A0A087XYR0_POEFO Loading...

Cell growth-regulating nucleolar protein

AlphaFold DB , UniProt , Accession A0A087XYR0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 269 aa.

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

 

Download Structure   PDB   PAE   Table  
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
1M77.1Confident92Very high153 Ų15359.9 Ų59.975%0.75435%0.352SS*.  01300-174.2177.5-164.600106F3 K14 A16M1-F3 WeakPolarHBondContact O-CD2 3.25Å; M1-F3 WeakPolarHBondContact O-CE2 3.16Å; M1-K14 HydrophobicContact CE-CB 3.81Å; M1-K14 HydrophobicContact CE-CD 4.09Å; M1-K14 HydrophobicContact CE-CG 4.28Å; M1-K14 HydrophobicContact SD-CB 4.44Å; M1-K14 HydrophobicContact SD-CD 4.04Å; M1-K14 HydrophobicContact SD-CG 4.32Å; M1-A16 HydrophobicContact CE-CB 4.34Å
2V88.1Confident92.2Very high16 Ų1661.2 Ų61.210%0.09737%0.366CS..  trans-88.1142.3-172.9-170.80000111F4 K15 C33V2-F4 HydrophobicContact CB-CE2 4.43Å; V2-F4 HydrophobicContact CG1-CE2 4.21Å; V2-F4 HydrophobicContact CG1-CZ 4.07Å; V2-K15 PolarHBondContact O-N 3.09Å; V2-C33 WeakPolarHBondContact CG1-SG 3.44Å
3F92.3Very high92.3Very high80 Ų8056.8 Ų56.835%0.35134%0.34SS..EExtended strand (participates in β ladder)trans-114.7142.7177.9-64.9-99.9000111M1 L13 K14 I34M1-F3 WeakPolarHBondContact O-CD2 3.25Å; M1-F3 WeakPolarHBondContact O-CE2 3.16Å; F3-L13 WeakPolarHBondContact CA-O 3.42Å; F3-K14 HydrophobicContact CD1-CG 3.73Å; F3-K14 HydrophobicContact CE1-CD 4.09Å; F3-K14 HydrophobicContact CE1-CG 3.32Å; F3-K14 HydrophobicContact CZ-CG 4.02Å; F3-I34 HydrophobicContact CB-CD1 3.9Å; F3-I34 HydrophobicContact CB-CG1 4.47Å; F3-I34 PolarHBondContact O-N 3.02Å; F3-I34 VanDerWaalsContact O-N 3.07Å
4F94.9Very high92.4Very high0 Ų059 Ų590%034%0.343CS..EExtended strand (participates in β ladder)trans-122.8152.9179.6-60.7-85.5000110.3V2 S12 L13 K15 V18 L31 S32 C33 F40 Y45 H48V2-F4 HydrophobicContact CB-CE2 4.43Å; V2-F4 HydrophobicContact CG1-CE2 4.21Å; V2-F4 HydrophobicContact CG1-CZ 4.07Å; F4-S12 CarbonylContact O-C 3.52Å; F4-S12 WeakPolarHBondContact O-CA 3.33Å; F4-L13 PolarHBondContact N-O 3.39Å; F4-L13 PolarHBondContact O-N 3.09Å; F4-K15 HydrophobicContact CE2-CB 3.93Å; F4-K15 HydrophobicContact CE2-CD 4.45Å; F4-K15 HydrophobicContact CE2-CG 4.01Å; F4-V18 HydrophobicContact CB-CG2 4.46Å; F4-V18 HydrophobicContact CD2-CG2 3.88Å; F4-V18 HydrophobicContact CG-CG2 4.45Å; F4-L31 HydrophobicContact CB-CB 4.33Å; F4-L31 HydrophobicContact CB-CD2 4.15Å; F4-L31 HydrophobicContact CD1-CB 4.39Å; F4-S32 CarbonylContact C-O 3.59Å; F4-S32 VanDerWaalsContact CA-O 3.27Å; F4-S32 WeakPolarHBondContact CA-O 3.26Å; F4-C33 HydrophobicContact CD1-CB 3.99Å; F4-C33 HydrophobicContact CE1-CB 3.96Å; F4-F40 HydrophobicContact CD1-CD2 4.11Å; F4-F40 HydrophobicContact CD1-CE2 4.43Å; F4-F40 AromaticContact CE1-CD2 3.72Å; F4-F40 HydrophobicContact CE1-CD2 3.72Å; F4-F40 AromaticContact CE1-CE2 3.82Å; F4-F40 HydrophobicContact CE1-CE2 3.82Å; F4-F40 HydrophobicContact CE1-CG 4.4Å; F4-Y45 HydrophobicContact CE2-CD2 4.3Å; F4-Y45 HydrophobicContact CZ-CD2 4.44Å; F4-H48 HydrophobicContact CE1-CB 4.46Å; F4-H48 AromaticContact CE1-CD2 3.94Å; F4-H48 HydrophobicContact CZ-CB 4.17Å; F4-H48 AromaticContact CZ-CD2 3.84Å
5T95.9Very high92.3Very high36 Ų3659.1 Ų59.122%0.22134%0.337CS..EExtended strand (participates in β ladder)trans-113.9129.6171.1-580000108.5E11 L31 S32 I34T5-E11 WeakPolarHBondContact CA-O 3.36Å; T5-L31 WeakPolarHBondContact O-CA 3.37Å; T5-S32 PolarHBondContact N-O 3.41Å; T5-S32 PolarHBondContact O-N 3.35Å; T5-I34 WeakPolarHBondContact OG1-CD1 3.42Å; T5-I34 VanDerWaalsContact OG1-CG1 3.25Å; T5-I34 WeakPolarHBondContact OG1-CG1 3.22Å
6C95.6Very high92.2Very high0 Ų059.7 Ų59.70%035%0.352CS..EExtended strand (participates in β ladder)trans-76.2124174.2175.60000110.2A8 G10 E11 L13 H21 C28 L31C6-A8 PolarHBondContact O-N 3.18Å; C6-G10 WeakPolarHBondContact O-CA 3.46Å; C6-G10 PolarHBondContact O-N 3.3Å; C6-E11 PolarHBondContact N-O 3.27Å; C6-L13 HydrophobicContact CB-CD1 4.32Å; C6-H21 WeakPolarHBondContact CB-NE2 3.46Å; C6-H21 PolarHBondContact SG-NE2 3.11Å; C6-C28 VanDerWaalsContact SG-SG 3.62Å; C6-L31 HydrophobicContact CB-CD2 4.14Å
7N93.3Very high92.3Very high94 Ų9461.7 Ų61.750%0.50336%0.357SS..THydrogen-bonded Turntrans-70.8-17.7-179.1-79.2-33.2000114V30 S32N7-V30 HydrophobicContact CB-CB 4.31Å; N7-V30 PolarHBondContact N-O 2.69Å; N7-V30 VanDerWaalsContact N-O 3.11Å; N7-V30 VanDerWaalsContact ND2-CG1 3.28Å; N7-V30 WeakPolarHBondContact ND2-CG1 3.39Å; N7-S32 PolarHBondContact ND2-OG 3.16Å; N7-S32 PolarHBondContact OD1-OG 3.48Å
8A93.4Very high92.3Very high60 Ų6058.3 Ų58.350%0.49634%0.337SS..THydrogen-bonded Turntrans-84.6-35.7179.800000114C6 G27C6-A8 PolarHBondContact O-N 3.18Å; A8-G27 VanDerWaalsContact CB-C 3.48Å; A8-G27 WeakPolarHBondContact CB-O 3.45Å
9C94.6Very high92.3Very high69 Ų6959.4 Ų59.447%0.46634%0.342SS..THydrogen-bonded Turntrans-123.7-6.5-175.566.90000114.3E11 H21C9-E11 PolarHBondContact O-N 2.98Å; C9-H21 PolarHBondContact SG-CE1 3.31Å
10G92.1Very high92.3Very high49 Ų4964 Ų6451%0.50536%0.358SS..  trans72.94.4-17900000115.2C6C6-G10 WeakPolarHBondContact O-CA 3.46Å; C6-G10 PolarHBondContact O-N 3.3Å
11E94.3Very high92.4Very high102 Ų10261.5 Ų61.548%0.47734%0.343SS..  trans-67.7135.8-179.4-167.3178.5-174.100111.3T5 C6 C9 L13 H21T5-E11 WeakPolarHBondContact CA-O 3.36Å; C6-E11 PolarHBondContact N-O 3.27Å; C9-E11 PolarHBondContact O-N 2.98Å; E11-L13 HydrophobicContact CG-CD2 3.91Å; E11-L13 HydrophobicContact CG-CG 4.37Å; E11-H21 IonicContact OE2-CE1 2.74Å; E11-H21 PolarHBondContact OE2-CE1 3.1Å; E11-H21 IonicContact OE2-ND1 2.76Å; E11-H21 PolarHBondContact OE2-ND1 2.94Å
12S94.4Very high93.1Very high75 Ų7556.8 Ų56.852%0.52432%0.323SS..EExtended strand (participates in β ladder)trans-92.1119.7174.9-64.80000110.8F4F4-S12 CarbonylContact O-C 3.52Å; F4-S12 WeakPolarHBondContact O-CA 3.33Å
13L93.7Very high93.2Very high5 Ų563.7 Ų63.73%0.02636%0.356CS..EExtended strand (participates in β ladder)trans-122.1135.1-167.8-58.6164.7000110.6F3 F4 C6 E11 V18 H21 L31F3-L13 WeakPolarHBondContact CA-O 3.42Å; F4-L13 PolarHBondContact N-O 3.39Å; F4-L13 PolarHBondContact O-N 3.09Å; C6-L13 HydrophobicContact CB-CD1 4.32Å; E11-L13 HydrophobicContact CG-CD2 3.91Å; E11-L13 HydrophobicContact CG-CG 4.37Å; L13-V18 HydrophobicContact CB-CG2 4.08Å; L13-H21 HydrophobicContact CD1-CB 3.54Å; L13-H21 VanDerWaalsContact CD1-CD2 3.41Å; L13-H21 WeakPolarHBondContact CD1-CD2 3.48Å; L13-H21 HydrophobicContact CD2-CB 3.75Å; L13-H21 HydrophobicContact CG-CB 4.27Å; L13-L31 HydrophobicContact CD1-CD2 4.12Å
14K93.4Very high93.2Very high87 Ų8768.3 Ų68.338%0.37838%0.376SS..EExtended strand (participates in β ladder)trans-70.9150.8164.6-66.9171.9-176.71760109.4M1 F3 A16 Q17 V18M1-K14 HydrophobicContact CE-CB 3.81Å; M1-K14 HydrophobicContact CE-CD 4.09Å; M1-K14 HydrophobicContact CE-CG 4.28Å; M1-K14 HydrophobicContact SD-CB 4.44Å; M1-K14 HydrophobicContact SD-CD 4.04Å; M1-K14 HydrophobicContact SD-CG 4.32Å; F3-K14 HydrophobicContact CD1-CG 3.73Å; F3-K14 HydrophobicContact CE1-CD 4.09Å; F3-K14 HydrophobicContact CE1-CG 3.32Å; F3-K14 HydrophobicContact CZ-CG 4.02Å; K14-A16 PolarHBondContact O-N 3.29Å; K14-Q17 HydrophobicContact CB-CG 4.26Å; K14-Q17 VanDerWaalsContact CB-OE1 3.3Å; K14-Q17 WeakPolarHBondContact O-CA 3.23Å; K14-Q17 WeakPolarHBondContact O-CB 3.44Å; K14-Q17 PolarHBondContact O-N 3.09Å; K14-V18 PolarHBondContact O-N 3.38Å
15K91Very high93.1Very high60 Ų6069.5 Ų69.526%0.26138%0.384SS..Hα-helixtrans-45.6-42.3177.4-168.6169.4-168.7-820114.6V2 F4 Q17 V18 Y45 K46 H48V2-K15 PolarHBondContact O-N 3.09Å; F4-K15 HydrophobicContact CE2-CB 3.93Å; F4-K15 HydrophobicContact CE2-CD 4.45Å; F4-K15 HydrophobicContact CE2-CG 4.01Å; K15-Q17 VanDerWaalsContact C-N 3.28Å; K15-Q17 PolarHBondContact O-N 3.28Å; K15-V18 PolarHBondContact O-N 3.42Å; K15-Y45 VanDerWaalsContact CE-O 3.3Å; K15-Y45 WeakPolarHBondContact CE-O 2.83Å; K15-K46 VanDerWaalsContact CE-O 3.23Å; K15-K46 WeakPolarHBondContact CE-O 3.29Å; K15-K46 PolarHBondContact NZ-O 3.47Å; K15-H48 VanDerWaalsContact CE-O 3.32Å; K15-H48 WeakPolarHBondContact CE-O 3.42Å
16A91.9Very high92.7Very high69 Ų6979.9 Ų79.957%0.5742%0.419SS*.Hα-helixtrans-73.6-14.1179.400000114.7M1 K14M1-A16 HydrophobicContact CE-CB 4.34Å; K14-A16 PolarHBondContact O-N 3.29Å
17Q92.9Very high92.3Very high94 Ų9482 Ų8244%0.43944%0.442SS..Hα-helixtrans-96.8-15178.6-64176.4-66.200112.3K14 K15 D19 K20 H21K14-Q17 HydrophobicContact CB-CG 4.26Å; K14-Q17 VanDerWaalsContact CB-OE1 3.3Å; K14-Q17 WeakPolarHBondContact O-CA 3.23Å; K14-Q17 WeakPolarHBondContact O-CB 3.44Å; K14-Q17 PolarHBondContact O-N 3.09Å; K15-Q17 VanDerWaalsContact C-N 3.28Å; K15-Q17 PolarHBondContact O-N 3.28Å; Q17-D19 PolarHBondContact O-N 3.02Å; Q17-K20 PolarHBondContact O-N 3.42Å; Q17-H21 PolarHBondContact O-N 3.29Å
18V92.6Very high92Very high0 Ų078.3 Ų78.30%042%0.423CS..Hα-helixtrans-58.9-46.6-178.81790000111.1F4 L13 K14 K15 K20 H21 V22 L31 Y45F4-V18 HydrophobicContact CB-CG2 4.46Å; F4-V18 HydrophobicContact CD2-CG2 3.88Å; F4-V18 HydrophobicContact CG-CG2 4.45Å; L13-V18 HydrophobicContact CB-CG2 4.08Å; K14-V18 PolarHBondContact O-N 3.38Å; K15-V18 PolarHBondContact O-N 3.42Å; V18-K20 VanDerWaalsContact C-N 3.27Å; V18-K20 PolarHBondContact O-N 2.93Å; V18-H21 WeakPolarHBondContact O-CA 3.4Å; V18-H21 WeakPolarHBondContact O-CB 3.45Å; V18-H21 PolarHBondContact O-N 3.18Å; V18-V22 HydrophobicContact CG1-CG2 4.13Å; V18-V22 WeakPolarHBondContact O-CG2 3.16Å; V18-V22 PolarHBondContact O-N 3.46Å; V18-L31 HydrophobicContact CG1-CD1 3.31Å; V18-L31 HydrophobicContact CG1-CD2 4.35Å; V18-L31 HydrophobicContact CG1-CG 4.47Å; V18-Y45 HydrophobicContact CB-CD2 4.13Å; V18-Y45 HydrophobicContact CB-CE2 3.53Å; V18-Y45 HydrophobicContact CG1-CD1 4.09Å; V18-Y45 HydrophobicContact CG1-CD2 3.92Å; V18-Y45 HydrophobicContact CG1-CE1 3.64Å; V18-Y45 HydrophobicContact CG1-CE2 3.45Å; V18-Y45 VanDerWaalsContact CG1-CE2 3.45Å; V18-Y45 HydrophobicContact CG1-CG 4.22Å; V18-Y45 HydrophobicContact CG2-CD2 4.21Å; V18-Y45 HydrophobicContact CG2-CE2 4.08Å
19D91.9Very high91.8Very high79 Ų7982 Ų8242%0.42243%0.43SS..Hα-helixtrans-55.5-43.4178-68-53.3000112Q17 H21 M23 Y45Q17-D19 PolarHBondContact O-N 3.02Å; D19-H21 VanDerWaalsContact C-N 3.31Å; D19-H21 PolarHBondContact O-N 3.25Å; D19-M23 WeakPolarHBondContact O-CG 3.43Å; D19-Y45 PolarHBondContact OD1-OH 3.47Å
