hα-helixtrans-66.4-34173.8-69.9172.7-165.9-167.98.6112.5E236 K237 C238 V242 S243 T244E236-R240 VanDerWaalsContact O-CG 3.27Å; E236-R240 WeakPolarHBondContact O-CG 3.49Å; E236-R240 PolarHBondContact O-N 2.84Å; E236-R240 IonicContact OE2-NH2 3.31Å; K237-R240 PolarHBondContact O-N 3.43Å; C238-R240 VanDerWaalsContact C-N 3.34Å; C238-R240 PolarHBondContact O-N 3.2Å; R240-V242 VanDerWaalsContact C-N 3.34Å; R240-S243 WeakPolarHBondContact CA-OG 3.08Å; R240-S243 PolarHBondContact O-OG 2.93Å; R240-T244 WeakPolarHBondContact O-CG2 3.21Å; R240-T244 PolarHBondContact O-N 2.87Å; R240-T244 PolarHBondContact O-OG1 2.86Å
241E93.8Very high91.7Very high68 Ų6861.1 Ų61.132%0.31831%0.312SS..Hα-helixtrans-69.7-34.3172.6-67.7177.3-164.700111.7K237 C238 L239 T244 M245 K288K237-E241 WeakPolarHBondContact CE-OE1 3.35Å; K237-E241 PolarHBondContact O-N 2.9Å; C238-E241 WeakPolarHBondContact O-CB 3.05Å; C238-E241 PolarHBondContact O-N 2.99Å; C238-E241 VanDerWaalsContact O-N 3.16Å; L239-E241 VanDerWaalsContact C-N 3.32Å; E241-T244 WeakPolarHBondContact CA-OG1 3.48Å; E241-T244 PolarHBondContact O-OG1 2.93Å; E241-M245 WeakPolarHBondContact O-CG 3.42Å; E241-K288 HydrophobicContact CB-CD 4.11Å; E241-K288 IonicContact OE2-NZ 3.81Å; E241-K288 PolarHBondContact OE2-NZ 3.04Å
242V93.4Very high91.7Very high0 Ų062.7 Ų62.70%033%0.326CS..Hα-helixtrans-67.5-43.3174.1167.80000111C238 L239 R240 T244 M245 V251 V270 T285 K288C238-V242 WeakPolarHBondContact O-CG2 3.4Å; C238-V242 PolarHBondContact O-N 3.11Å; L239-V242 WeakPolarHBondContact O-CB 3.29Å; L239-V242 PolarHBondContact O-N 3.46Å; R240-V242 VanDerWaalsContact C-N 3.34Å; V242-T244 PolarHBondContact O-N 3.31Å; V242-M245 HydrophobicContact CB-CE 4Å; V242-M245 HydrophobicContact CG1-CE 3.69Å; V242-M245 HydrophobicContact CG2-CE 4.08Å; V242-M245 WeakPolarHBondContact O-CB 3.39Å; V242-M245 WeakPolarHBondContact O-CG 3.39Å; V242-M245 PolarHBondContact O-N 2.85Å; V242-M245 VanDerWaalsContact O-N 3.16Å; V242-V251 HydrophobicContact CG1-CG2 3.98Å; V242-V270 HydrophobicContact CG1-CG2 4.14Å; V242-T285 HydrophobicContact CG1-CG2 3.98Å; V242-T285 HydrophobicContact CG2-CG2 4.08Å; V242-K288 HydrophobicContact CG2-CB 4.42Å; V242-K288 HydrophobicContact CG2-CD 4.01Å
243S93.1Very high91.7Very high50 Ų5062.9 Ų62.935%0.3533%0.328SS..Hα-helixtrans-67.4-19.8-179.770.50000113.9L239 R240L239-S243 PolarHBondContact O-N 2.92Å; R240-S243 WeakPolarHBondContact CA-OG 3.08Å; R240-S243 PolarHBondContact O-OG 2.93Å
244T93.6Very high91.8Very high114 Ų11462.7 Ų62.770%0.69932%0.323SS*.THydrogen-bonded Turntrans-92.91.2177.350.20000113.5R240 E241 V242R240-T244 WeakPolarHBondContact O-CG2 3.21Å; R240-T244 PolarHBondContact O-N 2.87Å; R240-T244 PolarHBondContact O-OG1 2.86Å; E241-T244 WeakPolarHBondContact CA-OG1 3.48Å; E241-T244 PolarHBondContact O-OG1 2.93Å; V242-T244 PolarHBondContact O-N 3.31Å
245M91.8Very high91.8Very high21 Ų2162.7 Ų62.710%0.10332%0.322CS..SBendtrans-69.4142.3175.7-66.5-164.2-72.900111.9E241 V242 G247 V248 I281 R284 T285E241-M245 WeakPolarHBondContact O-CG 3.42Å; V242-M245 HydrophobicContact CB-CE 4Å; V242-M245 HydrophobicContact CG1-CE 3.69Å; V242-M245 HydrophobicContact CG2-CE 4.08Å; V242-M245 WeakPolarHBondContact O-CB 3.39Å; V242-M245 WeakPolarHBondContact O-CG 3.39Å; V242-M245 PolarHBondContact O-N 2.85Å; V242-M245 VanDerWaalsContact O-N 3.16Å; M245-G247 PolarHBondContact O-N 2.92Å; M245-V248 HydrophobicContact CB-CG2 3.87Å; M245-V248 HydrophobicContact CE-CG2 4.32Å; M245-V248 WeakPolarHBondContact O-CB 3.38Å; M245-V248 PolarHBondContact O-N 3.23Å; M245-V248 VanDerWaalsContact O-N 3.09Å; M245-I281 HydrophobicContact CE-CG2 4.18Å; M245-R284 HydrophobicContact CE-CB 4.22Å; M245-R284 HydrophobicContact SD-CB 3.51Å; M245-R284 VanDerWaalsContact SD-CB 3.51Å; M245-R284 HydrophobicContact SD-CG 4.36Å; M245-T285 VanDerWaalsContact CE-OG1 3.24Å; M245-T285 WeakPolarHBondContact CE-OG1 2.78Å
246D91.3Very high91.9Very high125 Ų12563.5 Ų63.567%0.66833%0.326SS*.THydrogen-bonded Turntrans-61.4131.3177.1-171.820.9000111.3R273D246-R273 IonicContact OD1-CZ 2.63Å; D246-R273 IonicContact OD1-NH1 2.83Å; D246-R273 IonicContact OD1-NH2 3.63Å; D246-R273 PolarHBondContact OD1-NH2 3.16Å
247G90.9Very high91.9Very high3 Ų361.6 Ų61.63%0.03132%0.315CS..THydrogen-bonded Turntrans89.5-14.3-175.200000115.2M245 V272 R273M245-G247 PolarHBondContact O-N 2.92Å; G247-V272 CarbonylContact O-C 3.57Å; G247-V272 VanDerWaalsContact O-CA 3.3Å; G247-V272 WeakPolarHBondContact O-CA 3.23Å; G247-R273 PolarHBondContact O-N 3.14Å
248V93Very high91.8Very high17 Ų1756 Ų5610%0.10329%0.291CS..EExtended strand (participates in β ladder)trans-80.1130.7173.5179.70000109.6M245 V270 V272 I281M245-V248 HydrophobicContact CB-CG2 3.87Å; M245-V248 HydrophobicContact CE-CG2 4.32Å; M245-V248 WeakPolarHBondContact O-CB 3.38Å; M245-V248 PolarHBondContact O-N 3.23Å; M245-V248 VanDerWaalsContact O-N 3.09Å; V248-V270 HydrophobicContact CB-CG1 4.37Å; V248-V270 HydrophobicContact CG1-CG1 3.62Å; V248-V270 HydrophobicContact CG2-CG1 3.87Å; V248-V272 HydrophobicContact CG2-CG1 4.41Å; V248-I281 HydrophobicContact CG2-CD1 4.06Å; V248-I281 HydrophobicContact CG2-CG1 4.35Å; V248-I281 HydrophobicContact CG2-CG2 3.65Å
249L90.7Very high91.5Very high95 Ų9555.5 Ų55.550%0.49729%0.288SS..EExtended strand (participates in β ladder)trans-88.5-52.8174-70.2172.5000110.3R271 R273 A303L249-R271 WeakPolarHBondContact CB-O 3.45Å; L249-R271 PolarHBondContact N-O 3.44Å; L249-R273 HydrophobicContact CD1-CG 4.45Å; L249-R273 HydrophobicContact CD2-CG 3.66Å; L249-R273 HydrophobicContact CG-CG 3.88Å; L249-A303 HydrophobicContact CD1-CB 3.95Å
250E91.8Very high91.2Very high87 Ų8755.3 Ų55.341%0.40729%0.288SS..EExtended strand (participates in β ladder)trans-158.8156.1-179.962-173.9-179.800110.5A252 R271E250-A252 HydrophobicContact CG-CB 4.38Å; E250-R271 HydrophobicContact CG-CB 3.94Å; E250-R271 HydrophobicContact CG-CG 4.43Å; E250-R271 PolarHBondContact N-O 3.47Å; E250-R271 PolarHBondContact O-N 3.22Å; E250-R271 VanDerWaalsContact OE1-CD 3.28Å; E250-R271 WeakPolarHBondContact OE1-CD 3.31Å; E250-R271 IonicContact OE1-CZ 2.74Å; E250-R271 IonicContact OE1-NE 3.57Å; E250-R271 IonicContact OE1-NH1 3.79Å; E250-R271 PolarHBondContact OE1-NH1 2.9Å
251V90.9Very high90.9Very high32 Ų3248 Ų4819%0.19426%0.261CS..EExtended strand (participates in β ladder)trans-86.3105.8159.5179.30000105.3L239 V242 D254 V268L239-V251 HydrophobicContact CD2-CG1 4.21Å; V242-V251 HydrophobicContact CG1-CG2 3.98Å; V251-D254 HydrophobicContact CG1-CB 4.23Å; V251-V268 HydrophobicContact CG1-CG1 3.77Å
252A85.4Confident90.4Very high49 Ų4950.1 Ų50.141%0.40527%0.271SS..EExtended strand (participates in β ladder)trans-80.2-36.7-167.700000112.6E250 V269 R271E250-A252 HydrophobicContact CG-CB 4.38Å; A252-V269 HydrophobicContact CB-CG1 4.36Å; A252-V269 PolarHBondContact N-O 3.12Å; A252-R271 HydrophobicContact CB-CG 3.75Å
253D88.4Confident90.1Very high78 Ų7853 Ų5342%0.41728%0.283SS..EExtended strand (participates in β ladder)trans-149.8134.9178-163.35.8000109.9H255 V268 V269D253-H255 VanDerWaalsContact CG-CE1 3.44Å; D253-H255 IonicContact OD1-CE1 2.93Å; D253-H255 PolarHBondContact OD1-CE1 2.88Å; D253-H255 IonicContact OD1-ND1 2.69Å; D253-H255 PolarHBondContact OD1-ND1 3.37Å; D253-H255 IonicContact OD2-CE1 3.46Å; D253-H255 PolarHBondContact OD2-CE1 3.15Å; D253-H255 VanDerWaalsContact OD2-CE1 3.31Å; D253-H255 IonicContact OD2-ND1 2.68Å; D253-H255 PolarHBondContact OD2-ND1 3.15Å; D253-V268 CarbonylContact O-C 3.54Å; D253-V268 WeakPolarHBondContact O-CA 3.41Å; D253-V269 HydrophobicContact CB-CB 4.21Å; D253-V269 HydrophobicContact CB-CG2 4.17Å; D253-V269 PolarHBondContact O-N 2.92Å
254D90.6Very high90Very high71 Ų7151.4 Ų51.438%0.3827%0.271SS..EExtended strand (participates in β ladder)trans-139.6126.2177.670-91.7000110L239 V251 F256 V268L239-D254 HydrophobicContact CD1-CB 3.92Å; L239-D254 WeakPolarHBondContact CD1-OD2 3.19Å; V251-D254 HydrophobicContact CG1-CB 4.23Å; D254-F256 HydrophobicContact CB-CE2 3.78Å; D254-F256 HydrophobicContact CB-CZ 4.36Å; D254-V268 HydrophobicContact CB-CG2 4.35Å
255H92Very high89.9Confident97 Ų9746 Ų4645%0.44924%0.237SC..EExtended strand (participates in β ladder)trans-135.5123.1179-72.586.1000108.5D253 W257 G266 T267D253-H255 VanDerWaalsContact CG-CE1 3.44Å; D253-H255 IonicContact OD1-CE1 2.93Å; D253-H255 PolarHBondContact OD1-CE1 2.88Å; D253-H255 IonicContact OD1-ND1 2.69Å; D253-H255 PolarHBondContact OD1-ND1 3.37Å; D253-H255 IonicContact OD2-CE1 3.46Å; D253-H255 PolarHBondContact OD2-CE1 3.15Å; D253-H255 VanDerWaalsContact OD2-CE1 3.31Å; D253-H255 IonicContact OD2-ND1 2.68Å; D253-H255 PolarHBondContact OD2-ND1 3.15Å; H255-W257 HydrophobicContact CB-CE3 4.27Å; H255-W257 HydrophobicContact CB-CZ3 3.83Å; H255-W257 WeakPolarHBondContact O-CZ3 3.31Å; H255-G266 CarbonylContact O-C 3.59Å; H255-G266 WeakPolarHBondContact O-CA 3.4Å; H255-T267 PolarHBondContact N-O 3.48Å; H255-T267 PolarHBondContact O-N 3.38Å
256F93Very high90Very high20 Ų2045 Ų459%0.08823%0.233CC..EExtended strand (participates in β ladder)trans-130.6141.4178.7-55.3-85.7000110.5C227 L235 L239 D254 A265 V268 L289 V293 L296C227-F256 WeakPolarHBondContact CB-O 3.5Å; L235-F256 HydrophobicContact CD1-CD1 4.24Å; L235-F256 HydrophobicContact CD1-CE1 3.82Å; L235-F256 HydrophobicContact CD1-CE2 4.11Å; L235-F256 HydrophobicContact CD1-CZ 3.73Å; L235-F256 HydrophobicContact CD2-CB 3.65Å; L235-F256 HydrophobicContact CD2-CD1 3.64Å; L235-F256 HydrophobicContact CD2-CD2 3.21Å; L235-F256 HydrophobicContact CD2-CE1 3.99Å; L235-F256 HydrophobicContact CD2-CE2 3.57Å; L235-F256 HydrophobicContact CD2-CG 3.23Å; L235-F256 HydrophobicContact CD2-CZ 3.93Å; L235-F256 HydrophobicContact CG-CD1 4.39Å; L235-F256 HydrophobicContact CG-CD2 3.92Å; L235-F256 HydrophobicContact CG-CE1 4.24Å; L235-F256 HydrophobicContact CG-CE2 3.71Å; L235-F256 HydrophobicContact CG-CG 4.22Å; L235-F256 HydrophobicContact CG-CZ 3.88Å; L239-F256 HydrophobicContact CD1-CE2 3.89Å; L239-F256 HydrophobicContact CD1-CZ 4.39Å; L239-F256 HydrophobicContact CD2-CE2 4.46Å; L239-F256 HydrophobicContact CD2-CZ 4.15Å; L239-F256 HydrophobicContact CG-CE2 4.42Å; L239-F256 HydrophobicContact CG-CZ 4.46Å; D254-F256 HydrophobicContact CB-CE2 3.78Å; D254-F256 HydrophobicContact CB-CZ 4.36Å; F256-A265 WeakPolarHBondContact CA-O 3.38Å; F256-V268 HydrophobicContact CE1-CG2 3.71Å; F256-V268 HydrophobicContact CE2-CG2 4.27Å; F256-V268 HydrophobicContact CZ-CG2 3.35Å; F256-L289 HydrophobicContact CZ-CD2 4.45Å; F256-V293 HydrophobicContact CD1-CG1 4.43Å; F256-V293 HydrophobicContact CD1-CG2 3.67Å; F256-V293 HydrophobicContact CE1-CG2 3.81Å; F256-L296 HydrophobicContact CE1-CD1 4.36Å