20K93.6Very high91.7Very high152 Ų15279.7 Ų79.766%0.66141%0.413SS*.Hα-helixtrans-68.6-32.7177.8-65.5-176.2-180-178.10112.3Q17 V18 K24Q17-K20 PolarHBondContact O-N 3.42Å; V18-K20 VanDerWaalsContact C-N 3.27Å; V18-K20 PolarHBondContact O-N 2.93Å; K20-K24 WeakPolarHBondContact O-CG 3.24Å
21H93.9Very high91.8Very high11 Ų1177.5 Ų77.55%0.05139%0.39CS..Hα-helixtrans-73.8-43.5179.8178.187.9000111.8C6 C9 E11 L13 Q17 V18 D19 M23 K24 C25C6-H21 WeakPolarHBondContact CB-NE2 3.46Å; C6-H21 PolarHBondContact SG-NE2 3.11Å; C9-H21 PolarHBondContact SG-CE1 3.31Å; E11-H21 IonicContact OE2-CE1 2.74Å; E11-H21 PolarHBondContact OE2-CE1 3.1Å; E11-H21 IonicContact OE2-ND1 2.76Å; E11-H21 PolarHBondContact OE2-ND1 2.94Å; L13-H21 HydrophobicContact CD1-CB 3.54Å; L13-H21 VanDerWaalsContact CD1-CD2 3.41Å; L13-H21 WeakPolarHBondContact CD1-CD2 3.48Å; L13-H21 HydrophobicContact CD2-CB 3.75Å; L13-H21 HydrophobicContact CG-CB 4.27Å; Q17-H21 PolarHBondContact O-N 3.29Å; V18-H21 WeakPolarHBondContact O-CA 3.4Å; V18-H21 WeakPolarHBondContact O-CB 3.45Å; V18-H21 PolarHBondContact O-N 3.18Å; D19-H21 VanDerWaalsContact C-N 3.31Å; D19-H21 PolarHBondContact O-N 3.25Å; H21-M23 PolarHBondContact O-N 3.47Å; H21-K24 CarbonylContact O-C 3.44Å; H21-K24 WeakPolarHBondContact O-CA 3.41Å; H21-K24 PolarHBondContact O-N 2.96Å; H21-C25 WeakPolarHBondContact NE2-CB 3.45Å; H21-C25 WeakPolarHBondContact O-CB 3.48Å; H21-C25 PolarHBondContact O-N 2.97Å
22V90.8Very high91.9Very high55 Ų5573.6 Ų73.633%0.33337%0.374SS..Hα-helixtrans-56.2-36.5177.9174.40000111.1V18 K24 C28V18-V22 HydrophobicContact CG1-CG2 4.13Å; V18-V22 WeakPolarHBondContact O-CG2 3.16Å; V18-V22 PolarHBondContact O-N 3.46Å; V22-K24 VanDerWaalsContact C-N 3.31Å; V22-K24 PolarHBondContact O-N 3.44Å; V22-C28 HydrophobicContact CG2-CB 4.44Å
23M90.8Very high91.8Very high161 Ų16170 Ų7079%0.79335%0.349SS*.Hα-helixtrans-69.4-26.3176.2-60.2-60.2161.600113.9D19 H21D19-M23 WeakPolarHBondContact O-CG 3.43Å; H21-M23 PolarHBondContact O-N 3.47Å
24K92.2Very high91.7Very high177 Ų17773.4 Ų73.477%0.7737%0.366SS*.Hα-helixtrans-93.7-37.7-179.8-67.9179.2-178.7-172.40112.3K20 H21 V22K20-K24 WeakPolarHBondContact O-CG 3.24Å; H21-K24 CarbonylContact O-C 3.44Å; H21-K24 WeakPolarHBondContact O-CA 3.41Å; H21-K24 PolarHBondContact O-N 2.96Å; V22-K24 VanDerWaalsContact C-N 3.31Å; V22-K24 PolarHBondContact O-N 3.44Å
25C92.2Very high91.5Very high25 Ų2572.6 Ų72.617%0.16937%0.366CS..  trans-101.496.8-177.4-172.70000109.6H21 G27 C28H21-C25 WeakPolarHBondContact NE2-CB 3.45Å; H21-C25 WeakPolarHBondContact O-CB 3.48Å; H21-C25 PolarHBondContact O-N 2.97Å; C25-G27 PolarHBondContact O-N 3.22Å; C25-G27 VanDerWaalsContact O-N 3.15Å; C25-C28 HydrophobicContact CB-CB 4.01Å; C25-C28 VanDerWaalsContact O-CB 3.31Å; C25-C28 WeakPolarHBondContact O-CB 3.48Å; C25-C28 PolarHBondContact O-N 3.05Å; C25-C28 VanDerWaalsContact O-N 3.09Å
26R87.8Confident91.4Very high253 Ų25370.5 Ų70.596%0.95536%0.359SS*.THydrogen-bonded Turntrans-62.5-20.9-179.2-62.6-173.6178.2-153.6-0.3114.1
27G87.6Confident91.3Very high46 Ų4669.7 Ų69.747%0.47436%0.357SS..THydrogen-bonded Turntrans-90.1-0.7177.700000114.5A8 C25 Q29A8-G27 VanDerWaalsContact CB-C 3.48Å; A8-G27 WeakPolarHBondContact CB-O 3.45Å; C25-G27 PolarHBondContact O-N 3.22Å; C25-G27 VanDerWaalsContact O-N 3.15Å; G27-Q29 VanDerWaalsContact C-N 3.28Å; G27-Q29 PolarHBondContact O-N 3.14Å
28C86.4Confident91.2Very high15 Ų1571.4 Ų71.410%0.10136%0.363CS..  trans-74.877.1-175.4-176.40000111.8C6 V22 C25C6-C28 VanDerWaalsContact SG-SG 3.62Å; V22-C28 HydrophobicContact CG2-CB 4.44Å; C25-C28 HydrophobicContact CB-CB 4.01Å; C25-C28 VanDerWaalsContact O-CB 3.31Å; C25-C28 WeakPolarHBondContact O-CB 3.48Å; C25-C28 PolarHBondContact O-N 3.05Å; C25-C28 VanDerWaalsContact O-N 3.09Å
29Q89.7Confident91.2Very high138 Ų13875.9 Ų75.965%0.64539%0.387SS*.  trans-97.5-29.3178.4-164.9153.911.300113G27 W41 G42G27-Q29 VanDerWaalsContact C-N 3.28Å; G27-Q29 PolarHBondContact O-N 3.14Å; Q29-W41 HydrophobicContact CG-CE3 4.27Å; Q29-W41 HydrophobicContact CG-CZ3 4.35Å; Q29-G42 PolarHBondContact O-N 2.73Å; Q29-G42 VanDerWaalsContact O-N 3.11Å
30V93.2Very high91.3Very high21 Ų2173.2 Ų73.213%0.12737%0.372CS..EExtended strand (participates in β ladder)trans-127.3131.4-179.5-168.50000110.3N7 D39 F40 W41N7-V30 HydrophobicContact CB-CB 4.31Å; N7-V30 PolarHBondContact N-O 2.69Å; N7-V30 VanDerWaalsContact N-O 3.11Å; N7-V30 VanDerWaalsContact ND2-CG1 3.28Å; N7-V30 WeakPolarHBondContact ND2-CG1 3.39Å; V30-D39 HydrophobicContact CG1-CB 3.89Å; V30-F40 WeakPolarHBondContact CA-O 3.44Å; V30-W41 HydrophobicContact CG2-CD2 3.67Å; V30-W41 HydrophobicContact CG2-CE3 3.5Å; V30-W41 VanDerWaalsContact CG2-CE3 3.5Å; V30-W41 HydrophobicContact CG2-CH2 3.49Å; V30-W41 VanDerWaalsContact CG2-CH2 3.49Å; V30-W41 HydrophobicContact CG2-CZ2 3.65Å; V30-W41 HydrophobicContact CG2-CZ3 3.41Å; V30-W41 VanDerWaalsContact CG2-CZ3 3.41Å
31L94.6Very high91.2Very high3 Ų373.4 Ų73.42%0.01637%0.368CS..EExtended strand (participates in β ladder)trans-120.5128.9176.3-72.5154.3000109.2F4 T5 C6 L13 V18 F40 Y45F4-L31 HydrophobicContact CB-CB 4.33Å; F4-L31 HydrophobicContact CB-CD2 4.15Å; F4-L31 HydrophobicContact CD1-CB 4.39Å; T5-L31 WeakPolarHBondContact O-CA 3.37Å; C6-L31 HydrophobicContact CB-CD2 4.14Å; L13-L31 HydrophobicContact CD1-CD2 4.12Å; V18-L31 HydrophobicContact CG1-CD1 3.31Å; V18-L31 HydrophobicContact CG1-CD2 4.35Å; V18-L31 HydrophobicContact CG1-CG 4.47Å; L31-F40 PolarHBondContact N-O 2.88Å; L31-F40 WeakPolarHBondContact O-CB 3.3Å; L31-F40 WeakPolarHBondContact O-CD2 3.22Å; L31-F40 PolarHBondContact O-N 3.42Å; L31-Y45 HydrophobicContact CD1-CD1 3.78Å; L31-Y45 HydrophobicContact CD1-CE1 4.23Å; L31-Y45 HydrophobicContact CD1-CG 4.1Å
32S94.6Very high91Very high19 Ų1975 Ų7513%0.13339%0.388CS..EExtended strand (participates in β ladder)trans-104.3126.7178.7-54.60000109.7F4 T5 N7 I34 K38 D39F4-S32 CarbonylContact C-O 3.59Å; F4-S32 VanDerWaalsContact CA-O 3.27Å; F4-S32 WeakPolarHBondContact CA-O 3.26Å; T5-S32 PolarHBondContact N-O 3.41Å; T5-S32 PolarHBondContact O-N 3.35Å; N7-S32 PolarHBondContact ND2-OG 3.16Å; N7-S32 PolarHBondContact OD1-OG 3.48Å; S32-I34 PolarHBondContact O-N 2.91Å; S32-K38 CarbonylContact C-O 3.54Å; S32-K38 WeakPolarHBondContact CA-O 3.25Å; S32-D39 VanDerWaalsContact CB-OD1 3.26Å; S32-D39 WeakPolarHBondContact CB-OD1 3.46Å; S32-D39 PolarHBondContact OG-OD1 3.43Å
33C93.4Very high90.9Very high1 Ų178.5 Ų78.51%0.00740%0.401CS..EExtended strand (participates in β ladder)trans-72127.3174.3172.90000109.9V2 F4 D35 C36 G37 K38 F40 H48V2-C33 WeakPolarHBondContact CG1-SG 3.44Å; F4-C33 HydrophobicContact CD1-CB 3.99Å; F4-C33 HydrophobicContact CE1-CB 3.96Å; C33-D35 VanDerWaalsContact C-N 3.26Å; C33-D35 PolarHBondContact O-N 3Å; C33-C36 WeakPolarHBondContact CB-SG 3.31Å; C33-C36 PolarHBondContact SG-SG 3.4Å; C33-G37 WeakPolarHBondContact O-CA 3.17Å; C33-G37 PolarHBondContact O-N 3.4Å; C33-K38 PolarHBondContact N-O 2.86Å; C33-F40 HydrophobicContact CB-CD2 4.38Å; C33-F40 HydrophobicContact CB-CE2 3.59Å; C33-F40 HydrophobicContact CB-CZ 4.48Å; C33-H48 PolarHBondContact SG-NE2 3.45Å; C33-H48 VanDerWaalsContact SG-NE2 3.39Å
34I90.9Very high90.8Very high76 Ų7675.2 Ų75.239%0.3939%0.386SS..THydrogen-bonded Turntrans-65.6-36.6-177.2-59.8176000110.7F3 T5 S32 K57F3-I34 HydrophobicContact CB-CD1 3.9Å; F3-I34 HydrophobicContact CB-CG1 4.47Å; F3-I34 PolarHBondContact O-N 3.02Å; F3-I34 VanDerWaalsContact O-N 3.07Å; T5-I34 WeakPolarHBondContact OG1-CD1 3.42Å; T5-I34 VanDerWaalsContact OG1-CG1 3.25Å; T5-I34 WeakPolarHBondContact OG1-CG1 3.22Å; S32-I34 PolarHBondContact O-N 2.91Å; I34-K57 PolarHBondContact O-NZ 2.99Å
35D89.7Confident90.7Very high70 Ų7067.1 Ų67.137%0.37435%0.351SS..THydrogen-bonded Turntrans-73.4-51-174.5-60.8-38.7000110.8C33 C51 K57C33-D35 VanDerWaalsContact C-N 3.26Å; C33-D35 PolarHBondContact O-N 3Å; D35-C51 VanDerWaalsContact C-SG 3.58Å; D35-C51 HydrophobicContact CB-CB 4.14Å; D35-C51 WeakPolarHBondContact CB-SG 3.32Å; D35-K57 WeakPolarHBondContact O-CD 3.39Å; D35-K57 PolarHBondContact O-NZ 3.39Å
36C89.2Confident90.6Very high15 Ų1569.3 Ų69.310%0.10136%0.358CS..THydrogen-bonded Turntrans-96.4-13.6-178.359.80000115.8C33 K38 H48 C51 I52C33-C36 WeakPolarHBondContact CB-SG 3.31Å; C33-C36 PolarHBondContact SG-SG 3.4Å; C36-K38 HydrophobicContact CB-CG 4.41Å; C36-K38 PolarHBondContact O-N 2.63Å; C36-H48 VanDerWaalsContact SG-CE1 3.58Å; C36-C51 WeakPolarHBondContact CB-SG 3.45Å; C36-C51 PolarHBondContact N-SG 3.01Å; C36-I52 HydrophobicContact CB-CB 4.48Å; C36-I52 HydrophobicContact CB-CD1 3.81Å; C36-I52 HydrophobicContact CB-CG1 3.69Å; C36-I52 HydrophobicContact CB-CG2 4.28Å
37G88.5Confident90.7Very high52 Ų5263.6 Ų63.654%0.53635%0.346SS..  trans66.314.8-174.700000114.4C33C33-G37 WeakPolarHBondContact O-CA 3.17Å; C33-G37 PolarHBondContact O-N 3.4Å
38K90.8Very high90.8Very high130 Ų13062.3 Ų62.357%0.56533%0.327SS*.  trans-82140.6173.8-70.3-169.2176.7-161.70110.7S32 C33 C36 F40S32-K38 CarbonylContact C-O 3.54Å; S32-K38 WeakPolarHBondContact CA-O 3.25Å; C33-K38 PolarHBondContact N-O 2.86Å; C36-K38 HydrophobicContact CB-CG 4.41Å; C36-K38 PolarHBondContact O-N 2.63Å; K38-F40 HydrophobicContact CB-CE2 3.86Å; K38-F40 HydrophobicContact CB-CZ 3.91Å; K38-F40 VanDerWaalsContact O-CD2 3.29Å; K38-F40 WeakPolarHBondContact O-CD2 3.35Å; K38-F40 WeakPolarHBondContact O-CE2 3.48Å
39D93.5Very high90.7Very high94 Ų9466.4 Ų66.450%0.50335%0.352SS..EExtended strand (participates in β ladder)trans-90.6137.2173.5-61.3-25.4000110.5V30 S32V30-D39 HydrophobicContact CG1-CB 3.89Å; S32-D39 VanDerWaalsContact CB-OD1 3.26Å; S32-D39 WeakPolarHBondContact CB-OD1 3.46Å; S32-D39 PolarHBondContact OG-OD1 3.43Å