257W92.6Very high90.1Very high43 Ų4341.6 Ų41.616%0.16322%0.216CC..EExtended strand (participates in β ladder)trans-148.8152.4-178.757.787.1000111.7Q225 H255 L259 M264 A265 T267Q225-W257 HydrophobicContact CB-CB 3.78Å; Q225-W257 HydrophobicContact CB-CG 4.07Å; Q225-W257 WeakPolarHBondContact O-CB 3.48Å; H255-W257 HydrophobicContact CB-CE3 4.27Å; H255-W257 HydrophobicContact CB-CZ3 3.83Å; H255-W257 WeakPolarHBondContact O-CZ3 3.31Å; W257-L259 PolarHBondContact O-N 2.91Å; W257-M264 WeakPolarHBondContact O-CE 3.17Å; W257-A265 HydrophobicContact CZ2-CB 4.16Å; W257-A265 PolarHBondContact N-O 3.41Å; W257-A265 PolarHBondContact O-N 3Å; W257-A265 VanDerWaalsContact O-O 3.08Å; W257-T267 HydrophobicContact CH2-CG2 3.93Å
258Q90.7Very high90.3Very high13 Ų1341.5 Ų41.56%0.06122%0.215CC..EExtended strand (participates in β ladder)trans-76.4120.2171.2-167.2161.213.200109.8I222 A226 S260 M264I222-Q258 HydrophobicContact CD1-CG 4.33Å; I222-Q258 HydrophobicContact CG1-CB 4.29Å; I222-Q258 HydrophobicContact CG1-CG 4.07Å; I222-Q258 HydrophobicContact CG2-CB 4.22Å; I222-Q258 HydrophobicContact CG2-CG 4.04Å; A226-Q258 PolarHBondContact O-N 3.35Å; A226-Q258 VanDerWaalsContact O-N 3.07Å; Q258-S260 WeakPolarHBondContact CG-O 3.43Å; Q258-S260 PolarHBondContact NE2-O 3.29Å; Q258-S260 VanDerWaalsContact NE2-O 3.09Å; Q258-M264 VanDerWaalsContact CA-SD 3.54Å; Q258-M264 HydrophobicContact CB-SD 3.78Å; Q258-M264 HydrophobicContact CG-SD 3.99Å
259L87.4Confident90.4Very high0 Ų042 Ų420%022%0.218CC..  trans-85.9-43.5179.1177.161.2000111.1Y62 E65 R66 W257 K263 A265 E295Y62-L259 HydrophobicContact CD1-CD1 4.17Å; Y62-L259 HydrophobicContact CD1-CD2 3.43Å; Y62-L259 VanDerWaalsContact CD1-CD2 3.43Å; Y62-L259 HydrophobicContact CD1-CG 4.45Å; Y62-L259 HydrophobicContact CD2-CD1 4.18Å; Y62-L259 HydrophobicContact CE1-CD2 3.8Å; Y62-L259 HydrophobicContact CG-CD1 3.94Å; Y62-L259 HydrophobicContact CG-CD2 4.01Å; E65-L259 WeakPolarHBondContact OE2-CD2 3.5Å; R66-L259 HydrophobicContact CG-CD1 4.14Å; R66-L259 VanDerWaalsContact CG-O 3.25Å; R66-L259 WeakPolarHBondContact CG-O 3.44Å; R66-L259 VanDerWaalsContact NE-CD1 3.34Å; W257-L259 PolarHBondContact O-N 2.91Å; L259-K263 HydrophobicContact CB-CB 4.38Å; L259-K263 WeakPolarHBondContact CB-O 3.45Å; L259-K263 HydrophobicContact CD2-CB 4.47Å; L259-K263 PolarHBondContact N-O 2.88Å; L259-A265 HydrophobicContact CB-CB 4.18Å; L259-E295 HydrophobicContact CD2-CG 4.22Å
260S88.2Confident90.6Very high13 Ų1337.5 Ų37.59%0.09119%0.194CC..SBendtrans-146.5-174.6178.871.90000110Q258 E262 K263Q258-S260 WeakPolarHBondContact CG-O 3.43Å; Q258-S260 PolarHBondContact NE2-O 3.29Å; Q258-S260 VanDerWaalsContact NE2-O 3.09Å; S260-E262 PolarHBondContact O-N 3.39Å; S260-E262 VanDerWaalsContact O-N 3.15Å; S260-E262 PolarHBondContact OG-N 3.11Å; S260-K263 PolarHBondContact N-O 2.87Å; S260-K263 VanDerWaalsContact N-O 3.17Å; S260-K263 PolarHBondContact OG-N 2.85Å; S260-K263 VanDerWaalsContact OG-N 3.14Å
261F86.7Confident90.7Very high13 Ų1337.9 Ų37.96%0.05719%0.192CC..SBendtrans-60.7-21.1174.3-63.1-46.3000113.6D68 V69 V72 S128 H131 V132 Y218 T219 I222D68-F261 HydrophobicContact CB-CD2 4.27Å; D68-F261 HydrophobicContact CB-CE2 3.98Å; V69-F261 HydrophobicContact CB-CE1 4.4Å; V69-F261 HydrophobicContact CB-CZ 4.1Å; V69-F261 HydrophobicContact CG1-CE1 4.38Å; V69-F261 HydrophobicContact CG1-CZ 4.4Å; V69-F261 HydrophobicContact CG2-CD1 4.16Å; V69-F261 HydrophobicContact CG2-CD2 4.29Å; V69-F261 HydrophobicContact CG2-CE1 3.85Å; V69-F261 HydrophobicContact CG2-CE2 4.01Å; V69-F261 HydrophobicContact CG2-CG 4.37Å; V69-F261 HydrophobicContact CG2-CZ 3.8Å; V72-F261 HydrophobicContact CB-CZ 4.5Å; V72-F261 HydrophobicContact CG2-CE2 4.4Å; V72-F261 HydrophobicContact CG2-CZ 4.27Å; S128-F261 VanDerWaalsContact CB-CE2 3.43Å; H131-F261 HydrophobicContact CB-CB 4.34Å; H131-F261 AromaticContact CE1-CD1 3.95Å; H131-F261 PolarHBondContact CE1-O 2.96Å; H131-F261 VanDerWaalsContact CE1-O 3.25Å; H131-F261 WeakPolarHBondContact ND1-CB 3.43Å; H131-F261 AromaticContact ND1-CD1 3.37Å; H131-F261 WeakPolarHBondContact ND1-CD1 3.44Å; H131-F261 AromaticContact ND1-CG 3.65Å; H131-F261 PolarHBondContact NE2-O 3.5Å; V132-F261 HydrophobicContact CG2-CD1 3.86Å; V132-F261 HydrophobicContact CG2-CE1 3.09Å; V132-F261 HydrophobicContact CG2-CE2 4.02Å; V132-F261 HydrophobicContact CG2-CZ 3.17Å; Y218-F261 HydrophobicContact CE1-CD1 4.47Å; Y218-F261 HydrophobicContact CE1-CE1 4.39Å; T219-F261 HydrophobicContact CG2-CE1 4.12Å; T219-F261 HydrophobicContact CG2-CZ 4.12Å; I222-F261 HydrophobicContact CD1-CD1 3.81Å; I222-F261 HydrophobicContact CD1-CE1 3.79Å
262E83.7Confident90.8Very high111 Ų11136.4 Ų36.452%0.51918%0.183SC..SBendtrans-120.1-21-173.5-67170.6-148.500113.6R127 S260R127-E262 WeakPolarHBondContact CD-OE1 3.46Å; R127-E262 IonicContact CZ-OE1 2.7Å; R127-E262 IonicContact CZ-OE2 2.64Å; R127-E262 IonicContact NE-OE1 2.84Å; R127-E262 PolarHBondContact NE-OE1 3.46Å; R127-E262 IonicContact NE-OE2 2.76Å; R127-E262 IonicContact NH1-OE1 3.25Å; R127-E262 PolarHBondContact NH1-OE1 3.07Å; R127-E262 IonicContact NH1-OE2 2.82Å; R127-E262 PolarHBondContact NH1-OE2 3.36Å; R127-E262 IonicContact NH2-OE1 2.75Å; R127-E262 PolarHBondContact NH2-OE1 2.62Å; R127-E262 IonicContact NH2-OE2 2.99Å; R127-E262 PolarHBondContact NH2-OE2 2.95Å; S260-E262 PolarHBondContact O-N 3.39Å; S260-E262 VanDerWaalsContact O-N 3.15Å; S260-E262 PolarHBondContact OG-N 3.11Å
263K87.3Confident91.1Very high60 Ų6038.6 Ų38.626%0.26118%0.181SC..  trans-113132-173.4-71.5178.1159.8-156.20111.5E65 L259 S260 A294 E295E65-K263 WeakPolarHBondContact OE1-CD 3.31Å; E65-K263 WeakPolarHBondContact OE1-CE 3.37Å; E65-K263 IonicContact OE1-NZ 3.64Å; E65-K263 PolarHBondContact OE1-NZ 3.18Å; E65-K263 WeakPolarHBondContact OE2-CD 3.36Å; E65-K263 IonicContact OE2-NZ 3.95Å; L259-K263 HydrophobicContact CB-CB 4.38Å; L259-K263 WeakPolarHBondContact CB-O 3.45Å; L259-K263 HydrophobicContact CD2-CB 4.47Å; L259-K263 PolarHBondContact N-O 2.88Å; S260-K263 PolarHBondContact N-O 2.87Å; S260-K263 VanDerWaalsContact N-O 3.17Å; S260-K263 PolarHBondContact OG-N 2.85Å; S260-K263 VanDerWaalsContact OG-N 3.14Å; K263-A294 HydrophobicContact CG-CB 4.41Å; K263-E295 IonicContact NZ-OE1 2.95Å; K263-E295 PolarHBondContact NZ-OE1 2.8Å
264M90.8Very high91.1Very high18 Ų1841.4 Ų41.49%0.08919%0.186CC..EExtended strand (participates in β ladder)trans-99.8142.3164.9-73-60.6-63.200108.9P228 W257 Q258 Y292 A294 E295P228-M264 VanDerWaalsContact CD-SD 3.58Å; P228-M264 HydrophobicContact CG-CE 3.81Å; P228-M264 HydrophobicContact CG-SD 3.53Å; P228-M264 VanDerWaalsContact CG-SD 3.53Å; W257-M264 WeakPolarHBondContact O-CE 3.17Å; Q258-M264 VanDerWaalsContact CA-SD 3.54Å; Q258-M264 HydrophobicContact CB-SD 3.78Å; Q258-M264 HydrophobicContact CG-SD 3.99Å; M264-Y292 WeakPolarHBondContact CB-O 3.43Å; M264-A294 PolarHBondContact O-N 3.3Å; M264-A294 VanDerWaalsContact O-N 3.08Å; M264-E295 PolarHBondContact O-N 2.81Å; M264-E295 VanDerWaalsContact O-N 3.1Å
265A91.9Very high91.1Very high0 Ų044.1 Ų44.10%020%0.2CC..EExtended strand (participates in β ladder)trans-125.8153.7173.300000109.3F256 W257 L259 E295F256-A265 WeakPolarHBondContact CA-O 3.38Å; W257-A265 HydrophobicContact CZ2-CB 4.16Å; W257-A265 PolarHBondContact N-O 3.41Å; W257-A265 PolarHBondContact O-N 3Å; W257-A265 VanDerWaalsContact O-O 3.08Å; L259-A265 HydrophobicContact CB-CB 4.18Å; A265-E295 CarbonylContact C-O 3.39Å; A265-E295 VanDerWaalsContact CA-O 3.24Å; A265-E295 WeakPolarHBondContact CA-O 3.38Å; A265-E295 HydrophobicContact CB-CB 3.88Å
266G93Very high91Very high1 Ų140 Ų401%0.0118%0.184CC..EExtended strand (participates in β ladder)trans-170.1161.617700000114.3H255 E295 L296 T297H255-G266 CarbonylContact O-C 3.59Å; H255-G266 WeakPolarHBondContact O-CA 3.4Å; G266-E295 PolarHBondContact N-O 2.69Å; G266-L296 WeakPolarHBondContact O-CA 3.43Å; G266-T297 PolarHBondContact O-N 3.02Å
267T93.9Very high90.9Very high52 Ų5243.4 Ų43.432%0.31920%0.202SC..EExtended strand (participates in β ladder)trans-127.5131.8178.950.90000108.7H255 W257 T297H255-T267 PolarHBondContact N-O 3.48Å; H255-T267 PolarHBondContact O-N 3.38Å; W257-T267 HydrophobicContact CH2-CG2 3.93Å; T267-T297 CarbonylContact C-O 3.53Å; T267-T297 VanDerWaalsContact CA-O 3.29Å; T267-T297 WeakPolarHBondContact CA-O 3.45Å
268V94.8Very high90.9Very high1 Ų144.9 Ų44.91%0.00621%0.211CC..EExtended strand (participates in β ladder)trans-130.9129.2177.3-177.40000109.4L239 V251 D253 D254 F256 V270 L289 L296 T297 V298 Q299L239-V268 HydrophobicContact CD2-CG1 4.2Å; L239-V268 HydrophobicContact CD2-CG2 4.33Å; V251-V268 HydrophobicContact CG1-CG1 3.77Å; D253-V268 CarbonylContact O-C 3.54Å; D253-V268 WeakPolarHBondContact O-CA 3.41Å; D254-V268 HydrophobicContact CB-CG2 4.35Å; F256-V268 HydrophobicContact CE1-CG2 3.71Å; F256-V268 HydrophobicContact CE2-CG2 4.27Å; F256-V268 HydrophobicContact CZ-CG2 3.35Å; V268-V270 HydrophobicContact CG1-CG2 3.88Å; V268-L289 HydrophobicContact CB-CD1 4.45Å; V268-L289 HydrophobicContact CG2-CD1 3.82Å; V268-L296 HydrophobicContact CG2-CD1 4.31Å; V268-T297 PolarHBondContact N-O 3.36Å; V268-V298 CarbonylContact O-C 3.59Å; V268-V298 WeakPolarHBondContact O-CA 3.37Å; V268-Q299 PolarHBondContact O-N 3.09Å
269V94.5Very high90.9Very high28 Ų2851.9 Ų51.917%0.1724%0.244CC..EExtended strand (participates in β ladder)trans-105.1113.9173.4-1750000108.4A252 D253 Q299 D301A252-V269 HydrophobicContact CB-CG1 4.36Å; A252-V269 PolarHBondContact N-O 3.12Å; D253-V269 HydrophobicContact CB-CB 4.21Å; D253-V269 HydrophobicContact CB-CG2 4.17Å; D253-V269 PolarHBondContact O-N 2.92Å; V269-Q299 WeakPolarHBondContact CA-O 3.49Å; V269-Q299 HydrophobicContact CG2-CB 4.33Å; V269-D301 HydrophobicContact CG1-CB 4.43Å
270V94.9Very high91.2Very high0 Ų055.4 Ų55.40%026%0.262CS..EExtended strand (participates in β ladder)trans-105.6119.9178.8-174.10000108.7V242 V248 V268 V272 I281 T285 V298 Q299 I300 D301V242-V270 HydrophobicContact CG1-CG2 4.14Å; V248-V270 HydrophobicContact CB-CG1 4.37Å; V248-V270 HydrophobicContact CG1-CG1 3.62Å; V248-V270 HydrophobicContact CG2-CG1 3.87Å; V268-V270 HydrophobicContact CG1-CG2 3.88Å; V270-V272 HydrophobicContact CG1-CG1 4.08Å; V270-I281 HydrophobicContact CG1-CG2 4.2Å; V270-T285 HydrophobicContact CG2-CG2 4.08Å; V270-V298 HydrophobicContact CG2-CG1 4.27Å; V270-Q299 PolarHBondContact N-O 3.16Å; V270-I300 HydrophobicContact CB-CD1 3.84Å; V270-I300 HydrophobicContact CG2-CD1 4.4Å; V270-I300 WeakPolarHBondContact O-CA 3.38Å; V270-D301 PolarHBondContact O-N 2.87Å
271R93.2Very high91.4Very high96 Ų9655.1 Ų55.136%0.36226%0.259SS..EExtended strand (participates in β ladder)trans-89.2129174.9-73.2-179.475.8179.312.1110.1L249 E250 A252 D301L249-R271 WeakPolarHBondContact CB-O 3.45Å; L249-R271 PolarHBondContact N-O 3.44Å; E250-R271 HydrophobicContact CG-CB 3.94Å; E250-R271 HydrophobicContact CG-CG 4.43Å; E250-R271 PolarHBondContact N-O 3.47Å; E250-R271 PolarHBondContact O-N 3.22Å; E250-R271 VanDerWaalsContact OE1-CD 3.28Å; E250-R271 WeakPolarHBondContact OE1-CD 3.31Å; E250-R271 IonicContact OE1-CZ 2.74Å; E250-R271 IonicContact OE1-NE 3.57Å; E250-R271 IonicContact OE1-NH1 3.79Å; E250-R271 PolarHBondContact OE1-NH1 2.9Å; A252-R271 HydrophobicContact CB-CG 3.75Å; R271-D301 CarbonylContact C-O 3.55Å; R271-D301 VanDerWaalsContact CA-O 3.27Å; R271-D301 WeakPolarHBondContact CA-O 3.32Å; R271-D301 HydrophobicContact CG-CB 3.93Å