40F93.6Very high90.4Very high24 Ų2468.1 Ų68.111%0.10536%0.357CS..EExtended strand (participates in β ladder)trans-122128.1-179.3-60.9-87.6000108.7F4 V30 L31 C33 K38 D44 H48F4-F40 HydrophobicContact CD1-CD2 4.11Å; F4-F40 HydrophobicContact CD1-CE2 4.43Å; F4-F40 AromaticContact CE1-CD2 3.72Å; F4-F40 HydrophobicContact CE1-CD2 3.72Å; F4-F40 AromaticContact CE1-CE2 3.82Å; F4-F40 HydrophobicContact CE1-CE2 3.82Å; F4-F40 HydrophobicContact CE1-CG 4.4Å; V30-F40 WeakPolarHBondContact CA-O 3.44Å; L31-F40 PolarHBondContact N-O 2.88Å; L31-F40 WeakPolarHBondContact O-CB 3.3Å; L31-F40 WeakPolarHBondContact O-CD2 3.22Å; L31-F40 PolarHBondContact O-N 3.42Å; C33-F40 HydrophobicContact CB-CD2 4.38Å; C33-F40 HydrophobicContact CB-CE2 3.59Å; C33-F40 HydrophobicContact CB-CZ 4.48Å; K38-F40 HydrophobicContact CB-CE2 3.86Å; K38-F40 HydrophobicContact CB-CZ 3.91Å; K38-F40 VanDerWaalsContact O-CD2 3.29Å; K38-F40 WeakPolarHBondContact O-CD2 3.35Å; K38-F40 WeakPolarHBondContact O-CE2 3.48Å; F40-D44 HydrophobicContact CB-CB 4.26Å; F40-D44 HydrophobicContact CD1-CB 4.16Å; F40-H48 HydrophobicContact CD1-CB 4.33Å; F40-H48 HydrophobicContact CE1-CB 3.57Å; F40-H48 AromaticContact CE1-CG 3.81Å; F40-H48 HydrophobicContact CE2-CB 4.44Å; F40-H48 HydrophobicContact CZ-CB 3.64Å; F40-H48 AromaticContact CZ-CD2 3.78Å; F40-H48 AromaticContact CZ-CE1 3.97Å; F40-H48 AromaticContact CZ-CG 3.35Å; F40-H48 AromaticContact CZ-ND1 3.49Å; F40-H48 WeakPolarHBondContact CZ-ND1 3.43Å
41W92.9Very high90.2Very high155 Ų15569.1 Ų69.159%0.58737%0.365SS*.EExtended strand (participates in β ladder)trans-99.7135-179.6-6879000109.9Q29 V30 E43 D44Q29-W41 HydrophobicContact CG-CE3 4.27Å; Q29-W41 HydrophobicContact CG-CZ3 4.35Å; V30-W41 HydrophobicContact CG2-CD2 3.67Å; V30-W41 HydrophobicContact CG2-CE3 3.5Å; V30-W41 VanDerWaalsContact CG2-CE3 3.5Å; V30-W41 HydrophobicContact CG2-CH2 3.49Å; V30-W41 VanDerWaalsContact CG2-CH2 3.49Å; V30-W41 HydrophobicContact CG2-CZ2 3.65Å; V30-W41 HydrophobicContact CG2-CZ3 3.41Å; V30-W41 VanDerWaalsContact CG2-CZ3 3.41Å; W41-E43 PolarHBondContact O-N 3.41Å; W41-E43 VanDerWaalsContact O-N 3.1Å; W41-D44 WeakPolarHBondContact O-CB 3.46Å; W41-D44 PolarHBondContact O-N 3.15Å; W41-D44 VanDerWaalsContact O-N 3.14Å
42G88Confident89.7Confident44 Ų4471.3 Ų71.345%0.45438%0.376SS..THydrogen-bonded Turntrans56.4-115.6177.800000112.7Q29 Y45Q29-G42 PolarHBondContact O-N 2.73Å; Q29-G42 VanDerWaalsContact O-N 3.11Å; G42-Y45 VanDerWaalsContact O-CD1 3.25Å; G42-Y45 WeakPolarHBondContact O-CD1 3.48Å; G42-Y45 WeakPolarHBondContact O-CE1 3.46Å
43E88.8Confident88.9Confident130 Ų13073 Ų7361%0.60739%0.388SS*.THydrogen-bonded Turntrans-950.1-176.5-56.3-154142.200115.1W41 Y45 K46W41-E43 PolarHBondContact O-N 3.41Å; W41-E43 VanDerWaalsContact O-N 3.1Å; E43-Y45 PolarHBondContact O-N 3.47Å; E43-K46 HydrophobicContact CB-CD 4.22Å; E43-K46 VanDerWaalsContact O-CB 3.31Å; E43-K46 WeakPolarHBondContact O-CB 3.24Å; E43-K46 WeakPolarHBondContact O-CG 3.37Å; E43-K46 PolarHBondContact O-N 3.25Å; E43-K46 IonicContact OE1-NZ 3.86Å; E43-K46 PolarHBondContact OE1-NZ 2.98Å; E43-K46 IonicContact OE2-NZ 3.95Å; E43-K46 PolarHBondContact OE2-NZ 2.91Å
44D90.4Very high88.2Confident91 Ų9180 Ų8049%0.48742%0.421SS..G310 helixtrans-58.9-26.7-175.1-78.3-13.2000113.4F40 W41 K46 N47F40-D44 HydrophobicContact CB-CB 4.26Å; F40-D44 HydrophobicContact CD1-CB 4.16Å; W41-D44 WeakPolarHBondContact O-CB 3.46Å; W41-D44 PolarHBondContact O-N 3.15Å; W41-D44 VanDerWaalsContact O-N 3.14Å; D44-K46 PolarHBondContact O-N 2.97Å; D44-K46 VanDerWaalsContact O-N 3.12Å; D44-N47 PolarHBondContact O-N 3.49Å; D44-N47 VanDerWaalsContact O-N 3.14Å
45Y90Very high87.5Confident7 Ų781.1 Ų81.13%0.02743%0.427CS..G310 helixtrans-60.2-22.3176.578.5-90000112.5F4 K15 V18 D19 L31 G42 E43 N47 H48F4-Y45 HydrophobicContact CE2-CD2 4.3Å; F4-Y45 HydrophobicContact CZ-CD2 4.44Å; K15-Y45 VanDerWaalsContact CE-O 3.3Å; K15-Y45 WeakPolarHBondContact CE-O 2.83Å; V18-Y45 HydrophobicContact CB-CD2 4.13Å; V18-Y45 HydrophobicContact CB-CE2 3.53Å; V18-Y45 HydrophobicContact CG1-CD1 4.09Å; V18-Y45 HydrophobicContact CG1-CD2 3.92Å; V18-Y45 HydrophobicContact CG1-CE1 3.64Å; V18-Y45 HydrophobicContact CG1-CE2 3.45Å; V18-Y45 VanDerWaalsContact CG1-CE2 3.45Å; V18-Y45 HydrophobicContact CG1-CG 4.22Å; V18-Y45 HydrophobicContact CG2-CD2 4.21Å; V18-Y45 HydrophobicContact CG2-CE2 4.08Å; D19-Y45 PolarHBondContact OD1-OH 3.47Å; L31-Y45 HydrophobicContact CD1-CD1 3.78Å; L31-Y45 HydrophobicContact CD1-CE1 4.23Å; L31-Y45 HydrophobicContact CD1-CG 4.1Å; G42-Y45 VanDerWaalsContact O-CD1 3.25Å; G42-Y45 WeakPolarHBondContact O-CD1 3.48Å; G42-Y45 WeakPolarHBondContact O-CE1 3.46Å; E43-Y45 PolarHBondContact O-N 3.47Å; Y45-N47 VanDerWaalsContact C-N 3.29Å; Y45-N47 PolarHBondContact O-N 3.22Å; Y45-H48 WeakPolarHBondContact O-CB 3.25Å; Y45-H48 PolarHBondContact O-N 3.39Å
46K90.1Very high87Confident72 Ų7282 Ų8231%0.31343%0.429SS..G310 helixtrans-63.8-35.9177.7-68.2-178-173.3171.50111.7K15 E43 D44 H48K15-K46 VanDerWaalsContact CE-O 3.23Å; K15-K46 WeakPolarHBondContact CE-O 3.29Å; K15-K46 PolarHBondContact NZ-O 3.47Å; E43-K46 HydrophobicContact CB-CD 4.22Å; E43-K46 VanDerWaalsContact O-CB 3.31Å; E43-K46 WeakPolarHBondContact O-CB 3.24Å; E43-K46 WeakPolarHBondContact O-CG 3.37Å; E43-K46 PolarHBondContact O-N 3.25Å; E43-K46 IonicContact OE1-NZ 3.86Å; E43-K46 PolarHBondContact OE1-NZ 2.98Å; E43-K46 IonicContact OE2-NZ 3.95Å; E43-K46 PolarHBondContact OE2-NZ 2.91Å; D44-K46 PolarHBondContact O-N 2.97Å; D44-K46 VanDerWaalsContact O-N 3.12Å; K46-H48 VanDerWaalsContact C-N 3.29Å
47N89.2Confident86.4Confident132 Ų13285.2 Ų85.271%0.70644%0.441SS*.THydrogen-bonded Turntrans-77.8-16.9179.1-65.9-31000112.6D44 Y45 T49D44-N47 PolarHBondContact O-N 3.49Å; D44-N47 VanDerWaalsContact O-N 3.14Å; Y45-N47 VanDerWaalsContact C-N 3.29Å; Y45-N47 PolarHBondContact O-N 3.22Å; N47-T49 PolarHBondContact O-N 3.14Å
48H89.5Confident86Confident19 Ų1990.5 Ų90.59%0.08845%0.446CS..  trans-7688.2176.9-167.161.3000111.3F4 K15 C33 C36 F40 Y45 K46 K50F4-H48 HydrophobicContact CE1-CB 4.46Å; F4-H48 AromaticContact CE1-CD2 3.94Å; F4-H48 HydrophobicContact CZ-CB 4.17Å; F4-H48 AromaticContact CZ-CD2 3.84Å; K15-H48 VanDerWaalsContact CE-O 3.32Å; K15-H48 WeakPolarHBondContact CE-O 3.42Å; C33-H48 PolarHBondContact SG-NE2 3.45Å; C33-H48 VanDerWaalsContact SG-NE2 3.39Å; C36-H48 VanDerWaalsContact SG-CE1 3.58Å; F40-H48 HydrophobicContact CD1-CB 4.33Å; F40-H48 HydrophobicContact CE1-CB 3.57Å; F40-H48 AromaticContact CE1-CG 3.81Å; F40-H48 HydrophobicContact CE2-CB 4.44Å; F40-H48 HydrophobicContact CZ-CB 3.64Å; F40-H48 AromaticContact CZ-CD2 3.78Å; F40-H48 AromaticContact CZ-CE1 3.97Å; F40-H48 AromaticContact CZ-CG 3.35Å; F40-H48 AromaticContact CZ-ND1 3.49Å; F40-H48 WeakPolarHBondContact CZ-ND1 3.43Å; Y45-H48 WeakPolarHBondContact O-CB 3.25Å; Y45-H48 PolarHBondContact O-N 3.39Å; K46-H48 VanDerWaalsContact C-N 3.29Å; H48-K50 PolarHBondContact CE1-O 3.31Å; H48-K50 VanDerWaalsContact CE1-O 3.22Å
49T84.8Confident85.3Confident101 Ų10185.6 Ų85.662%0.6243%0.432SS*.  trans-105.2-23.4-179.556.80000113.2N47N47-T49 PolarHBondContact O-N 3.14Å
50K83.8Confident84.8Confident174 Ų17483.9 Ų83.976%0.75744%0.437SS*.SBendtrans-127.7127.4178.4-63.1177.8-174.7171.80109.2H48H48-K50 PolarHBondContact CE1-O 3.31Å; H48-K50 VanDerWaalsContact CE1-O 3.22Å
51C87.4Confident83.9Confident42 Ų4293.7 Ų93.728%0.28448%0.479SS..PPolyproline II helixtrans-94.6159.7175.9-172.50000110.9D35 C36D35-C51 VanDerWaalsContact C-SG 3.58Å; D35-C51 HydrophobicContact CB-CB 4.14Å; D35-C51 WeakPolarHBondContact CB-SG 3.32Å; C36-C51 WeakPolarHBondContact CB-SG 3.45Å; C36-C51 PolarHBondContact N-SG 3.01Å
52I83.8Confident83Confident50 Ų5089.8 Ų89.826%0.25649%0.487SS..PPolyproline II helixtrans-60149.2169.469.6-176.4000110C36 Q56 K57C36-I52 HydrophobicContact CB-CB 4.48Å; C36-I52 HydrophobicContact CB-CD1 3.81Å; C36-I52 HydrophobicContact CB-CG1 3.69Å; C36-I52 HydrophobicContact CB-CG2 4.28Å; I52-Q56 HydrophobicContact CB-CB 4.38Å; I52-Q56 HydrophobicContact CB-CG 4.46Å; I52-K57 HydrophobicContact CD1-CB 3.78Å; I52-K57 HydrophobicContact CD1-CD 4.42Å; I52-K57 HydrophobicContact CD1-CG 4.16Å; I52-K57 HydrophobicContact CG1-CB 4.37Å
53S79.4Confident82.3Confident53 Ų5391.6 Ų91.637%0.37148%0.481SS..PPolyproline II helixtrans-71.8155.4171.956.90000110.8D55 Q56 K57S53-D55 PolarHBondContact O-N 3.28Å; S53-Q56 WeakPolarHBondContact O-CB 3.48Å; S53-Q56 PolarHBondContact O-N 3.47Å; S53-Q56 WeakPolarHBondContact OG-CB 3.21Å; S53-Q56 PolarHBondContact OG-N 2.77Å; S53-K57 PolarHBondContact O-N 3.2Å; S53-K57 VanDerWaalsContact O-N 3.16Å
54E78.4Confident81.3Confident150 Ų15093.6 Ų93.670%0.70149%0.49SS*.Hα-helixtrans-54-43.7173.9-172.1175.310500111.2Q56 K57 Y58E54-Q56 PolarHBondContact O-N 3.26Å; E54-K57 PolarHBondContact O-N 3.15Å; E54-Y58 HydrophobicContact CG-CD2 3.69Å; E54-Y58 HydrophobicContact CG-CE2 4.07Å; E54-Y58 WeakPolarHBondContact O-CD2 3.49Å; E54-Y58 PolarHBondContact O-N 2.85Å
55D75.2Confident80.3Confident98 Ų9893.6 Ų93.652%0.52449%0.494SS..Hα-helixtrans-59.9-30.6176-61.7-27.8000113.2S53 G59 Y63S53-D55 PolarHBondContact O-N 3.28Å; D55-G59 WeakPolarHBondContact O-CA 3.44Å; D55-G59 PolarHBondContact O-N 3.18Å; D55-Y63 HydrophobicContact CB-CD2 4.49Å; D55-Y63 HydrophobicContact CB-CE1 4.24Å; D55-Y63 HydrophobicContact CB-CE2 3.59Å; D55-Y63 VanDerWaalsContact CB-CZ 3.42Å; D55-Y63 WeakPolarHBondContact CB-OH 3.4Å; D55-Y63 WeakPolarHBondContact O-CD1 3.26Å; D55-Y63 WeakPolarHBondContact O-CE1 3.49Å
56Q79Confident79.3Confident88 Ų88100.7 Ų100.741%0.41153%0.525SS..Hα-helixtrans-79.9-26.7176.6-174.7178.5-20.400112.3I52 S53 E54 Y63 V65I52-Q56 HydrophobicContact CB-CB 4.38Å; I52-Q56 HydrophobicContact CB-CG 4.46Å; S53-Q56 WeakPolarHBondContact O-CB 3.48Å; S53-Q56 PolarHBondContact O-N 3.47Å; S53-Q56 WeakPolarHBondContact OG-CB 3.21Å; S53-Q56 PolarHBondContact OG-N 2.77Å; E54-Q56 PolarHBondContact O-N 3.26Å; Q56-Y63 HydrophobicContact CB-CD1 4.44Å; Q56-Y63 HydrophobicContact CB-CE1 3.98Å; Q56-V65 HydrophobicContact CG-CG2 4.13Å
57K77.5Confident78.4Confident84 Ų84100 Ų10037%0.36553%0.532SS..Hα-helixtrans-80.4-40.9178-171.7175.3-177.3179.40112.2I34 D35 I52 S53 E54I34-K57 PolarHBondContact O-NZ 2.99Å; D35-K57 WeakPolarHBondContact O-CD 3.39Å; D35-K57 PolarHBondContact O-NZ 3.39Å; I52-K57 HydrophobicContact CD1-CB 3.78Å; I52-K57 HydrophobicContact CD1-CD 4.42Å; I52-K57 HydrophobicContact CD1-CG 4.16Å; I52-K57 HydrophobicContact CG1-CB 4.37Å; S53-K57 PolarHBondContact O-N 3.2Å; S53-K57 VanDerWaalsContact O-N 3.16Å; E54-K57 PolarHBondContact O-N 3.15Å