272V94.3Very high91.7Very high0 Ų057.5 Ų57.50%027%0.273CS..EExtended strand (participates in β ladder)trans-122.7154.3-174.4-58.20000111.6G247 V248 V270 A276 E278 I281 I300 D301 K302 A303G247-V272 CarbonylContact O-C 3.57Å; G247-V272 VanDerWaalsContact O-CA 3.3Å; G247-V272 WeakPolarHBondContact O-CA 3.23Å; V248-V272 HydrophobicContact CG2-CG1 4.41Å; V270-V272 HydrophobicContact CG1-CG1 4.08Å; V272-A276 HydrophobicContact CB-CB 4.18Å; V272-E278 HydrophobicContact CG2-CG 4.4Å; V272-I281 HydrophobicContact CB-CD1 4.11Å; V272-I281 HydrophobicContact CG1-CB 4.49Å; V272-I281 HydrophobicContact CG1-CD1 3.61Å; V272-I281 HydrophobicContact CG1-CG2 3.95Å; V272-I300 HydrophobicContact CB-CG2 4.28Å; V272-I300 HydrophobicContact CG1-CG2 3.83Å; V272-I300 HydrophobicContact CG2-CG2 3.41Å; V272-I300 VanDerWaalsContact CG2-CG2 3.41Å; V272-D301 PolarHBondContact N-O 3.24Å; V272-K302 HydrophobicContact CG2-CG 3.78Å; V272-A303 PolarHBondContact O-N 3.46Å
273R92.1Very high92.2Very high95 Ų9555 Ų5536%0.35827%0.271SS..  trans-62.4156.5171.3-60.8-169.2-55.7-139.7-12.2110.1D246 G247 L249 D275 A276D246-R273 IonicContact OD1-CZ 2.63Å; D246-R273 IonicContact OD1-NH1 2.83Å; D246-R273 IonicContact OD1-NH2 3.63Å; D246-R273 PolarHBondContact OD1-NH2 3.16Å; G247-R273 PolarHBondContact O-N 3.14Å; L249-R273 HydrophobicContact CD1-CG 4.45Å; L249-R273 HydrophobicContact CD2-CG 3.66Å; L249-R273 HydrophobicContact CG-CG 3.88Å; R273-D275 VanDerWaalsContact C-N 3.29Å; R273-D275 WeakPolarHBondContact CB-OD1 3.28Å; R273-D275 IonicContact NE-OD1 3.76Å; R273-D275 PolarHBondContact O-N 2.94Å; R273-A276 HydrophobicContact CB-CB 4.25Å; R273-A276 VanDerWaalsContact O-CB 3.32Å; R273-A276 WeakPolarHBondContact O-CB 3.32Å; R273-A276 PolarHBondContact O-N 2.98Å
274R87.9Confident92.5Very high137 Ų13758 Ų5852%0.51728%0.281SS..THydrogen-bonded Turntrans-64.9-34.7-176.9-64.8-177.6-175.7178.85.1113.7A276 K302 A303 T304 T305R274-A276 VanDerWaalsContact C-N 3.33Å; R274-K302 VanDerWaalsContact O-CE 3.31Å; R274-K302 WeakPolarHBondContact O-CE 3.3Å; R274-A303 WeakPolarHBondContact CG-O 3.42Å; R274-A303 PolarHBondContact NE-O 2.99Å; R274-A303 PolarHBondContact NH2-O 3.21Å; R274-T304 PolarHBondContact NH2-O 3.45Å; R274-T305 VanDerWaalsContact CZ-OG1 3.23Å; R274-T305 PolarHBondContact NH1-OG1 3.25Å; R274-T305 PolarHBondContact NH2-OG1 2.77Å
275D90.1Very high92.6Very high128 Ų12857.2 Ų57.268%0.68428%0.276SS*.THydrogen-bonded Turntrans-87.9-2-179.563.5-33.1000112.9R273R273-D275 VanDerWaalsContact C-N 3.29Å; R273-D275 WeakPolarHBondContact CB-OD1 3.28Å; R273-D275 IonicContact NE-OD1 3.76Å; R273-D275 PolarHBondContact O-N 2.94Å
276A89.4Confident92.8Very high12 Ų1259.5 Ų59.510%0.09929%0.29CS..SBendtrans-74.6147.3179.200000112.1V272 R273 R274 E278 I281V272-A276 HydrophobicContact CB-CB 4.18Å; R273-A276 HydrophobicContact CB-CB 4.25Å; R273-A276 VanDerWaalsContact O-CB 3.32Å; R273-A276 WeakPolarHBondContact O-CB 3.32Å; R273-A276 PolarHBondContact O-N 2.98Å; R274-A276 VanDerWaalsContact C-N 3.33Å; A276-E278 PolarHBondContact O-N 3.06Å; A276-I281 HydrophobicContact CB-CD1 3.77Å
277D92.1Very high92.8Very high90 Ų9065.2 Ų65.248%0.48132%0.321SS..  trans-77100.3171.6-175.6-14.5000110Q279 L280 I281D277-Q279 VanDerWaalsContact C-N 3.31Å; D277-Q279 PolarHBondContact O-N 3.22Å; D277-Q279 PolarHBondContact OD1-N 3.24Å; D277-Q279 VanDerWaalsContact OD1-N 3.08Å; D277-L280 HydrophobicContact CB-CB 3.94Å; D277-L280 PolarHBondContact O-N 3.14Å; D277-L280 PolarHBondContact OD1-N 3.08Å; D277-L280 VanDerWaalsContact OD1-N 3.12Å; D277-I281 WeakPolarHBondContact O-CG1 3.38Å; D277-I281 PolarHBondContact O-N 3.41Å; D277-I281 VanDerWaalsContact O-N 3.1Å
278E91.8Very high92.8Very high75 Ų7565.8 Ų65.835%0.3532%0.319SS..Hα-helixtrans-58.9-40.4179.8-64.1175.8-169.600112.5V272 A276 I281 L282 I300 K302V272-E278 HydrophobicContact CG2-CG 4.4Å; A276-E278 PolarHBondContact O-N 3.06Å; E278-I281 PolarHBondContact O-N 2.85Å; E278-L282 WeakPolarHBondContact O-CB 3.24Å; E278-L282 PolarHBondContact O-N 3.45Å; E278-I300 HydrophobicContact CB-CG2 4.16Å; E278-I300 HydrophobicContact CG-CG2 3.94Å; E278-K302 HydrophobicContact CG-CD 4.42Å; E278-K302 HydrophobicContact CG-CG 4.46Å; E278-K302 WeakPolarHBondContact OE1-CD 3.4Å; E278-K302 WeakPolarHBondContact OE1-CE 3.17Å; E278-K302 WeakPolarHBondContact OE1-CG 3.45Å; E278-K302 IonicContact OE1-NZ 2.86Å; E278-K302 PolarHBondContact OE1-NZ 3.32Å
279Q91.2Very high92.7Very high160 Ų16065.8 Ų65.875%0.74832%0.319SS*.Hα-helixtrans-69.9-40.3-175.3-68.8-175.9-12.400110.6D277 A283D277-Q279 VanDerWaalsContact C-N 3.31Å; D277-Q279 PolarHBondContact O-N 3.22Å; D277-Q279 PolarHBondContact OD1-N 3.24Å; D277-Q279 VanDerWaalsContact OD1-N 3.08Å; Q279-A283 VanDerWaalsContact O-CB 3.28Å; Q279-A283 WeakPolarHBondContact O-CB 3.31Å; Q279-A283 PolarHBondContact O-N 3.1Å
280L92.9Very high92.5Very high74 Ų7469 Ų6939%0.38734%0.335SS..Hα-helixtrans-65.2-44.5175.7-178.462.5000111.9D277 A283 R284D277-L280 HydrophobicContact CB-CB 3.94Å; D277-L280 PolarHBondContact O-N 3.14Å; D277-L280 PolarHBondContact OD1-N 3.08Å; D277-L280 VanDerWaalsContact OD1-N 3.12Å; L280-A283 PolarHBondContact O-N 3.44Å; L280-R284 HydrophobicContact CD1-CG 4.38Å; L280-R284 WeakPolarHBondContact O-CB 3.45Å; L280-R284 VanDerWaalsContact O-CG 3.32Å; L280-R284 WeakPolarHBondContact O-CG 3.37Å; L280-R284 PolarHBondContact O-N 3.12Å
281I92.6Very high92.3Very high6 Ų673.8 Ų73.83%0.03137%0.365CS..Hα-helixtrans-65.6-44178.5-67.9171.6000110.4M245 V248 V270 V272 A276 D277 E278 R284 T285 I300M245-I281 HydrophobicContact CE-CG2 4.18Å; V248-I281 HydrophobicContact CG2-CD1 4.06Å; V248-I281 HydrophobicContact CG2-CG1 4.35Å; V248-I281 HydrophobicContact CG2-CG2 3.65Å; V270-I281 HydrophobicContact CG1-CG2 4.2Å; V272-I281 HydrophobicContact CB-CD1 4.11Å; V272-I281 HydrophobicContact CG1-CB 4.49Å; V272-I281 HydrophobicContact CG1-CD1 3.61Å; V272-I281 HydrophobicContact CG1-CG2 3.95Å; A276-I281 HydrophobicContact CB-CD1 3.77Å; D277-I281 WeakPolarHBondContact O-CG1 3.38Å; D277-I281 PolarHBondContact O-N 3.41Å; D277-I281 VanDerWaalsContact O-N 3.1Å; E278-I281 PolarHBondContact O-N 2.85Å; I281-R284 PolarHBondContact O-N 2.71Å; I281-T285 VanDerWaalsContact O-CB 3.31Å; I281-T285 WeakPolarHBondContact O-CB 3.27Å; I281-T285 PolarHBondContact O-N 3.05Å; I281-T285 PolarHBondContact O-OG1 3.44Å; I281-I300 HydrophobicContact CG2-CD1 4.24Å
282L94Very high92.1Very high64 Ų6473 Ų7334%0.33536%0.363SS..Hα-helixtrans-57.6-52.3175.5177.261.7000110.8E278 R284 T285 V286 V298 I300E278-L282 WeakPolarHBondContact O-CB 3.24Å; E278-L282 PolarHBondContact O-N 3.45Å; L282-R284 VanDerWaalsContact C-N 3.35Å; L282-R284 PolarHBondContact O-N 3.21Å; L282-T285 PolarHBondContact O-N 2.88Å; L282-V286 HydrophobicContact CD1-CG2 4.09Å; L282-V286 WeakPolarHBondContact O-CB 3.31Å; L282-V286 VanDerWaalsContact O-CG2 3.31Å; L282-V286 WeakPolarHBondContact O-CG2 2.96Å; L282-V286 PolarHBondContact O-N 2.88Å; L282-V298 HydrophobicContact CD1-CB 3.53Å; L282-V298 HydrophobicContact CD1-CG1 3.57Å; L282-I300 HydrophobicContact CB-CD1 4.34Å; L282-I300 HydrophobicContact CB-CG1 4.09Å; L282-I300 HydrophobicContact CD1-CD1 4.47Å; L282-I300 HydrophobicContact CD1-CG1 4.3Å
283A94.3Very high91.9Very high58 Ų5873.1 Ų73.148%0.47936%0.364SS..Hα-helixtrans-59.4-43.9-179.200000112.2Q279 L280 D287Q279-A283 VanDerWaalsContact O-CB 3.28Å; Q279-A283 WeakPolarHBondContact O-CB 3.31Å; Q279-A283 PolarHBondContact O-N 3.1Å; L280-A283 PolarHBondContact O-N 3.44Å; A283-D287 VanDerWaalsContact O-CB 3.31Å; A283-D287 WeakPolarHBondContact O-CB 3.43Å; A283-D287 PolarHBondContact O-N 2.93Å
284R93.4Very high91.7Very high124 Ų12471.1 Ų71.147%0.46837%0.368SS..Hα-helixtrans-68.1-37.3177.5-72.4179.4177.3179.71.8113M245 L280 I281 L282 K288M245-R284 HydrophobicContact CE-CB 4.22Å; M245-R284 HydrophobicContact SD-CB 3.51Å; M245-R284 VanDerWaalsContact SD-CB 3.51Å; M245-R284 HydrophobicContact SD-CG 4.36Å; L280-R284 HydrophobicContact CD1-CG 4.38Å; L280-R284 WeakPolarHBondContact O-CB 3.45Å; L280-R284 VanDerWaalsContact O-CG 3.32Å; L280-R284 WeakPolarHBondContact O-CG 3.37Å; L280-R284 PolarHBondContact O-N 3.12Å; I281-R284 PolarHBondContact O-N 2.71Å; L282-R284 VanDerWaalsContact C-N 3.35Å; L282-R284 PolarHBondContact O-N 3.21Å; R284-K288 WeakPolarHBondContact O-CG 3.47Å; R284-K288 PolarHBondContact O-N 2.83Å; R284-K288 VanDerWaalsContact O-N 3.12Å
285T93.2Very high91.8Very high0 Ų068.2 Ų68.20%036%0.36CS..Hα-helixtrans-65.4-46.7177-57.10000110.4V242 M245 V270 I281 L282 K288 L289 V298V242-T285 HydrophobicContact CG1-CG2 3.98Å; V242-T285 HydrophobicContact CG2-CG2 4.08Å; M245-T285 VanDerWaalsContact CE-OG1 3.24Å; M245-T285 WeakPolarHBondContact CE-OG1 2.78Å; V270-T285 HydrophobicContact CG2-CG2 4.08Å; I281-T285 VanDerWaalsContact O-CB 3.31Å; I281-T285 WeakPolarHBondContact O-CB 3.27Å; I281-T285 PolarHBondContact O-N 3.05Å; I281-T285 PolarHBondContact O-OG1 3.44Å; L282-T285 PolarHBondContact O-N 2.88Å; T285-K288 PolarHBondContact O-N 3.22Å; T285-L289 HydrophobicContact CG2-CD1 3.87Å; T285-L289 WeakPolarHBondContact O-CG 3.5Å; T285-L289 PolarHBondContact O-N 2.8Å; T285-L289 VanDerWaalsContact O-N 3.15Å; T285-V298 HydrophobicContact CG2-CG1 3.89Å; T285-V298 HydrophobicContact CG2-CG2 4.05Å
286V94.2Very high92Very high48 Ų4863.7 Ų63.729%0.29134%0.335SS..Hα-helixtrans-60.3-49.6176172.40000110.3L282 K288 L289 L290 L296 V298L282-V286 HydrophobicContact CD1-CG2 4.09Å; L282-V286 WeakPolarHBondContact O-CB 3.31Å; L282-V286 VanDerWaalsContact O-CG2 3.31Å; L282-V286 WeakPolarHBondContact O-CG2 2.96Å; L282-V286 PolarHBondContact O-N 2.88Å; V286-K288 VanDerWaalsContact C-N 3.26Å; V286-K288 PolarHBondContact O-N 2.95Å; V286-L289 PolarHBondContact O-N 2.63Å; V286-L289 VanDerWaalsContact O-N 3.14Å; V286-L290 WeakPolarHBondContact O-CB 3.28Å; V286-L290 PolarHBondContact O-N 2.74Å; V286-L296 HydrophobicContact CG2-CD2 4.4Å; V286-V298 HydrophobicContact CG2-CB 4.34Å; V286-V298 HydrophobicContact CG2-CG2 3.83Å
287D94.6Very high92.2Very high122 Ų12267.2 Ų67.265%0.65236%0.356SS*.Hα-helixtrans-57-37.1-179.9-172.160.3000113A283 P291A283-D287 VanDerWaalsContact O-CB 3.31Å; A283-D287 WeakPolarHBondContact O-CB 3.43Å; A283-D287 PolarHBondContact O-N 2.93Å; D287-P291 WeakPolarHBondContact O-CD 3.27Å
288K92.7Very high92.2Very high64 Ų6464 Ų6428%0.27834%0.34SS..Hα-helixtrans-73.4-34.6177.6-76.9-175.3174.4-65.20114.4E241 V242 R284 T285 V286E241-K288 HydrophobicContact CB-CD 4.11Å; E241-K288 IonicContact OE2-NZ 3.81Å; E241-K288 PolarHBondContact OE2-NZ 3.04Å; V242-K288 HydrophobicContact CG2-CB 4.42Å; V242-K288 HydrophobicContact CG2-CD 4.01Å; R284-K288 WeakPolarHBondContact O-CG 3.47Å; R284-K288 PolarHBondContact O-N 2.83Å; R284-K288 VanDerWaalsContact O-N 3.12Å; T285-K288 PolarHBondContact O-N 3.22Å; V286-K288 VanDerWaalsContact C-N 3.26Å; V286-K288 PolarHBondContact O-N 2.95Å