58Y80.6Confident77.8Confident162 Ų16298.8 Ų98.864%0.63553%0.526SS*.Hα-helixtrans-112-8.8-174.5-58.4-73.9000113.8E54 G60E54-Y58 HydrophobicContact CG-CD2 3.69Å; E54-Y58 HydrophobicContact CG-CE2 4.07Å; E54-Y58 WeakPolarHBondContact O-CD2 3.49Å; E54-Y58 PolarHBondContact O-N 2.85Å; Y58-G60 PolarHBondContact O-N 2.91Å; Y58-G60 VanDerWaalsContact O-N 3.1Å
59G75.3Confident77.4Confident27 Ų27105.2 Ų105.228%0.27855%0.553SS.*SBendtrans-65.2112167.800000107.7D55D55-G59 WeakPolarHBondContact O-CA 3.44Å; D55-G59 PolarHBondContact O-N 3.18Å
60G82.8Confident77.3Confident58 Ų58102.3 Ų102.360%0.59854%0.544SS*.  trans-59.2-167.8-172.900000114.3Y58 G62 Y63Y58-G60 PolarHBondContact O-N 2.91Å; Y58-G60 VanDerWaalsContact O-N 3.1Å; G60-G62 PolarHBondContact O-N 3.5Å; G60-Y63 PolarHBondContact O-N 3.24Å
61K74.3Confident77.3Confident230 Ų23098.3 Ų98.3100%153%0.531SS*.THydrogen-bonded Turntrans-56.7-5.7-170.2-155.3169.6-178.4-177.40116.6
62G75.3Confident77.3Confident73 Ų7398.5 Ų98.575%0.75353%0.53SS*.THydrogen-bonded Turntrans-11814.8174.400000115.2G60 E64G60-G62 PolarHBondContact O-N 3.5Å; G62-E64 PolarHBondContact O-N 2.89Å; G62-E64 VanDerWaalsContact O-N 3.13Å
63Y73.8Confident77.6Confident83 Ų83102.2 Ų102.233%0.32555%0.545SS..  trans-73.4104.2176.6-178.7-99.9000110.8D55 Q56 G60 V65D55-Y63 HydrophobicContact CB-CD2 4.49Å; D55-Y63 HydrophobicContact CB-CE1 4.24Å; D55-Y63 HydrophobicContact CB-CE2 3.59Å; D55-Y63 VanDerWaalsContact CB-CZ 3.42Å; D55-Y63 WeakPolarHBondContact CB-OH 3.4Å; D55-Y63 WeakPolarHBondContact O-CD1 3.26Å; D55-Y63 WeakPolarHBondContact O-CE1 3.49Å; Q56-Y63 HydrophobicContact CB-CD1 4.44Å; Q56-Y63 HydrophobicContact CB-CE1 3.98Å; G60-Y63 PolarHBondContact O-N 3.24Å; Y63-V65 HydrophobicContact CD1-CG2 4.35Å; Y63-V65 HydrophobicContact CE1-CG2 4.1Å
64E67.7Low78Confident171 Ų171101 Ų10180%0.79953%0.533SS*.  trans-76.6123.6166.3-65.8-176.3169.600109.1G62 K66G62-E64 PolarHBondContact O-N 2.89Å; G62-E64 VanDerWaalsContact O-N 3.13Å; E64-K66 VanDerWaalsContact C-N 3.27Å; E64-K66 PolarHBondContact O-N 3.13Å
65V68.1Low78.5Confident92 Ų92100.1 Ų100.156%0.55853%0.529SS*.  trans-6391.8173.4-178.70000108.1Q56 Y63 A67Q56-V65 HydrophobicContact CG-CG2 4.13Å; Y63-V65 HydrophobicContact CD1-CG2 4.35Å; Y63-V65 HydrophobicContact CE1-CG2 4.1Å; V65-A67 PolarHBondContact O-N 3.24Å
66K68.7Low79.2Confident155 Ų15599.7 Ų99.767%0.67452%0.524SS*.  trans-71.3108.7176.4-164.4174.2-164.81070107.3E64 N68E64-K66 VanDerWaalsContact C-N 3.27Å; E64-K66 PolarHBondContact O-N 3.13Å; K66-N68 PolarHBondContact O-N 3.38Å
67A71.4Confident79.7Confident57 Ų5795.8 Ų95.847%0.47151%0.505SS..  trans-46.8132178.500000110.7V65 K69 V72V65-A67 PolarHBondContact O-N 3.24Å; A67-K69 PolarHBondContact O-N 2.59Å; A67-K69 VanDerWaalsContact O-N 3.13Å; A67-V72 HydrophobicContact CB-CG2 3.41Å; A67-V72 VanDerWaalsContact CB-CG2 3.41Å
68N78.1Confident80.4Confident108 Ų10893.4 Ų93.458%0.57850%0.496SS*.  trans-55.6124.6-178.1-69.5-59.5000108.7K66 G70 D71 V72K66-N68 PolarHBondContact O-N 3.38Å; N68-G70 PolarHBondContact O-N 3.42Å; N68-D71 HydrophobicContact CB-CB 4.09Å; N68-D71 WeakPolarHBondContact CB-OD2 3.43Å; N68-D71 PolarHBondContact ND2-OD2 3.29Å; N68-D71 VanDerWaalsContact ND2-OD2 3.16Å; N68-D71 PolarHBondContact O-N 3.13Å; N68-V72 PolarHBondContact O-N 3.35Å
69K80.3Confident80.9Confident153 Ų15391 Ų9167%0.66549%0.491SS*.Hα-helixtrans-54-26.4-179.9-70127.7179.1172.40112.8A67 K73A67-K69 PolarHBondContact O-N 2.59Å; A67-K69 VanDerWaalsContact O-N 3.13Å; K69-K73 WeakPolarHBondContact O-CD 3.42Å; K69-K73 WeakPolarHBondContact O-CG 3.41Å; K69-K73 PolarHBondContact O-N 2.85Å
70G82.9Confident81.6Confident40 Ų4092.2 Ų92.241%0.41249%0.487SS..Hα-helixtrans-72.2-42.6174.600000113.6N68 Q74 R109N68-G70 PolarHBondContact O-N 3.42Å; G70-Q74 PolarHBondContact O-N 3.36Å; G70-Q74 VanDerWaalsContact O-N 3.08Å; G70-R109 PolarHBondContact O-NH1 2.9Å
71D84Confident82Confident91 Ų9189.4 Ų89.449%0.48746%0.459SS..Hα-helixtrans-72.1-42.2179.8-67.5-21.1000110.9N68 K73 Q74 Q75N68-D71 HydrophobicContact CB-CB 4.09Å; N68-D71 WeakPolarHBondContact CB-OD2 3.43Å; N68-D71 PolarHBondContact ND2-OD2 3.29Å; N68-D71 VanDerWaalsContact ND2-OD2 3.16Å; N68-D71 PolarHBondContact O-N 3.13Å; D71-K73 VanDerWaalsContact C-N 3.28Å; D71-K73 PolarHBondContact O-N 3.13Å; D71-Q74 CarbonylContact O-C 3.46Å; D71-Q74 WeakPolarHBondContact O-CA 3.47Å; D71-Q74 WeakPolarHBondContact O-CB 3.44Å; D71-Q74 PolarHBondContact O-N 3.42Å; D71-Q75 WeakPolarHBondContact O-CG 3.44Å; D71-Q75 PolarHBondContact O-N 3.24Å
72V87.4Confident82.7Confident46 Ų4681.7 Ų81.728%0.27943%0.428SS..Hα-helixtrans-57.7-44.1174.5177.60000110.7A67 N68 Q74 Q75 Q76A67-V72 HydrophobicContact CB-CG2 3.41Å; A67-V72 VanDerWaalsContact CB-CG2 3.41Å; N68-V72 PolarHBondContact O-N 3.35Å; V72-Q74 VanDerWaalsContact C-N 3.26Å; V72-Q74 PolarHBondContact O-N 3.28Å; V72-Q75 PolarHBondContact O-N 3.42Å; V72-Q76 WeakPolarHBondContact O-CB 3.42Å; V72-Q76 VanDerWaalsContact O-CG 3.29Å; V72-Q76 WeakPolarHBondContact O-CG 3.4Å; V72-Q76 PolarHBondContact O-N 3.07Å
73K88.6Confident83.4Confident127 Ų12782.6 Ų82.655%0.55241%0.413SS*.Hα-helixtrans-65.8-29.2175.1-73.9176.9-177.1-172.60112.9K69 D71 W77K69-K73 WeakPolarHBondContact O-CD 3.42Å; K69-K73 WeakPolarHBondContact O-CG 3.41Å; K69-K73 PolarHBondContact O-N 2.85Å; D71-K73 VanDerWaalsContact C-N 3.28Å; D71-K73 PolarHBondContact O-N 3.13Å; K73-W77 WeakPolarHBondContact O-CB 3.24Å; K73-W77 PolarHBondContact O-N 3.06Å; K73-W77 VanDerWaalsContact O-N 3.15Å
74Q88.4Confident84.1Confident28 Ų2878.8 Ų78.813%0.13140%0.399CS..Hα-helixtrans-75.3-42.6176.7-170.764.216.100110.8G70 D71 V72 W77 L78 E105 V107G70-Q74 PolarHBondContact O-N 3.36Å; G70-Q74 VanDerWaalsContact O-N 3.08Å; D71-Q74 CarbonylContact O-C 3.46Å; D71-Q74 WeakPolarHBondContact O-CA 3.47Å; D71-Q74 WeakPolarHBondContact O-CB 3.44Å; D71-Q74 PolarHBondContact O-N 3.42Å; V72-Q74 VanDerWaalsContact C-N 3.26Å; V72-Q74 PolarHBondContact O-N 3.28Å; Q74-W77 WeakPolarHBondContact O-CB 3.35Å; Q74-W77 PolarHBondContact O-N 3.28Å; Q74-W77 VanDerWaalsContact O-N 3.16Å; Q74-L78 WeakPolarHBondContact O-CG 3.34Å; Q74-L78 PolarHBondContact O-N 3.4Å; Q74-E105 PolarHBondContact NE2-O 2.68Å; Q74-V107 PolarHBondContact NE2-O 3.43Å
75Q88.7Confident84.9Confident131 Ų13172.7 Ų72.761%0.61237%0.371SS*.Hα-helixtrans-62.4-45174.6-72179.5-31.500111.6D71 V72 W77 L78 Q79D71-Q75 WeakPolarHBondContact O-CG 3.44Å; D71-Q75 PolarHBondContact O-N 3.24Å; V72-Q75 PolarHBondContact O-N 3.42Å; Q75-W77 VanDerWaalsContact C-N 3.26Å; Q75-W77 PolarHBondContact O-N 2.86Å; Q75-L78 PolarHBondContact O-N 3.48Å; Q75-Q79 WeakPolarHBondContact O-CB 3.21Å; Q75-Q79 PolarHBondContact O-N 3.21Å
76Q90.4Very high85.6Confident89 Ų8974.7 Ų74.742%0.41638%0.378SS..Hα-helixtrans-59.4-38.7173-73.3173.4300111.8V72 Q79 R80V72-Q76 WeakPolarHBondContact O-CB 3.42Å; V72-Q76 VanDerWaalsContact O-CG 3.29Å; V72-Q76 WeakPolarHBondContact O-CG 3.4Å; V72-Q76 PolarHBondContact O-N 3.07Å; Q76-Q79 PolarHBondContact O-N 3.14Å; Q76-R80 WeakPolarHBondContact O-CD 3.39Å; Q76-R80 VanDerWaalsContact O-CG 3.24Å; Q76-R80 WeakPolarHBondContact O-CG 3.48Å; Q76-R80 PolarHBondContact O-N 3.31Å
77W90.3Very high86.3Confident6 Ų673.3 Ų73.32%0.02337%0.372CS..Hα-helixtrans-63.5-45.5175.2176.8-105.7000112.5K73 Q74 Q75 Q79 R80 I81 R109 W134 I137K73-W77 WeakPolarHBondContact O-CB 3.24Å; K73-W77 PolarHBondContact O-N 3.06Å; K73-W77 VanDerWaalsContact O-N 3.15Å; Q74-W77 WeakPolarHBondContact O-CB 3.35Å; Q74-W77 PolarHBondContact O-N 3.28Å; Q74-W77 VanDerWaalsContact O-N 3.16Å; Q75-W77 VanDerWaalsContact C-N 3.26Å; Q75-W77 PolarHBondContact O-N 2.86Å; W77-Q79 VanDerWaalsContact C-N 3.34Å; W77-R80 PolarHBondContact O-N 3.47Å; W77-I81 WeakPolarHBondContact O-CG1 3.46Å; W77-I81 PolarHBondContact O-N 2.83Å; W77-R109 HydrophobicContact CB-CG 4.17Å; W77-R109 HydrophobicContact CD2-CG 3.94Å; W77-R109 HydrophobicContact CG-CG 3.75Å; W77-W134 HydrophobicContact CH2-CE3 4.15Å; W77-W134 AromaticContact CH2-CH2 3.8Å; W77-W134 HydrophobicContact CH2-CH2 3.8Å; W77-W134 AromaticContact CH2-CZ3 3.57Å; W77-W134 HydrophobicContact CH2-CZ3 3.57Å; W77-W134 HydrophobicContact CZ2-CE3 4.35Å; W77-W134 HydrophobicContact CZ2-CH2 4.29Å; W77-W134 AromaticContact CZ2-CZ3 3.71Å; W77-W134 HydrophobicContact CZ2-CZ3 3.71Å; W77-I137 HydrophobicContact CD2-CG2 4.4Å; W77-I137 HydrophobicContact CE3-CG2 4.03Å; W77-I137 HydrophobicContact CH2-CB 4.01Å; W77-I137 HydrophobicContact CH2-CG2 3.27Å; W77-I137 HydrophobicContact CZ2-CB 4.48Å; W77-I137 HydrophobicContact CZ2-CD1 4.48Å; W77-I137 HydrophobicContact CZ2-CG2 3.69Å; W77-I137 HydrophobicContact CZ3-CB 4.5Å; W77-I137 HydrophobicContact CZ3-CG2 3.46Å; W77-I137 VanDerWaalsContact CZ3-CG2 3.46Å
78L91Very high86.4Confident34 Ų3476.4 Ų76.418%0.17839%0.387CS..Hα-helixtrans-65.4-37.1175.3-67173.6000112.2Q74 Q75 R80 I81 N82 Y104 V107Q74-L78 WeakPolarHBondContact O-CG 3.34Å; Q74-L78 PolarHBondContact O-N 3.4Å; Q75-L78 PolarHBondContact O-N 3.48Å; L78-R80 VanDerWaalsContact C-N 3.31Å; L78-R80 PolarHBondContact O-N 3.19Å; L78-I81 HydrophobicContact CD2-CD1 4.14Å; L78-I81 WeakPolarHBondContact O-CB 3.47Å; L78-I81 PolarHBondContact O-N 3.45Å; L78-N82 PolarHBondContact O-N 2.83Å; L78-N82 PolarHBondContact O-ND2 2.99Å; L78-Y104 WeakPolarHBondContact CD2-O 3.31Å; L78-V107 HydrophobicContact CD2-CG2 4.1Å
79Q91.4Very high86.6Confident112 Ų11275.3 Ų75.352%0.52340%0.402SS..Hα-helixtrans-60.9-42.9175.9-173.1-179.6-1700111Q75 Q76 W77 I81 N82 E83Q75-Q79 WeakPolarHBondContact O-CB 3.21Å; Q75-Q79 PolarHBondContact O-N 3.21Å; Q76-Q79 PolarHBondContact O-N 3.14Å; W77-Q79 VanDerWaalsContact C-N 3.34Å; Q79-I81 VanDerWaalsContact C-N 3.31Å; Q79-I81 PolarHBondContact O-N 3.27Å; Q79-N82 CarbonylContact O-C 3.57Å; Q79-N82 WeakPolarHBondContact O-CA 3.25Å; Q79-N82 WeakPolarHBondContact O-CB 3.39Å; Q79-N82 PolarHBondContact O-N 2.79Å; Q79-N82 VanDerWaalsContact O-N 3.07Å; Q79-E83 WeakPolarHBondContact CG-OE1 3.23Å; Q79-E83 PolarHBondContact NE2-OE1 2.81Å; Q79-E83 WeakPolarHBondContact O-CG 3.31Å; Q79-E83 PolarHBondContact O-N 2.76Å