289L92.8Very high92.3Very high0 Ų065.4 Ų65.40%035%0.346CS..Hα-helixtrans-96.3-27.5-172.3-69.7175.5000113.4L235 C238 L239 F256 V268 T285 V286 P291 Y292 V293 L296L235-L289 HydrophobicContact CD1-CD2 3.57Å; C238-L289 HydrophobicContact CB-CD2 3.89Å; L239-L289 HydrophobicContact CD2-CD1 4.44Å; L239-L289 HydrophobicContact CD2-CD2 4.33Å; F256-L289 HydrophobicContact CZ-CD2 4.45Å; V268-L289 HydrophobicContact CB-CD1 4.45Å; V268-L289 HydrophobicContact CG2-CD1 3.82Å; T285-L289 HydrophobicContact CG2-CD1 3.87Å; T285-L289 WeakPolarHBondContact O-CG 3.5Å; T285-L289 PolarHBondContact O-N 2.8Å; T285-L289 VanDerWaalsContact O-N 3.15Å; V286-L289 PolarHBondContact O-N 2.63Å; V286-L289 VanDerWaalsContact O-N 3.14Å; L289-P291 VanDerWaalsContact C-N 3.3Å; L289-Y292 PolarHBondContact O-N 2.72Å; L289-V293 PolarHBondContact O-N 2.98Å; L289-L296 HydrophobicContact CB-CD1 4.29Å; L289-L296 HydrophobicContact CB-CD2 3.5Å; L289-L296 HydrophobicContact CD1-CD1 4.07Å; L289-L296 HydrophobicContact CD1-CD2 4.13Å; L289-L296 HydrophobicContact CG-CD2 4.47Å
290L91.2Very high92.4Very high97 Ų9759.3 Ų59.351%0.50832%0.318SS..THydrogen-bonded Turntrans-52.4-35.8179.7-167.375.7000114.4V286 Y292V286-L290 WeakPolarHBondContact O-CB 3.28Å; V286-L290 PolarHBondContact O-N 2.74Å; L290-Y292 PolarHBondContact O-N 3.21Å
291P90.1Very high92.3Very high99 Ų9959 Ų5964%0.64332%0.317SS*.THydrogen-bonded Turntrans-61.4-25.2176.8-2535.8000114.2D287 L289D287-P291 WeakPolarHBondContact O-CD 3.27Å; L289-P291 VanDerWaalsContact C-N 3.3Å
292Y89.6Confident92.1Very high81 Ų8162.9 Ų62.932%0.31833%0.334SS..THydrogen-bonded Turntrans-107.5-30.6-176.6-54.6-80.4000112.6V231 E234 C238 M264 L289 L290V231-Y292 HydrophobicContact CG1-CD1 4.31Å; E234-Y292 HydrophobicContact CB-CD1 4.41Å; E234-Y292 HydrophobicContact CB-CE1 3.88Å; E234-Y292 VanDerWaalsContact OE2-CE1 3.23Å; E234-Y292 WeakPolarHBondContact OE2-CE1 3.44Å; C238-Y292 WeakPolarHBondContact SG-CE2 3.49Å; M264-Y292 WeakPolarHBondContact CB-O 3.43Å; L289-Y292 PolarHBondContact O-N 2.72Å; L290-Y292 PolarHBondContact O-N 3.21Å
293V90.6Very high91.4Very high1 Ų161 Ų611%0.00633%0.328CS..  trans-122.4101.9-173.1-171.90000109.1L235 F256 L289 L296L235-V293 HydrophobicContact CD1-CG2 4.13Å; F256-V293 HydrophobicContact CD1-CG1 4.43Å; F256-V293 HydrophobicContact CD1-CG2 3.67Å; F256-V293 HydrophobicContact CE1-CG2 3.81Å; L289-V293 PolarHBondContact O-N 2.98Å; V293-L296 HydrophobicContact CB-CB 4.31Å; V293-L296 HydrophobicContact CB-CD1 4.29Å; V293-L296 HydrophobicContact CG1-CB 3.97Å; V293-L296 HydrophobicContact CG1-CD1 4.04Å
294A87.8Confident90.3Very high54 Ų5464.2 Ų64.245%0.44634%0.342SS..SBendtrans-68-41.7-177.600000112.1K263 M264K263-A294 HydrophobicContact CG-CB 4.41Å; M264-A294 PolarHBondContact O-N 3.3Å; M264-A294 VanDerWaalsContact O-N 3.08Å
295E90Very high88.5Confident75 Ų7562.3 Ų62.335%0.3534%0.344SS..EExtended strand (participates in β ladder)trans-10683.4178.3-57-66.516600108.9Y62 L259 K263 M264 A265 G266Y62-E295 HydrophobicContact CE1-CB 4.49Å; Y62-E295 HydrophobicContact CE1-CG 4.4Å; L259-E295 HydrophobicContact CD2-CG 4.22Å; K263-E295 IonicContact NZ-OE1 2.95Å; K263-E295 PolarHBondContact NZ-OE1 2.8Å; M264-E295 PolarHBondContact O-N 2.81Å; M264-E295 VanDerWaalsContact O-N 3.1Å; A265-E295 CarbonylContact C-O 3.39Å; A265-E295 VanDerWaalsContact CA-O 3.24Å; A265-E295 WeakPolarHBondContact CA-O 3.38Å; A265-E295 HydrophobicContact CB-CB 3.88Å; G266-E295 PolarHBondContact N-O 2.69Å
296L92.9Very high86.5Confident33 Ų3368.6 Ų68.617%0.17338%0.382CS..EExtended strand (participates in β ladder)trans-106.6127.2-175-18070.8000111.3F256 G266 V268 V286 L289 V293 V298F256-L296 HydrophobicContact CE1-CD1 4.36Å; G266-L296 WeakPolarHBondContact O-CA 3.43Å; V268-L296 HydrophobicContact CG2-CD1 4.31Å; V286-L296 HydrophobicContact CG2-CD2 4.4Å; L289-L296 HydrophobicContact CB-CD1 4.29Å; L289-L296 HydrophobicContact CB-CD2 3.5Å; L289-L296 HydrophobicContact CD1-CD1 4.07Å; L289-L296 HydrophobicContact CD1-CD2 4.13Å; L289-L296 HydrophobicContact CG-CD2 4.47Å; V293-L296 HydrophobicContact CB-CB 4.31Å; V293-L296 HydrophobicContact CB-CD1 4.29Å; V293-L296 HydrophobicContact CG1-CB 3.97Å; V293-L296 HydrophobicContact CG1-CD1 4.04Å; L296-V298 HydrophobicContact CD1-CG2 4.22Å; L296-V298 HydrophobicContact CD2-CG2 3.69Å; L296-V298 HydrophobicContact CG-CG2 3.78Å
297T93.1Very high84.1Confident87 Ų8771.2 Ų71.253%0.53440%0.398SS..EExtended strand (participates in β ladder)trans-109.1122.5166.7-53.70000109.1G266 T267 V268G266-T297 PolarHBondContact O-N 3.02Å; T267-T297 CarbonylContact C-O 3.53Å; T267-T297 VanDerWaalsContact CA-O 3.29Å; T267-T297 WeakPolarHBondContact CA-O 3.45Å; V268-T297 PolarHBondContact N-O 3.36Å
298V93.9Very high81.5Confident22 Ų2271.7 Ų71.713%0.13341%0.406CS..EExtended strand (participates in β ladder)trans-113.9123.4174.1-177.80000109.1V268 V270 L282 T285 V286 L296 I300V268-V298 CarbonylContact O-C 3.59Å; V268-V298 WeakPolarHBondContact O-CA 3.37Å; V270-V298 HydrophobicContact CG2-CG1 4.27Å; L282-V298 HydrophobicContact CD1-CB 3.53Å; L282-V298 HydrophobicContact CD1-CG1 3.57Å; T285-V298 HydrophobicContact CG2-CG1 3.89Å; T285-V298 HydrophobicContact CG2-CG2 4.05Å; V286-V298 HydrophobicContact CG2-CB 4.34Å; V286-V298 HydrophobicContact CG2-CG2 3.83Å; L296-V298 HydrophobicContact CD1-CG2 4.22Å; L296-V298 HydrophobicContact CD2-CG2 3.69Å; L296-V298 HydrophobicContact CG-CG2 3.78Å; V298-I300 HydrophobicContact CG1-CD1 4Å
299Q93.6Very high79.1Confident105 Ų10574.2 Ų74.249%0.49143%0.427SS..EExtended strand (participates in β ladder)trans-107.4134.3173.7-177.9178.5-3900109.6V268 V269 V270 D301V268-Q299 PolarHBondContact O-N 3.09Å; V269-Q299 WeakPolarHBondContact CA-O 3.49Å; V269-Q299 HydrophobicContact CG2-CB 4.33Å; V270-Q299 PolarHBondContact N-O 3.16Å; Q299-D301 PolarHBondContact NE2-OD1 3Å
300I93.1Very high76.6Confident32 Ų3279.1 Ų79.116%0.16446%0.457CS..EExtended strand (participates in β ladder)trans-107.8120.5177.4-55.8-58.1000109.3V270 V272 E278 I281 L282 V298V270-I300 HydrophobicContact CB-CD1 3.84Å; V270-I300 HydrophobicContact CG2-CD1 4.4Å; V270-I300 WeakPolarHBondContact O-CA 3.38Å; V272-I300 HydrophobicContact CB-CG2 4.28Å; V272-I300 HydrophobicContact CG1-CG2 3.83Å; V272-I300 HydrophobicContact CG2-CG2 3.41Å; V272-I300 VanDerWaalsContact CG2-CG2 3.41Å; E278-I300 HydrophobicContact CB-CG2 4.16Å; E278-I300 HydrophobicContact CG-CG2 3.94Å; I281-I300 HydrophobicContact CG2-CD1 4.24Å; L282-I300 HydrophobicContact CB-CD1 4.34Å; L282-I300 HydrophobicContact CB-CG1 4.09Å; L282-I300 HydrophobicContact CD1-CD1 4.47Å; L282-I300 HydrophobicContact CD1-CG1 4.3Å; V298-I300 HydrophobicContact CG1-CD1 4Å
301D91.2Very high74.2Confident66 Ų6679.6 Ų79.635%0.35348%0.475SS..EExtended strand (participates in β ladder)trans-111.2114.7179.3-88.811.4000110.6V269 V270 R271 V272 Q299V269-D301 HydrophobicContact CG1-CB 4.43Å; V270-D301 PolarHBondContact O-N 2.87Å; R271-D301 CarbonylContact C-O 3.55Å; R271-D301 VanDerWaalsContact CA-O 3.27Å; R271-D301 WeakPolarHBondContact CA-O 3.32Å; R271-D301 HydrophobicContact CG-CB 3.93Å; V272-D301 PolarHBondContact N-O 3.24Å; Q299-D301 PolarHBondContact NE2-OD1 3Å
302K88.7Confident72Confident88 Ų8879.5 Ų79.538%0.38347%0.472SS..EExtended strand (participates in β ladder)trans-77.3136.7172.8-87.3-173.9171.6149.30111.3V272 R274 E278 T304V272-K302 HydrophobicContact CG2-CG 3.78Å; R274-K302 VanDerWaalsContact O-CE 3.31Å; R274-K302 WeakPolarHBondContact O-CE 3.3Å; E278-K302 HydrophobicContact CG-CD 4.42Å; E278-K302 HydrophobicContact CG-CG 4.46Å; E278-K302 WeakPolarHBondContact OE1-CD 3.4Å; E278-K302 WeakPolarHBondContact OE1-CE 3.17Å; E278-K302 WeakPolarHBondContact OE1-CG 3.45Å; E278-K302 IonicContact OE1-NZ 2.86Å; E278-K302 PolarHBondContact OE1-NZ 3.32Å; K302-T304 PolarHBondContact O-N 2.81Å
303A77.9Confident69.5Low26 Ų2682.4 Ų82.422%0.21549%0.494CS..  trans-60.5109.8176.700000112.5L249 V272 R274L249-A303 HydrophobicContact CD1-CB 3.95Å; V272-A303 PolarHBondContact O-N 3.46Å; R274-A303 WeakPolarHBondContact CG-O 3.42Å; R274-A303 PolarHBondContact NE-O 2.99Å; R274-A303 PolarHBondContact NH2-O 3.21Å
304T71.4Confident67.1Low125 Ų12594.7 Ų94.777%0.76754%0.54SS*.  trans-74.5152.7175.3-9.60000111.8R274 K302 T306R274-T304 PolarHBondContact NH2-O 3.45Å; K302-T304 PolarHBondContact O-N 2.81Å; T304-T306 PolarHBondContact O-N 3.4Å
305T56.9Low65Low83 Ų83101.4 Ų101.451%0.50956%0.562SS.*  trans-72.7117172-48.50000106.2R274 T307R274-T305 VanDerWaalsContact CZ-OG1 3.23Å; R274-T305 PolarHBondContact NH1-OG1 3.25Å; R274-T305 PolarHBondContact NH2-OG1 2.77Å; T305-T307 HydrophobicContact CG2-CG2 4.46Å; T305-T307 PolarHBondContact O-N 3.37Å
306T50.6Low63Low132 Ų132102.1 Ų102.181%0.8158%0.576SS**  trans-62.585.2161-20.60000106.2T304 T308T304-T306 PolarHBondContact O-N 3.4Å; T306-T308 VanDerWaalsContact C-N 3.33Å; T306-T308 PolarHBondContact O-N 3.39Å
307T44.3Very low60.4Low103 Ų103108.9 Ų108.963%0.63261%0.606SS**  trans-65.4106.6162.138.90000104.7T305 T309T305-T307 HydrophobicContact CG2-CG2 4.46Å; T305-T307 PolarHBondContact O-N 3.37Å; T307-T309 PolarHBondContact O-N 2.79Å; T307-T309 PolarHBondContact O-OG1 2.97Å
308T39.2Very low58Low133 Ų133113.4 Ų113.482%0.81663%0.626SS**  trans-59.175.3164.5-13.20000107.5T306 T310T306-T308 VanDerWaalsContact C-N 3.33Å; T306-T308 PolarHBondContact O-N 3.39Å; T308-T310 PolarHBondContact O-N 3.03Å
309T41.8Very low55.8Low116 Ų116119.5 Ų119.571%0.71269%0.693SS**  trans-79.786169.8-19.30000105.4T307 A311T307-T309 PolarHBondContact O-N 2.79Å; T307-T309 PolarHBondContact O-OG1 2.97Å; T309-A311 PolarHBondContact O-N 3.27Å
310T40.5Very low53.9Low103 Ų103120.2 Ų120.263%0.63270%0.703SS**  trans-11.7113.7161.545.50000113.4T308 T312T308-T310 PolarHBondContact O-N 3.03Å; T310-T312 PolarHBondContact O-N 2.74Å
311A41.9Very low51.8Low107 Ų107124.8 Ų124.888%0.88473%0.731SS**SBendtrans-63.279.2162.200000109.4T309T309-A311 PolarHBondContact O-N 3.27Å
312T43.3Very low49.6Very low97 Ų97128.1 Ų128.160%0.59575%0.752SS**  trans-148.8100.9168.751.20000106.2T310T310-T312 PolarHBondContact O-N 2.74Å
313N37.7Very low47.3Very low142 Ų142130.5 Ų130.576%0.75977%0.774SS**  trans16711148.2-83.5-6.9000115.8
314W39.7Very low45.4Very low259 Ų259137 Ų13798%0.98181%0.809SS**THydrogen-bonded Turntrans-87.15.2173.8-71115.5000115.5
315E44.2Very low43.7Very low196 Ų196137.8 Ų137.892%0.91681%0.812SS**THydrogen-bonded Turntrans-98.36.7-179-80.1-172.8165.200116.4
316S46.9Very low42.8Very low90 Ų90141.7 Ų141.763%0.62983%0.833SS**SBendtrans-10825.2-177.569.90000116.8
317H39.3Very low42.2Very low174 Ų174142.5 Ų142.581%0.80684%0.835SS**SBendtrans-127.925173.9-78.9-51.5000115.6
318L41Very low42Very low183 Ų183145.8 Ų145.896%0.95885%0.852SS**  trans-124.879.7165.8-69.3172.4000110.2
319G48.2Very low42.2Very low149 Ų149146.9 Ų146.9100%1.53686%0.855SS**  trans-146.10162.600000107.9

Retrieved 319 of 319 residues in 807.3 ms (Link to these results)

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