80R90.2Very high86.7Confident52 Ų5268.9 Ų68.920%0.19638%0.375CS..Hα-helixtrans-62.7-37.3175.3-67.4161.4-173.3-173.7-10.8113Q76 W77 L78 N82 E83 A84 I137 A140 D141Q76-R80 WeakPolarHBondContact O-CD 3.39Å; Q76-R80 VanDerWaalsContact O-CG 3.24Å; Q76-R80 WeakPolarHBondContact O-CG 3.48Å; Q76-R80 PolarHBondContact O-N 3.31Å; W77-R80 PolarHBondContact O-N 3.47Å; L78-R80 VanDerWaalsContact C-N 3.31Å; L78-R80 PolarHBondContact O-N 3.19Å; R80-N82 VanDerWaalsContact C-N 3.28Å; R80-N82 PolarHBondContact O-N 2.87Å; R80-E83 PolarHBondContact O-N 2.86Å; R80-A84 VanDerWaalsContact O-CB 3.29Å; R80-A84 WeakPolarHBondContact O-CB 3.3Å; R80-A84 PolarHBondContact O-N 3.4Å; R80-I137 HydrophobicContact CB-CG2 4.31Å; R80-A140 HydrophobicContact CB-CB 4.27Å; R80-A140 HydrophobicContact CG-CB 4.37Å; R80-D141 VanDerWaalsContact CZ-CG 3.49Å; R80-D141 IonicContact CZ-OD1 3.09Å; R80-D141 IonicContact CZ-OD2 2.76Å; R80-D141 IonicContact NH1-OD1 3.39Å; R80-D141 PolarHBondContact NH1-OD1 3.4Å; R80-D141 IonicContact NH1-OD2 2.59Å; R80-D141 PolarHBondContact NH1-OD2 3.44Å; R80-D141 IonicContact NH2-OD1 2.78Å; R80-D141 PolarHBondContact NH2-OD1 3.45Å
81I90.8Very high86.8Confident0 Ų069.7 Ų69.70%038%0.375CS..Hα-helixtrans-60.6-42.9173.7-68.6160.1000109.7W77 L78 Q79 A84 M85 L98 V101 V107 I137W77-I81 WeakPolarHBondContact O-CG1 3.46Å; W77-I81 PolarHBondContact O-N 2.83Å; L78-I81 HydrophobicContact CD2-CD1 4.14Å; L78-I81 WeakPolarHBondContact O-CB 3.47Å; L78-I81 PolarHBondContact O-N 3.45Å; Q79-I81 VanDerWaalsContact C-N 3.31Å; Q79-I81 PolarHBondContact O-N 3.27Å; I81-A84 WeakPolarHBondContact O-CB 3.5Å; I81-A84 PolarHBondContact O-N 3.45Å; I81-M85 WeakPolarHBondContact O-CG 3.38Å; I81-M85 PolarHBondContact O-N 3.34Å; I81-L98 HydrophobicContact CG2-CD2 4.36Å; I81-V101 HydrophobicContact CD1-CG1 3.81Å; I81-V101 HydrophobicContact CG1-CG1 4.38Å; I81-V101 HydrophobicContact CG2-CB 4.37Å; I81-V101 HydrophobicContact CG2-CG1 4.01Å; I81-V107 HydrophobicContact CD1-CB 4.29Å; I81-V107 HydrophobicContact CD1-CG1 4.15Å; I81-V107 HydrophobicContact CD1-CG2 4.31Å; I81-I137 HydrophobicContact CG1-CD1 3.86Å; I81-I137 HydrophobicContact CG1-CG1 4.12Å; I81-I137 HydrophobicContact CG1-CG2 3.96Å
82N89.4Confident87.1Confident68 Ų6868.5 Ų68.536%0.36438%0.378SS..Hα-helixtrans-67-42.2176.2-71-68.5000112.7L78 Q79 R80 A84 M85 N86L78-N82 PolarHBondContact O-N 2.83Å; L78-N82 PolarHBondContact O-ND2 2.99Å; Q79-N82 CarbonylContact O-C 3.57Å; Q79-N82 WeakPolarHBondContact O-CA 3.25Å; Q79-N82 WeakPolarHBondContact O-CB 3.39Å; Q79-N82 PolarHBondContact O-N 2.79Å; Q79-N82 VanDerWaalsContact O-N 3.07Å; R80-N82 VanDerWaalsContact C-N 3.28Å; R80-N82 PolarHBondContact O-N 2.87Å; N82-A84 VanDerWaalsContact C-N 3.3Å; N82-A84 PolarHBondContact O-N 3.23Å; N82-M85 HydrophobicContact CB-CE 4.4Å; N82-M85 WeakPolarHBondContact O-CB 3.48Å; N82-M85 PolarHBondContact O-N 3.07Å; N82-M85 VanDerWaalsContact O-N 3.13Å; N82-M85 VanDerWaalsContact OD1-CE 3.25Å; N82-M85 WeakPolarHBondContact OD1-CE 3.41Å; N82-N86 PolarHBondContact O-N 2.99Å; N82-N86 PolarHBondContact O-ND2 3.41Å
83E89.4Confident87.1Confident91 Ų9174.6 Ų74.643%0.42540%0.4SS..Hα-helixtrans-62-38.4175.3-71.5167.5-171.900111.9Q79 R80 M85 N86 K87Q79-E83 WeakPolarHBondContact CG-OE1 3.23Å; Q79-E83 PolarHBondContact NE2-OE1 2.81Å; Q79-E83 WeakPolarHBondContact O-CG 3.31Å; Q79-E83 PolarHBondContact O-N 2.76Å; R80-E83 PolarHBondContact O-N 2.86Å; E83-M85 VanDerWaalsContact C-N 3.26Å; E83-M85 PolarHBondContact O-N 2.74Å; E83-N86 PolarHBondContact O-N 2.92Å; E83-N86 VanDerWaalsContact O-N 3.13Å; E83-K87 PolarHBondContact O-N 2.98Å
84A88.3Confident87.1Confident4 Ų469.2 Ų69.23%0.03338%0.377CS..Hα-helixtrans-61-31.8174.100000113.1R80 I81 N82 N86 L98 I136R80-A84 VanDerWaalsContact O-CB 3.29Å; R80-A84 WeakPolarHBondContact O-CB 3.3Å; R80-A84 PolarHBondContact O-N 3.4Å; I81-A84 WeakPolarHBondContact O-CB 3.5Å; I81-A84 PolarHBondContact O-N 3.45Å; N82-A84 VanDerWaalsContact C-N 3.3Å; N82-A84 PolarHBondContact O-N 3.23Å; A84-N86 VanDerWaalsContact C-N 3.35Å; A84-L98 HydrophobicContact CB-CD1 4.15Å; A84-L98 HydrophobicContact CB-CD2 4.39Å; A84-I136 HydrophobicContact CB-CG2 3.6Å
85M85Confident87.2Confident42 Ų4273.4 Ų73.421%0.20739%0.392CS..Hα-helixtrans-68.5-34.9174.7-64-165.2-60.400112.4I81 N82 E83 K87 L98I81-M85 WeakPolarHBondContact O-CG 3.38Å; I81-M85 PolarHBondContact O-N 3.34Å; N82-M85 HydrophobicContact CB-CE 4.4Å; N82-M85 WeakPolarHBondContact O-CB 3.48Å; N82-M85 PolarHBondContact O-N 3.07Å; N82-M85 VanDerWaalsContact O-N 3.13Å; N82-M85 VanDerWaalsContact OD1-CE 3.25Å; N82-M85 WeakPolarHBondContact OD1-CE 3.41Å; E83-M85 VanDerWaalsContact C-N 3.26Å; E83-M85 PolarHBondContact O-N 2.74Å; M85-K87 VanDerWaalsContact C-N 3.31Å; M85-L98 HydrophobicContact CG-CB 3.63Å; M85-L98 HydrophobicContact CG-CD1 4.41Å; M85-L98 HydrophobicContact SD-CB 4.23Å
86N83.2Confident87.3Confident134 Ų13471.4 Ų71.472%0.71739%0.386SS*.Hα-helixtrans-83.9-6.2-176.7-64.9-35.1000113.3N82 E83 A84 P88N82-N86 PolarHBondContact O-N 2.99Å; N82-N86 PolarHBondContact O-ND2 3.41Å; E83-N86 PolarHBondContact O-N 2.92Å; E83-N86 VanDerWaalsContact O-N 3.13Å; A84-N86 VanDerWaalsContact C-N 3.35Å; N86-P88 WeakPolarHBondContact O-CD 3.29Å
87K82.3Confident87.4Confident126 Ų12667.8 Ų67.855%0.54837%0.37SS..SBendtrans-71.9122.5-178.8-167.6173.9-177.1176.70110.7E83 M85 G89 V90E83-K87 PolarHBondContact O-N 2.98Å; M85-K87 VanDerWaalsContact C-N 3.31Å; K87-G89 PolarHBondContact O-N 2.76Å; K87-V90 HydrophobicContact CB-CG2 4.24Å
88P74.9Confident87.4Confident122 Ų12267.5 Ų67.579%0.79237%0.369SS*.THydrogen-bonded Turntrans-67132175.127.3-32.6000109.7N86N86-P88 WeakPolarHBondContact O-CD 3.29Å
89G80.9Confident87.4Confident85 Ų8573.7 Ų73.788%0.87639%0.391SS*.THydrogen-bonded Turntrans108.41-179.900000115.9K87K87-G89 PolarHBondContact O-N 2.76Å
90V83Confident87.4Confident18 Ų1871.8 Ų71.811%0.10938%0.382CS..  trans-82.2131.3173-175.70000110.5K87 L94 R95 L98 I136K87-V90 HydrophobicContact CB-CG2 4.24Å; V90-L94 HydrophobicContact CG1-CB 3.53Å; V90-L94 HydrophobicContact CG1-CD1 4.34Å; V90-R95 HydrophobicContact CB-CG 3.92Å; V90-R95 HydrophobicContact CG1-CG 3.76Å; V90-R95 PolarHBondContact O-NE 3.1Å; V90-L98 HydrophobicContact CG1-CD1 4.33Å; V90-I136 HydrophobicContact CG1-CD1 4Å; V90-I136 HydrophobicContact CG2-CD1 4.42Å
91S86.3Confident87.5Confident58 Ų5869.3 Ų69.341%0.40637%0.372SS..  trans-59.4150.8-179.684.10000111.8K93 L94 R95S91-K93 VanDerWaalsContact C-N 3.27Å; S91-K93 PolarHBondContact O-N 3.35Å; S91-L94 PolarHBondContact O-N 2.73Å; S91-L94 VanDerWaalsContact O-N 3.1Å; S91-L94 WeakPolarHBondContact OG-CB 3.45Å; S91-L94 VanDerWaalsContact OG-CD1 3.25Å; S91-L94 WeakPolarHBondContact OG-CD1 3.45Å; S91-L94 WeakPolarHBondContact OG-CG 3.49Å; S91-L94 PolarHBondContact OG-N 2.99Å; S91-R95 PolarHBondContact O-N 2.99Å
92A88.3Confident87.4Confident66 Ų6671.1 Ų71.155%0.54539%0.385SS..Hα-helixtrans-58.7-38.2-177.500000112.9R95 D96A92-R95 PolarHBondContact O-N 3.41Å; A92-D96 PolarHBondContact O-N 3.31Å; A92-D96 VanDerWaalsContact O-N 3.09Å
93K88.1Confident87.5Confident173 Ų17371 Ų7175%0.75240%0.4SS*.Hα-helixtrans-65.5-40.6176.2-66-179.1-178.7175.50111.9S91 D96 V97S91-K93 VanDerWaalsContact C-N 3.27Å; S91-K93 PolarHBondContact O-N 3.35Å; K93-D96 PolarHBondContact O-N 3.2Å; K93-V97 WeakPolarHBondContact O-CG2 3.4Å; K93-V97 PolarHBondContact O-N 3.14Å
94L88.8Confident87.6Confident14 Ų1471.4 Ų71.47%0.07340%0.398CS..Hα-helixtrans-68.9-37.3178.1-69.6168.3000111.7V90 S91 V97 L98 V129 E132 V133 I136V90-L94 HydrophobicContact CG1-CB 3.53Å; V90-L94 HydrophobicContact CG1-CD1 4.34Å; S91-L94 PolarHBondContact O-N 2.73Å; S91-L94 VanDerWaalsContact O-N 3.1Å; S91-L94 WeakPolarHBondContact OG-CB 3.45Å; S91-L94 VanDerWaalsContact OG-CD1 3.25Å; S91-L94 WeakPolarHBondContact OG-CD1 3.45Å; S91-L94 WeakPolarHBondContact OG-CG 3.49Å; S91-L94 PolarHBondContact OG-N 2.99Å; L94-V97 PolarHBondContact O-N 2.79Å; L94-L98 WeakPolarHBondContact O-CG 3.44Å; L94-L98 PolarHBondContact O-N 3.05Å; L94-V129 HydrophobicContact CD2-CG1 4.08Å; L94-E132 HydrophobicContact CD1-CB 4.38Å; L94-E132 HydrophobicContact CD2-CB 3.84Å; L94-V133 HydrophobicContact CD2-CG2 3.49Å; L94-V133 VanDerWaalsContact CD2-CG2 3.49Å; L94-I136 HydrophobicContact CD1-CD1 3.92Å
95R90.4Very high87.6Confident117 Ų11778.7 Ų78.744%0.44243%0.432SS..Hα-helixtrans-63.3-40.9173.9-74.4-172.3-71.6107.1-5.6112.4V90 S91 A92 L98 Y99V90-R95 HydrophobicContact CB-CG 3.92Å; V90-R95 HydrophobicContact CG1-CG 3.76Å; V90-R95 PolarHBondContact O-NE 3.1Å; S91-R95 PolarHBondContact O-N 2.99Å; A92-R95 PolarHBondContact O-N 3.41Å; R95-L98 PolarHBondContact O-N 2.87Å; R95-Y99 PolarHBondContact O-N 3.14Å
96D91.3Very high87.8Confident89 Ų8982.9 Ų82.948%0.47646%0.455SS..Hα-helixtrans-61.1-44.6175.5-17556.2000111.7A92 K93 L98 Y99 Q100A92-D96 PolarHBondContact O-N 3.31Å; A92-D96 VanDerWaalsContact O-N 3.09Å; K93-D96 PolarHBondContact O-N 3.2Å; D96-L98 PolarHBondContact O-N 3.35Å; D96-Y99 WeakPolarHBondContact O-CB 3.32Å; D96-Y99 PolarHBondContact O-N 3.04Å; D96-Q100 WeakPolarHBondContact O-CG 3.45Å; D96-Q100 PolarHBondContact O-N 2.94Å; D96-Q100 PolarHBondContact OD2-NE2 3.43Å
97V91.9Very high88.2Confident13 Ų1376.5 Ų76.58%0.07942%0.421CS..Hα-helixtrans-62.7-44175.1177.70000111.5K93 L94 Y99 Q100 V101 L122 I124 V129 V133K93-V97 WeakPolarHBondContact O-CG2 3.4Å; K93-V97 PolarHBondContact O-N 3.14Å; L94-V97 PolarHBondContact O-N 2.79Å; V97-Y99 VanDerWaalsContact C-N 3.28Å; V97-Y99 PolarHBondContact O-N 3.21Å; V97-Q100 WeakPolarHBondContact O-CB 3.45Å; V97-Q100 PolarHBondContact O-N 2.8Å; V97-Q100 VanDerWaalsContact O-N 3.15Å; V97-V101 HydrophobicContact CG1-CG2 4.31Å; V97-V101 VanDerWaalsContact O-CG2 3.25Å; V97-V101 WeakPolarHBondContact O-CG2 3.48Å; V97-V101 PolarHBondContact O-N 3.38Å; V97-L122 HydrophobicContact CG1-CD1 4.41Å; V97-I124 HydrophobicContact CB-CD1 4.21Å; V97-I124 HydrophobicContact CG1-CD1 3.58Å; V97-I124 HydrophobicContact CG2-CD1 3.64Å; V97-V129 HydrophobicContact CG2-CG1 4.26Å; V97-V133 HydrophobicContact CB-CG2 4.22Å; V97-V133 HydrophobicContact CG1-CG1 4.45Å; V97-V133 HydrophobicContact CG1-CG2 3.89Å
98L91.5Very high88.7Confident0 Ų072 Ų720%040%0.404CS..Hα-helixtrans-62.1-36.2177.3-72.9167.2000112.3I81 A84 M85 V90 L94 R95 D96 V101 S102 V133 I137I81-L98 HydrophobicContact CG2-CD2 4.36Å; A84-L98 HydrophobicContact CB-CD1 4.15Å; A84-L98 HydrophobicContact CB-CD2 4.39Å; M85-L98 HydrophobicContact CG-CB 3.63Å; M85-L98 HydrophobicContact CG-CD1 4.41Å; M85-L98 HydrophobicContact SD-CB 4.23Å; V90-L98 HydrophobicContact CG1-CD1 4.33Å; L94-L98 WeakPolarHBondContact O-CG 3.44Å; L94-L98 PolarHBondContact O-N 3.05Å; R95-L98 PolarHBondContact O-N 2.87Å; D96-L98 PolarHBondContact O-N 3.35Å; L98-V101 PolarHBondContact O-N 2.93Å; L98-S102 PolarHBondContact O-N 3.12Å; L98-V133 HydrophobicContact CD2-CG1 3.88Å; L98-V133 HydrophobicContact CG-CG1 4.47Å; L98-I137 HydrophobicContact CD2-CD1 3.95Å; L98-I137 HydrophobicContact CD2-CG1 3.94Å
99Y90.8Very high89.5Confident163 Ų16371.5 Ų71.564%0.63939%0.387SS*.Hα-helixtrans-64.1-41173.4-177.4-98000111.9R95 D96 V97 V101 S102R95-Y99 PolarHBondContact O-N 3.14Å; D96-Y99 WeakPolarHBondContact O-CB 3.32Å; D96-Y99 PolarHBondContact O-N 3.04Å; V97-Y99 VanDerWaalsContact C-N 3.28Å; V97-Y99 PolarHBondContact O-N 3.21Å; Y99-V101 VanDerWaalsContact C-N 3.32Å; Y99-V101 PolarHBondContact O-N 2.92Å; Y99-S102 PolarHBondContact O-N 2.92Å; Y99-S102 PolarHBondContact O-OG 3.38Å
100Q91.1Very high90Very high72 Ų7274.8 Ų74.834%0.33638%0.377SS..Hα-helixtrans-64.9-38.2173.4-65.6172.54.200111.9D96 V97 G103 Y104 L122D96-Q100 WeakPolarHBondContact O-CG 3.45Å; D96-Q100 PolarHBondContact O-N 2.94Å; D96-Q100 PolarHBondContact OD2-NE2 3.43Å; V97-Q100 WeakPolarHBondContact O-CB 3.45Å; V97-Q100 PolarHBondContact O-N 2.8Å; V97-Q100 VanDerWaalsContact O-N 3.15Å; Q100-G103 PolarHBondContact O-N 3.16Å; Q100-Y104 VanDerWaalsContact O-CD2 3.22Å; Q100-Y104 WeakPolarHBondContact O-CD2 3.42Å; Q100-Y104 WeakPolarHBondContact O-CE2 3.43Å; Q100-L122 HydrophobicContact CB-CD1 4.47Å; Q100-L122 HydrophobicContact CB-CD2 3.91Å
101V91.1Very high90.4Very high0 Ų077.2 Ų77.20%039%0.386CS..Hα-helixtrans-65.2-39.2178.1175.60000111.5I81 V97 L98 Y99 G103 Y104 V107 F114 W117 L122I81-V101 HydrophobicContact CD1-CG1 3.81Å; I81-V101 HydrophobicContact CG1-CG1 4.38Å; I81-V101 HydrophobicContact CG2-CB 4.37Å; I81-V101 HydrophobicContact CG2-CG1 4.01Å; V97-V101 HydrophobicContact CG1-CG2 4.31Å; V97-V101 VanDerWaalsContact O-CG2 3.25Å; V97-V101 WeakPolarHBondContact O-CG2 3.48Å; V97-V101 PolarHBondContact O-N 3.38Å; L98-V101 PolarHBondContact O-N 2.93Å; Y99-V101 VanDerWaalsContact C-N 3.32Å; Y99-V101 PolarHBondContact O-N 2.92Å; V101-G103 PolarHBondContact O-N 3.33Å; V101-Y104 PolarHBondContact O-N 3.15Å; V101-Y104 VanDerWaalsContact O-N 3.14Å; V101-V107 HydrophobicContact CG1-CG1 4.01Å; V101-V107 HydrophobicContact CG1-CG2 3.83Å; V101-F114 HydrophobicContact CG1-CE2 4.35Å; V101-F114 HydrophobicContact CG2-CZ 4.48Å; V101-W117 HydrophobicContact CB-CH2 4.33Å; V101-W117 HydrophobicContact CG1-CH2 4.01Å; V101-W117 HydrophobicContact CG1-CZ3 4.2Å; V101-W117 HydrophobicContact CG2-CH2 4.11Å; V101-W117 HydrophobicContact CG2-CZ3 4.02Å; V101-L122 HydrophobicContact CG2-CD1 3.61Å
102S90.1Very high90.7Very high39 Ų3977.4 Ų77.427%0.27339%0.391SS..Hα-helixtrans-66.8-20.9-178.571.30000113.5L98 Y99 Y104L98-S102 PolarHBondContact O-N 3.12Å; Y99-S102 PolarHBondContact O-N 2.92Å; Y99-S102 PolarHBondContact O-OG 3.38Å; S102-Y104 PolarHBondContact O-N 3.08Å
103G90.4Very high91Very high65 Ų6580.5 Ų80.567%0.6739%0.392SS*.THydrogen-bonded Turntrans-67.8-10.5172.400000114.8Q100 V101Q100-G103 PolarHBondContact O-N 3.16Å; V101-G103 PolarHBondContact O-N 3.33Å
104Y91.4Very high91.3Very high99 Ų9972.3 Ų72.339%0.38836%0.356SS..  trans-109.4129.1179.2-63.1-90.8000111.7L78 Q100 V101 S102 V107 W117 L122L78-Y104 WeakPolarHBondContact CD2-O 3.31Å; Q100-Y104 VanDerWaalsContact O-CD2 3.22Å; Q100-Y104 WeakPolarHBondContact O-CD2 3.42Å; Q100-Y104 WeakPolarHBondContact O-CE2 3.43Å; V101-Y104 PolarHBondContact O-N 3.15Å; V101-Y104 VanDerWaalsContact O-N 3.14Å; S102-Y104 PolarHBondContact O-N 3.08Å; Y104-V107 WeakPolarHBondContact O-CG2 3.42Å; Y104-W117 HydrophobicContact CD1-CZ2 4.27Å; Y104-W117 HydrophobicContact CD2-CH2 4.07Å; Y104-W117 AromaticContact CD2-CZ2 3.74Å; Y104-W117 HydrophobicContact CD2-CZ2 3.74Å; Y104-W117 HydrophobicContact CE2-CZ2 4.36Å; Y104-W117 HydrophobicContact CG-CH2 4.41Å; Y104-W117 AromaticContact CG-CZ2 3.69Å; Y104-W117 HydrophobicContact CG-CZ2 3.69Å; Y104-L122 HydrophobicContact CD2-CD2 4.3Å; Y104-L122 HydrophobicContact CE2-CD2 3.48Å; Y104-L122 VanDerWaalsContact CE2-CD2 3.48Å
105E88.6Confident91.5Very high157 Ų15772.7 Ų72.773%0.73436%0.358SS*.SBendtrans-76.7-29.4176.6-61.4-176.2166.500113Q74Q74-E105 PolarHBondContact NE2-O 2.68Å
106N89.7Confident91.7Very high131 Ų13171.3 Ų71.370%0.70136%0.359SS*.  trans-107.257.6-173.1-168.410.3000112.9
107V91.6Very high91.9Very high0 Ų068.7 Ų68.70%034%0.343CS..  trans-77.1129.7176.3-177.70000110.6Q74 L78 I81 V101 Y104 F114 W117Q74-V107 PolarHBondContact NE2-O 3.43Å; L78-V107 HydrophobicContact CD2-CG2 4.1Å; I81-V107 HydrophobicContact CD1-CB 4.29Å; I81-V107 HydrophobicContact CD1-CG1 4.15Å; I81-V107 HydrophobicContact CD1-CG2 4.31Å; V101-V107 HydrophobicContact CG1-CG1 4.01Å; V101-V107 HydrophobicContact CG1-CG2 3.83Å; Y104-V107 WeakPolarHBondContact O-CG2 3.42Å; V107-F114 HydrophobicContact CG1-CD2 3.63Å; V107-F114 HydrophobicContact CG1-CE2 3.48Å; V107-F114 VanDerWaalsContact CG1-CE2 3.48Å; V107-W117 HydrophobicContact CG1-CE3 4.37Å; V107-W117 HydrophobicContact CG1-CH2 4.19Å; V107-W117 HydrophobicContact CG1-CZ3 4.02Å; V107-W117 HydrophobicContact CG2-CH2 3.91Å; V107-W117 HydrophobicContact CG2-CZ2 4.04Å
108P92.9Very high92Very high30 Ų3068.1 Ų68.120%0.19534%0.339CS..  trans-66.2135.9178.5-23.234.5000113.9K113 F114 W117P108-K113 HydrophobicContact CB-CB 3.95Å; P108-F114 HydrophobicContact CB-CB 4.5Å; P108-W117 HydrophobicContact CG-CB 3.63Å; P108-W117 HydrophobicContact CG-CD2 4.32Å; P108-W117 HydrophobicContact CG-CG 3.71Å
109R91.3Very high92.1Very high112 Ų11272.5 Ų72.542%0.42336%0.356SS..SBendtrans-92.113.6-179.9-57.5-177.1-65.8-128.5-4.1115.4G70 W77 W134G70-R109 PolarHBondContact O-NH1 2.9Å; W77-R109 HydrophobicContact CB-CG 4.17Å; W77-R109 HydrophobicContact CD2-CG 3.94Å; W77-R109 HydrophobicContact CG-CG 3.75Å; R109-W134 VanDerWaalsContact C-CH2 3.44Å; R109-W134 WeakPolarHBondContact O-CH2 3.5Å
110K90.8Very high92.2Very high154 Ų15469.3 Ų69.367%0.6736%0.357SS*.SBendtrans-123.7127.6179.1-68.1-176.7-180-178.90108.5A112 K113 F114K110-A112 PolarHBondContact O-N 2.9Å; K110-K113 HydrophobicContact CB-CB 4.22Å; K110-K113 HydrophobicContact CB-CG 4.21Å; K110-K113 CarbonylContact O-C 3.6Å; K110-K113 WeakPolarHBondContact O-CA 3.49Å; K110-K113 WeakPolarHBondContact O-CB 3.49Å; K110-K113 PolarHBondContact O-N 3.26Å; K110-F114 WeakPolarHBondContact O-CB 3.18Å; K110-F114 PolarHBondContact O-N 3.21Å
111K92Very high92.2Very high70 Ų7067.9 Ų67.930%0.30436%0.355SS..Hα-helixtrans-41.3-60.3-175.8-169.2166.5-173.5157.10114.2K113 F114 Q115 E131 W134 D135K111-K113 VanDerWaalsContact C-N 3.29Å; K111-K113 PolarHBondContact O-N 3.19Å; K111-F114 WeakPolarHBondContact O-CB 3.47Å; K111-F114 PolarHBondContact O-N 2.75Å; K111-F114 VanDerWaalsContact O-N 3.13Å; K111-Q115 WeakPolarHBondContact O-CG 3.41Å; K111-Q115 PolarHBondContact O-N 2.97Å; K111-E131 VanDerWaalsContact CE-OE1 3.24Å; K111-E131 WeakPolarHBondContact CE-OE1 3.22Å; K111-E131 WeakPolarHBondContact CE-OE2 3.27Å; K111-E131 IonicContact NZ-OE1 2.99Å; K111-E131 IonicContact NZ-OE2 2.68Å; K111-E131 PolarHBondContact NZ-OE2 3.28Å; K111-W134 HydrophobicContact CB-CD2 3.97Å; K111-W134 HydrophobicContact CB-CG 4.4Å; K111-W134 HydrophobicContact CB-CH2 4.44Å; K111-W134 HydrophobicContact CB-CZ2 3.78Å; K111-W134 HydrophobicContact CD-CG 4.23Å; K111-W134 HydrophobicContact CG-CD2 3.98Å; K111-W134 HydrophobicContact CG-CG 3.89Å; K111-W134 VanDerWaalsContact N-CH2 3.25Å; K111-W134 VanDerWaalsContact N-CZ2 3.32Å; K111-D135 IonicContact NZ-OD1 2.99Å; K111-D135 PolarHBondContact NZ-OD1 3.07Å
112A93.2Very high92.1Very high62 Ų6268.9 Ų68.951%0.51236%0.36SS..Hα-helixtrans-61.3-33.9-179.500000113.9K110 N116K110-A112 PolarHBondContact O-N 2.9Å; A112-N116 PolarHBondContact O-N 3.46Å
113K94.4Very high92.1Very high131 Ų13175.5 Ų75.557%0.5738%0.384SS*.Hα-helixtrans-76.4-36.4177.2-63.1-60.8-173.8179.60111.5P108 K110 K111 N116 W117P108-K113 HydrophobicContact CB-CB 3.95Å; K110-K113 HydrophobicContact CB-CB 4.22Å; K110-K113 HydrophobicContact CB-CG 4.21Å; K110-K113 CarbonylContact O-C 3.6Å; K110-K113 WeakPolarHBondContact O-CA 3.49Å; K110-K113 WeakPolarHBondContact O-CB 3.49Å; K110-K113 PolarHBondContact O-N 3.26Å; K111-K113 VanDerWaalsContact C-N 3.29Å; K111-K113 PolarHBondContact O-N 3.19Å; K113-N116 PolarHBondContact O-N 3.39Å; K113-W117 VanDerWaalsContact O-CB 3.24Å; K113-W117 WeakPolarHBondContact O-CB 3.42Å; K113-W117 PolarHBondContact O-N 3.17Å
114F94Very high92Very high0 Ų073.8 Ų73.80%036%0.359CS..Hα-helixtrans-64.1-44174.8-179.8-106.9000111V101 V107 P108 K110 K111 W117 M118 V133 W134 I137V101-F114 HydrophobicContact CG1-CE2 4.35Å; V101-F114 HydrophobicContact CG2-CZ 4.48Å; V107-F114 HydrophobicContact CG1-CD2 3.63Å; V107-F114 HydrophobicContact CG1-CE2 3.48Å; V107-F114 VanDerWaalsContact CG1-CE2 3.48Å; P108-F114 HydrophobicContact CB-CB 4.5Å; K110-F114 WeakPolarHBondContact O-CB 3.18Å; K110-F114 PolarHBondContact O-N 3.21Å; K111-F114 WeakPolarHBondContact O-CB 3.47Å; K111-F114 PolarHBondContact O-N 2.75Å; K111-F114 VanDerWaalsContact O-N 3.13Å; F114-W117 AromaticContact CD2-CE3 3.86Å; F114-W117 HydrophobicContact CD2-CE3 3.86Å; F114-W117 HydrophobicContact CD2-CZ3 4.11Å; F114-W117 AromaticContact CE2-CE3 3.88Å; F114-W117 HydrophobicContact CE2-CE3 3.88Å; F114-W117 AromaticContact CE2-CZ3 3.64Å; F114-W117 HydrophobicContact CE2-CZ3 3.64Å; F114-W117 HydrophobicContact CZ-CZ3 4.41Å; F114-W117 CarbonylContact O-C 3.54Å; F114-W117 PolarHBondContact O-N 3.46Å; F114-M118 HydrophobicContact CD1-CE 3.2Å; F114-M118 HydrophobicContact CD1-CG 4.39Å; F114-M118 HydrophobicContact CD1-SD 3.95Å; F114-M118 HydrophobicContact CE1-CE 3.13Å; F114-M118 HydrophobicContact CE1-CG 4.08Å; F114-M118 HydrophobicContact CE1-SD 3.3Å; F114-M118 WeakPolarHBondContact CE1-SD 3.43Å; F114-M118 HydrophobicContact CE2-CG 4.33Å; F114-M118 HydrophobicContact CE2-SD 4.43Å; F114-M118 HydrophobicContact CG-CE 4.16Å; F114-M118 HydrophobicContact CZ-CE 4Å; F114-M118 HydrophobicContact CZ-CG 4.02Å; F114-M118 HydrophobicContact CZ-SD 3.57Å; F114-M118 VanDerWaalsContact CZ-SD 3.57Å; F114-M118 WeakPolarHBondContact O-CG 3.44Å; F114-M118 PolarHBondContact O-N 2.78Å; F114-V133 HydrophobicContact CE1-CG1 4.11Å; F114-V133 HydrophobicContact CZ-CG1 3.96Å; F114-W134 HydrophobicContact CB-CE3 3.64Å; F114-W134 HydrophobicContact CB-CZ3 3.58Å; F114-W134 HydrophobicContact CD1-CB 4.16Å; F114-W134 HydrophobicContact CD1-CD2 4.21Å; F114-W134 AromaticContact CD1-CE3 3.32Å; F114-W134 HydrophobicContact CD1-CE3 3.32Å; F114-W134 HydrophobicContact CD1-CZ3 4.09Å; F114-W134 HydrophobicContact CD2-CE3 4.34Å; F114-W134 HydrophobicContact CD2-CZ3 4.4Å; F114-W134 HydrophobicContact CE1-CB 4.18Å; F114-W134 HydrophobicContact CE1-CE3 4Å; F114-W134 AromaticContact CG-CE3 3.51Å; F114-W134 HydrophobicContact CG-CE3 3.51Å; F114-W134 AromaticContact CG-CZ3 3.79Å; F114-W134 HydrophobicContact CG-CZ3 3.79Å; F114-I137 HydrophobicContact CZ-CD1 4.03Å
115Q93.4Very high91.8Very high23 Ų2373.2 Ų73.211%0.10737%0.37CS..Hα-helixtrans-60.2-48.1174.6-71.9173.7-11.500112.7K111 W117 M118 R119 Q130 E131K111-Q115 WeakPolarHBondContact O-CG 3.41Å; K111-Q115 PolarHBondContact O-N 2.97Å; Q115-W117 VanDerWaalsContact C-N 3.28Å; Q115-W117 PolarHBondContact O-N 3.44Å; Q115-M118 HydrophobicContact CG-CE 4.18Å; Q115-M118 PolarHBondContact O-N 3.03Å; Q115-R119 WeakPolarHBondContact O-CG 3.2Å; Q115-R119 PolarHBondContact O-N 3.27Å; Q115-Q130 HydrophobicContact CG-CB 4.25Å; Q115-E131 PolarHBondContact NE2-OE1 3.48Å
116N94.6Very high91.9Very high87 Ų8770.3 Ų70.347%0.46536%0.359SS..Hα-helixtrans-62.7-38.3175.9-71.4-9.1000111.9A112 K113 R119 S120A112-N116 PolarHBondContact O-N 3.46Å; K113-N116 PolarHBondContact O-N 3.39Å; N116-R119 PolarHBondContact O-N 3.08Å; N116-R119 PolarHBondContact OD1-NH1 3.11Å; N116-S120 WeakPolarHBondContact O-CB 3.41Å; N116-S120 PolarHBondContact O-N 3.09Å
117W94.9Very high92Very high35 Ų3567.6 Ų67.613%0.13335%0.348CS..Hα-helixtrans-66.9-39.3175.3171.588.4000112.2V101 Y104 V107 P108 K113 F114 Q115 R119 S120 S121 L122V101-W117 HydrophobicContact CB-CH2 4.33Å; V101-W117 HydrophobicContact CG1-CH2 4.01Å; V101-W117 HydrophobicContact CG1-CZ3 4.2Å; V101-W117 HydrophobicContact CG2-CH2 4.11Å; V101-W117 HydrophobicContact CG2-CZ3 4.02Å; Y104-W117 HydrophobicContact CD1-CZ2 4.27Å; Y104-W117 HydrophobicContact CD2-CH2 4.07Å; Y104-W117 AromaticContact CD2-CZ2 3.74Å; Y104-W117 HydrophobicContact CD2-CZ2 3.74Å; Y104-W117 HydrophobicContact CE2-CZ2 4.36Å; Y104-W117 HydrophobicContact CG-CH2 4.41Å; Y104-W117 AromaticContact CG-CZ2 3.69Å; Y104-W117 HydrophobicContact CG-CZ2 3.69Å; V107-W117 HydrophobicContact CG1-CE3 4.37Å; V107-W117 HydrophobicContact CG1-CH2 4.19Å; V107-W117 HydrophobicContact CG1-CZ3 4.02Å; V107-W117 HydrophobicContact CG2-CH2 3.91Å; V107-W117 HydrophobicContact CG2-CZ2 4.04Å; P108-W117 HydrophobicContact CG-CB 3.63Å; P108-W117 HydrophobicContact CG-CD2 4.32Å; P108-W117 HydrophobicContact CG-CG 3.71Å; K113-W117 VanDerWaalsContact O-CB 3.24Å; K113-W117 WeakPolarHBondContact O-CB 3.42Å; K113-W117 PolarHBondContact O-N 3.17Å; F114-W117 AromaticContact CD2-CE3 3.86Å; F114-W117 HydrophobicContact CD2-CE3 3.86Å; F114-W117 HydrophobicContact CD2-CZ3 4.11Å; F114-W117 AromaticContact CE2-CE3 3.88Å; F114-W117 HydrophobicContact CE2-CE3 3.88Å; F114-W117 AromaticContact CE2-CZ3 3.64Å; F114-W117 HydrophobicContact CE2-CZ3 3.64Å; F114-W117 HydrophobicContact CZ-CZ3 4.41Å; F114-W117 CarbonylContact O-C 3.54Å; F114-W117 PolarHBondContact O-N 3.46Å; Q115-W117 VanDerWaalsContact C-N 3.28Å; Q115-W117 PolarHBondContact O-N 3.44Å; W117-R119 VanDerWaalsContact C-N 3.34Å; W117-R119 PolarHBondContact O-N 3Å; W117-S120 PolarHBondContact O-N 3.28Å; W117-S121 PolarHBondContact NE1-OG 2.92Å; W117-S121 WeakPolarHBondContact O-CA 3.44Å; W117-S121 WeakPolarHBondContact O-CB 3.45Å; W117-S121 PolarHBondContact O-N 3.15Å; W117-S121 PolarHBondContact O-OG 2.83Å; W117-S121 VanDerWaalsContact O-OG 3.14Å; W117-L122 HydrophobicContact CH2-CD1 4.13Å; W117-L122 HydrophobicContact CH2-CG 4.32Å; W117-L122 HydrophobicContact CZ3-CD1 4.04Å; W117-L122 HydrophobicContact CZ3-CG 4.45Å
118M94Very high92Very high1 Ų169.2 Ų69.21%0.00536%0.364CS..Hα-helixtrans-64.3-38.8173.6-74.8-172.6-70.100112F114 Q115 L122 K123 I124 Q130F114-M118 HydrophobicContact CD1-CE 3.2Å; F114-M118 HydrophobicContact CD1-CG 4.39Å; F114-M118 HydrophobicContact CD1-SD 3.95Å; F114-M118 HydrophobicContact CE1-CE 3.13Å; F114-M118 HydrophobicContact CE1-CG 4.08Å; F114-M118 HydrophobicContact CE1-SD 3.3Å; F114-M118 WeakPolarHBondContact CE1-SD 3.43Å; F114-M118 HydrophobicContact CE2-CG 4.33Å; F114-M118 HydrophobicContact CE2-SD 4.43Å; F114-M118 HydrophobicContact CG-CE 4.16Å; F114-M118 HydrophobicContact CZ-CE 4Å; F114-M118 HydrophobicContact CZ-CG 4.02Å; F114-M118 HydrophobicContact CZ-SD 3.57Å; F114-M118 VanDerWaalsContact CZ-SD 3.57Å; F114-M118 WeakPolarHBondContact O-CG 3.44Å; F114-M118 PolarHBondContact O-N 2.78Å; Q115-M118 HydrophobicContact CG-CE 4.18Å; Q115-M118 PolarHBondContact O-N 3.03Å; M118-L122 HydrophobicContact CG-CD1 4.21Å; M118-L122 CarbonylContact O-C 3.54Å; M118-L122 WeakPolarHBondContact O-CA 3.36Å; M118-L122 WeakPolarHBondContact O-CB 3.46Å; M118-L122 PolarHBondContact O-N 3.22Å; M118-L122 VanDerWaalsContact O-N 3.14Å; M118-K123 PolarHBondContact O-N 2.96Å; M118-I124 PolarHBondContact O-N 3.39Å; M118-Q130 HydrophobicContact CB-CG 4.38Å; M118-Q130 HydrophobicContact CE-CB 3.34Å; M118-Q130 HydrophobicContact CE-CG 3.51Å; M118-Q130 HydrophobicContact SD-CB 4.34Å; M118-Q130 HydrophobicContact SD-CG 4.15Å
119R93.6Very high91.8Very high92 Ų9269.5 Ų69.535%0.34737%0.365SS..Hα-helixtrans-64.4-39.4174.5-67.8-175.7-161.7113.59112.4Q115 N116 W117 K123 Q130Q115-R119 WeakPolarHBondContact O-CG 3.2Å; Q115-R119 PolarHBondContact O-N 3.27Å; N116-R119 PolarHBondContact O-N 3.08Å; N116-R119 PolarHBondContact OD1-NH1 3.11Å; W117-R119 VanDerWaalsContact C-N 3.34Å; W117-R119 PolarHBondContact O-N 3Å; R119-K123 WeakPolarHBondContact O-CA 3.17Å; R119-Q130 VanDerWaalsContact NH2-OE1 3.1Å
120S93.7Very high91.8Very high95 Ų9564.2 Ų64.266%0.66435%0.345SS*.Hα-helixtrans-84-49-176.2-1720000113N116 W117N116-S120 WeakPolarHBondContact O-CB 3.41Å; N116-S120 PolarHBondContact O-N 3.09Å; W117-S120 PolarHBondContact O-N 3.28Å
121S90.1Very high91.9Very high42 Ų4259.8 Ų59.829%0.29433%0.327SS..Hα-helixtrans-84.7-46.6-171.9-51.90000111.9W117W117-S121 PolarHBondContact NE1-OG 2.92Å; W117-S121 WeakPolarHBondContact O-CA 3.44Å; W117-S121 WeakPolarHBondContact O-CB 3.45Å; W117-S121 PolarHBondContact O-N 3.15Å; W117-S121 PolarHBondContact O-OG 2.83Å; W117-S121 VanDerWaalsContact O-OG 3.14Å
122L88.7Confident91.9Very high22 Ų2261.2 Ų61.212%0.11534%0.335CS..SBendtrans-95.6-8-177.7-57.9-178.2000113.1V97 Q100 V101 Y104 W117 M118 I124V97-L122 HydrophobicContact CG1-CD1 4.41Å; Q100-L122 HydrophobicContact CB-CD1 4.47Å; Q100-L122 HydrophobicContact CB-CD2 3.91Å; V101-L122 HydrophobicContact CG2-CD1 3.61Å; Y104-L122 HydrophobicContact CD2-CD2 4.3Å; Y104-L122 HydrophobicContact CE2-CD2 3.48Å; Y104-L122 VanDerWaalsContact CE2-CD2 3.48Å; W117-L122 HydrophobicContact CH2-CD1 4.13Å; W117-L122 HydrophobicContact CH2-CG 4.32Å; W117-L122 HydrophobicContact CZ3-CD1 4.04Å; W117-L122 HydrophobicContact CZ3-CG 4.45Å; M118-L122 HydrophobicContact CG-CD1 4.21Å; M118-L122 CarbonylContact O-C 3.54Å; M118-L122 WeakPolarHBondContact O-CA 3.36Å; M118-L122 WeakPolarHBondContact O-CB 3.46Å; M118-L122 PolarHBondContact O-N 3.22Å; M118-L122 VanDerWaalsContact O-N 3.14Å; L122-I124 HydrophobicContact CB-CD1 3.74Å; L122-I124 HydrophobicContact CB-CG1 3.94Å; L122-I124 HydrophobicContact CD1-CD1 4.03Å; L122-I124 PolarHBondContact O-N 3.4Å; L122-I124 VanDerWaalsContact O-N 3.11Å
123K90.9Very high91.8Very high178 Ų17858.3 Ų58.377%0.77431%0.311SS*.  trans55.524.2-175.3-58178-179.4174.30113.7M118 R119 S125M118-K123 PolarHBondContact O-N 2.96Å; R119-K123 WeakPolarHBondContact O-CA 3.17Å; K123-S125 PolarHBondContact O-N 3.31Å
124I88Confident91.8Very high29 Ų2953.4 Ų53.415%0.14929%0.289CS..  trans-89.1108.7176.3-60.9165.8000107.4V97 M118 L122 Q130V97-I124 HydrophobicContact CB-CD1 4.21Å; V97-I124 HydrophobicContact CG1-CD1 3.58Å; V97-I124 HydrophobicContact CG2-CD1 3.64Å; M118-I124 PolarHBondContact O-N 3.39Å; L122-I124 HydrophobicContact CB-CD1 3.74Å; L122-I124 HydrophobicContact CB-CG1 3.94Å; L122-I124 HydrophobicContact CD1-CD1 4.03Å; L122-I124 PolarHBondContact O-N 3.4Å; L122-I124 VanDerWaalsContact O-N 3.11Å; I124-Q130 PolarHBondContact O-NE2 3.16Å
125S87.9Confident91.6Very high86 Ų8657.2 Ų57.260%0.60131%0.309SS*.  trans-95.4-10.1-178.9-63.90000114.2K123 T127K123-S125 PolarHBondContact O-N 3.31Å; S125-T127 PolarHBondContact O-N 2.88Å; S125-T127 VanDerWaalsContact O-N 3.09Å
126N90.1Very high91.5Very high97 Ų9757.9 Ų57.952%0.51931%0.313SS..  trans-70.6106.4-177.4-171.5-49.8000110.9G128 V129 Q130N126-G128 VanDerWaalsContact C-N 3.27Å; N126-G128 PolarHBondContact O-N 2.94Å; N126-G128 PolarHBondContact OD1-N 2.78Å; N126-V129 HydrophobicContact CB-CB 4.23Å; N126-V129 HydrophobicContact CB-CG2 4.08Å; N126-V129 PolarHBondContact O-N 2.73Å; N126-V129 PolarHBondContact OD1-N 3.22Å; N126-Q130 VanDerWaalsContact O-CG 3.22Å; N126-Q130 WeakPolarHBondContact O-CG 3.4Å; N126-Q130 PolarHBondContact O-N 3.09Å; N126-Q130 VanDerWaalsContact O-N 3.09Å
127T91.2Very high91.2Very high74 Ų7453.8 Ų53.845%0.45429%0.291SS..Hα-helixtrans-59.8-33.9-177.9-48.70000112.9S125 Q130 E131S125-T127 PolarHBondContact O-N 2.88Å; S125-T127 VanDerWaalsContact O-N 3.09Å; T127-Q130 WeakPolarHBondContact O-CB 3.28Å; T127-Q130 PolarHBondContact O-N 3.4Å; T127-E131 HydrophobicContact CG2-CG 4.39Å; T127-E131 WeakPolarHBondContact O-CB 3.29Å; T127-E131 WeakPolarHBondContact O-CG 3.43Å; T127-E131 PolarHBondContact O-N 2.9Å
128G91.4Very high90.9Very high34 Ų3453.3 Ų53.335%0.35130%0.295SS..Hα-helixtrans-65.1-48.917800000112.1N126 Q130 E131 E132N126-G128 VanDerWaalsContact C-N 3.27Å; N126-G128 PolarHBondContact O-N 2.94Å; N126-G128 PolarHBondContact OD1-N 2.78Å; G128-Q130 VanDerWaalsContact C-N 3.29Å; G128-Q130 PolarHBondContact O-N 3.11Å; G128-E131 WeakPolarHBondContact O-CB 3.46Å; G128-E131 PolarHBondContact O-N 2.89Å; G128-E131 VanDerWaalsContact O-N 3.16Å; G128-E132 WeakPolarHBondContact O-CG 3.4Å; G128-E132 PolarHBondContact O-N 3.07Å
129V90.5Very high90.4Very high36 Ų3655.7 Ų55.722%0.21832%0.315CS..Hα-helixtrans-61.3-39.4176.3178.20000111.2L94 V97 N126 E131 E132 V133L94-V129 HydrophobicContact CD2-CG1 4.08Å; V97-V129 HydrophobicContact CG2-CG1 4.26Å; N126-V129 HydrophobicContact CB-CB 4.23Å; N126-V129 HydrophobicContact CB-CG2 4.08Å; N126-V129 PolarHBondContact O-N 2.73Å; N126-V129 PolarHBondContact OD1-N 3.22Å; V129-E131 VanDerWaalsContact C-N 3.34Å; V129-E131 PolarHBondContact O-N 3.04Å; V129-E132 PolarHBondContact O-N 2.81Å; V129-V133 HydrophobicContact CG1-CG2 4.29Å; V129-V133 WeakPolarHBondContact O-CB 3.41Å; V129-V133 VanDerWaalsContact O-CG2 3.23Å; V129-V133 WeakPolarHBondContact O-CG2 3.26Å; V129-V133 PolarHBondContact O-N 3.05Å
130Q90.9Very high89.5Confident0 Ų052.7 Ų52.70%031%0.31CS..Hα-helixtrans-61.9-40.7176.5-68.4173.311.300112.8Q115 M118 R119 I124 N126 T127 G128 W134Q115-Q130 HydrophobicContact CG-CB 4.25Å; M118-Q130 HydrophobicContact CB-CG 4.38Å; M118-Q130 HydrophobicContact CE-CB 3.34Å; M118-Q130 HydrophobicContact CE-CG 3.51Å; M118-Q130 HydrophobicContact SD-CB 4.34Å; M118-Q130 HydrophobicContact SD-CG 4.15Å; R119-Q130 VanDerWaalsContact NH2-OE1 3.1Å; I124-Q130 PolarHBondContact O-NE2 3.16Å; N126-Q130 VanDerWaalsContact O-CG 3.22Å; N126-Q130 WeakPolarHBondContact O-CG 3.4Å; N126-Q130 PolarHBondContact O-N 3.09Å; N126-Q130 VanDerWaalsContact O-N 3.09Å; T127-Q130 WeakPolarHBondContact O-CB 3.28Å; T127-Q130 PolarHBondContact O-N 3.4Å; G128-Q130 VanDerWaalsContact C-N 3.29Å; G128-Q130 PolarHBondContact O-N 3.11Å; Q130-W134 WeakPolarHBondContact O-CB 3.15Å; Q130-W134 PolarHBondContact O-N 2.76Å; Q130-W134 VanDerWaalsContact O-N 3.15Å
131E92.9Very high88.4Confident62 Ų6252.1 Ų52.129%0.2930%0.299SS..Hα-helixtrans-68.1-48.4177.2-71.8-80.4155.800110.7K111 Q115 T127 G128 V129 V133 W134 D135K111-E131 VanDerWaalsContact CE-OE1 3.24Å; K111-E131 WeakPolarHBondContact CE-OE1 3.22Å; K111-E131 WeakPolarHBondContact CE-OE2 3.27Å; K111-E131 IonicContact NZ-OE1 2.99Å; K111-E131 IonicContact NZ-OE2 2.68Å; K111-E131 PolarHBondContact NZ-OE2 3.28Å; Q115-E131 PolarHBondContact NE2-OE1 3.48Å; T127-E131 HydrophobicContact CG2-CG 4.39Å; T127-E131 WeakPolarHBondContact O-CB 3.29Å; T127-E131 WeakPolarHBondContact O-CG 3.43Å; T127-E131 PolarHBondContact O-N 2.9Å; G128-E131 WeakPolarHBondContact O-CB 3.46Å; G128-E131 PolarHBondContact O-N 2.89Å; G128-E131 VanDerWaalsContact O-N 3.16Å; V129-E131 VanDerWaalsContact C-N 3.34Å; V129-E131 PolarHBondContact O-N 3.04Å; E131-V133 PolarHBondContact O-N 3.31Å; E131-W134 WeakPolarHBondContact O-CB 3.18Å; E131-W134 PolarHBondContact O-N 2.98Å; E131-D135 WeakPolarHBondContact O-CB 3.39Å; E131-D135 VanDerWaalsContact O-CG 3.29Å; E131-D135 PolarHBondContact O-N 2.77Å
132E91.6Very high87Confident100 Ų10055.1 Ų55.147%0.46732%0.32SS..Hα-helixtrans-58.6-47.3177.8-72.6172.1-15500112.3L94 G128 V129 W134 D135 I136L94-E132 HydrophobicContact CD1-CB 4.38Å; L94-E132 HydrophobicContact CD2-CB 3.84Å; G128-E132 WeakPolarHBondContact O-CG 3.4Å; G128-E132 PolarHBondContact O-N 3.07Å; V129-E132 PolarHBondContact O-N 2.81Å; E132-W134 VanDerWaalsContact C-N 3.33Å; E132-W134 PolarHBondContact O-N 3.13Å; E132-D135 PolarHBondContact O-N 3.26Å; E132-I136 VanDerWaalsContact O-CG1 3.26Å; E132-I136 WeakPolarHBondContact O-CG1 3.5Å; E132-I136 PolarHBondContact O-N 2.83Å
133V91.8Very high85.1Confident0 Ų057.1 Ų57.10%034%0.339CS..Hα-helixtrans-61.4-43.7176.8172.20000110.8L94 V97 L98 F114 V129 E131 I136 I137L94-V133 HydrophobicContact CD2-CG2 3.49Å; L94-V133 VanDerWaalsContact CD2-CG2 3.49Å; V97-V133 HydrophobicContact CB-CG2 4.22Å; V97-V133 HydrophobicContact CG1-CG1 4.45Å; V97-V133 HydrophobicContact CG1-CG2 3.89Å; L98-V133 HydrophobicContact CD2-CG1 3.88Å; L98-V133 HydrophobicContact CG-CG1 4.47Å; F114-V133 HydrophobicContact CE1-CG1 4.11Å; F114-V133 HydrophobicContact CZ-CG1 3.96Å; V129-V133 HydrophobicContact CG1-CG2 4.29Å; V129-V133 WeakPolarHBondContact O-CB 3.41Å; V129-V133 VanDerWaalsContact O-CG2 3.23Å; V129-V133 WeakPolarHBondContact O-CG2 3.26Å; V129-V133 PolarHBondContact O-N 3.05Å; E131-V133 PolarHBondContact O-N 3.31Å; V133-I136 PolarHBondContact O-N 3.26Å; V133-I137 HydrophobicContact CG1-CD1 3.93Å; V133-I137 WeakPolarHBondContact O-CD1 3.38Å; V133-I137 VanDerWaalsContact O-CG1 3.31Å; V133-I137 WeakPolarHBondContact O-CG1 3.18Å; V133-I137 PolarHBondContact O-N 2.82Å
134W92.6Very high82.8Confident28 Ų2853.8 Ų53.811%0.10634%0.336CS..Hα-helixtrans-62.1-44.9177.7176.2-90.1000111.8W77 R109 K111 F114 Q130 E131 E132 I136 I137 A138W77-W134 HydrophobicContact CH2-CE3 4.15Å; W77-W134 AromaticContact CH2-CH2 3.8Å; W77-W134 HydrophobicContact CH2-CH2 3.8Å; W77-W134 AromaticContact CH2-CZ3 3.57Å; W77-W134 HydrophobicContact CH2-CZ3 3.57Å; W77-W134 HydrophobicContact CZ2-CE3 4.35Å; W77-W134 HydrophobicContact CZ2-CH2 4.29Å; W77-W134 AromaticContact CZ2-CZ3 3.71Å; W77-W134 HydrophobicContact CZ2-CZ3 3.71Å; R109-W134 VanDerWaalsContact C-CH2 3.44Å; R109-W134 WeakPolarHBondContact O-CH2 3.5Å; K111-W134 HydrophobicContact CB-CD2 3.97Å; K111-W134 HydrophobicContact CB-CG 4.4Å; K111-W134 HydrophobicContact CB-CH2 4.44Å; K111-W134 HydrophobicContact CB-CZ2 3.78Å; K111-W134 HydrophobicContact CD-CG 4.23Å; K111-W134 HydrophobicContact CG-CD2 3.98Å; K111-W134 HydrophobicContact CG-CG 3.89Å; K111-W134 VanDerWaalsContact N-CH2 3.25Å; K111-W134 VanDerWaalsContact N-CZ2 3.32Å; F114-W134 HydrophobicContact CB-CE3 3.64Å; F114-W134 HydrophobicContact CB-CZ3 3.58Å; F114-W134 HydrophobicContact CD1-CB 4.16Å; F114-W134 HydrophobicContact CD1-CD2 4.21Å; F114-W134 AromaticContact CD1-CE3 3.32Å; F114-W134 HydrophobicContact CD1-CE3 3.32Å; F114-W134 HydrophobicContact CD1-CZ3 4.09Å; F114-W134 HydrophobicContact CD2-CE3 4.34Å; F114-W134 HydrophobicContact CD2-CZ3 4.4Å; F114-W134 HydrophobicContact CE1-CB 4.18Å; F114-W134 HydrophobicContact CE1-CE3 4Å; F114-W134 AromaticContact CG-CE3 3.51Å; F114-W134 HydrophobicContact CG-CE3 3.51Å; F114-W134 AromaticContact CG-CZ3 3.79Å; F114-W134 HydrophobicContact CG-CZ3 3.79Å; Q130-W134 WeakPolarHBondContact O-CB 3.15Å; Q130-W134 PolarHBondContact O-N 2.76Å; Q130-W134 VanDerWaalsContact O-N 3.15Å; E131-W134 WeakPolarHBondContact O-CB 3.18Å; E131-W134 PolarHBondContact O-N 2.98Å; E132-W134 VanDerWaalsContact C-N 3.33Å; E132-W134 PolarHBondContact O-N 3.13Å; W134-I136 VanDerWaalsContact C-N 3.35Å; W134-I136 PolarHBondContact O-N 3.38Å; W134-I137 PolarHBondContact O-N 3.28Å; W134-A138 VanDerWaalsContact O-CB 3.26Å; W134-A138 WeakPolarHBondContact O-CB 3.45Å; W134-A138 PolarHBondContact O-N 2.88Å
135D91.7Very high80.8Confident80 Ų8058.4 Ų58.443%0.42837%0.368SS..Hα-helixtrans-68.3-34.5-177.3-70-15.9000111.6K111 E131 E132 A138 A139K111-D135 IonicContact NZ-OD1 2.99Å; K111-D135 PolarHBondContact NZ-OD1 3.07Å; E131-D135 WeakPolarHBondContact O-CB 3.39Å; E131-D135 VanDerWaalsContact O-CG 3.29Å; E131-D135 PolarHBondContact O-N 2.77Å; E132-D135 PolarHBondContact O-N 3.26Å; D135-A138 PolarHBondContact O-N 3.01Å; D135-A139 WeakPolarHBondContact O-CB 3.47Å; D135-A139 PolarHBondContact O-N 3.44Å
136I89.7Confident78.3Confident38 Ų3858.7 Ų58.720%0.19538%0.375CS..Hα-helixtrans-60.7-46.9172-69.2165.6000111A84 V90 L94 E132 V133 W134 A140A84-I136 HydrophobicContact CB-CG2 3.6Å; V90-I136 HydrophobicContact CG1-CD1 4Å; V90-I136 HydrophobicContact CG2-CD1 4.42Å; L94-I136 HydrophobicContact CD1-CD1 3.92Å; E132-I136 VanDerWaalsContact O-CG1 3.26Å; E132-I136 WeakPolarHBondContact O-CG1 3.5Å; E132-I136 PolarHBondContact O-N 2.83Å; V133-I136 PolarHBondContact O-N 3.26Å; W134-I136 VanDerWaalsContact C-N 3.35Å; W134-I136 PolarHBondContact O-N 3.38Å; I136-A140 PolarHBondContact O-N 3.33Å
137I89.3Confident75.6Confident0 Ų059.8 Ų59.80%039%0.386CS..Hα-helixtrans-70.8-38.3-179.5-56.1160.1000110.6W77 R80 I81 L98 F114 V133 W134 A140 D141W77-I137 HydrophobicContact CD2-CG2 4.4Å; W77-I137 HydrophobicContact CE3-CG2 4.03Å; W77-I137 HydrophobicContact CH2-CB 4.01Å; W77-I137 HydrophobicContact CH2-CG2 3.27Å; W77-I137 HydrophobicContact CZ2-CB 4.48Å; W77-I137 HydrophobicContact CZ2-CD1 4.48Å; W77-I137 HydrophobicContact CZ2-CG2 3.69Å; W77-I137 HydrophobicContact CZ3-CB 4.5Å; W77-I137 HydrophobicContact CZ3-CG2 3.46Å; W77-I137 VanDerWaalsContact CZ3-CG2 3.46Å; R80-I137 HydrophobicContact CB-CG2 4.31Å; I81-I137 HydrophobicContact CG1-CD1 3.86Å; I81-I137 HydrophobicContact CG1-CG1 4.12Å; I81-I137 HydrophobicContact CG1-CG2 3.96Å; L98-I137 HydrophobicContact CD2-CD1 3.95Å; L98-I137 HydrophobicContact CD2-CG1 3.94Å; F114-I137 HydrophobicContact CZ-CD1 4.03Å; V133-I137 HydrophobicContact CG1-CD1 3.93Å; V133-I137 WeakPolarHBondContact O-CD1 3.38Å; V133-I137 VanDerWaalsContact O-CG1 3.31Å; V133-I137 WeakPolarHBondContact O-CG1 3.18Å; V133-I137 PolarHBondContact O-N 2.82Å; W134-I137 PolarHBondContact O-N 3.28Å; I137-A140 WeakPolarHBondContact O-CB 3.25Å; I137-A140 PolarHBondContact O-N 3.29Å; I137-D141 PolarHBondContact O-N 3.17Å
138A88.3Confident73.3Confident26 Ų2665.2 Ų65.222%0.21541%0.406CS..Hα-helixtrans-71-32.7178.900000112.8W134 D135 A140 D141 S142W134-A138 VanDerWaalsContact O-CB 3.26Å; W134-A138 WeakPolarHBondContact O-CB 3.45Å; W134-A138 PolarHBondContact O-N 2.88Å; D135-A138 PolarHBondContact O-N 3.01Å; A138-A140 PolarHBondContact O-N 3.16Å; A138-D141 WeakPolarHBondContact O-CA 3.34Å; A138-D141 WeakPolarHBondContact O-CB 3.18Å; A138-D141 PolarHBondContact O-N 3.4Å; A138-S142 PolarHBondContact O-N 3.04Å
139A84.3Confident70.3Confident51 Ų5169.4 Ų69.442%0.42143%0.425SS..Hα-helixtrans-61.8-35172.800000111.5D135 D141 S142 A143D135-A139 WeakPolarHBondContact O-CB 3.47Å; D135-A139 PolarHBondContact O-N 3.44Å; A139-D141 VanDerWaalsContact C-N 3.25Å; A139-D141 PolarHBondContact O-N 3.09Å; A139-S142 PolarHBondContact O-N 3.44Å; A139-A143 PolarHBondContact O-N 2.53Å
140A74.1Confident67.4Low29 Ų2974.3 Ų74.324%0.2446%0.455CS..Hα-helixtrans-69.5-18.9172.100000113.4R80 I136 I137 A138R80-A140 HydrophobicContact CB-CB 4.27Å; R80-A140 HydrophobicContact CG-CB 4.37Å; I136-A140 PolarHBondContact O-N 3.33Å; I137-A140 WeakPolarHBondContact O-CB 3.25Å; I137-A140 PolarHBondContact O-N 3.29Å; A138-A140 PolarHBondContact O-N 3.16Å
141D69.6Low64.9Low83 Ų8383.5 Ų83.544%0.44450%0.495SS..Hα-helixtrans-77.6-27.3173.5-157.3-0.8000112.4R80 I137 A138 A139R80-D141 VanDerWaalsContact CZ-CG 3.49Å; R80-D141 IonicContact CZ-OD1 3.09Å; R80-D141 IonicContact CZ-OD2 2.76Å; R80-D141 IonicContact NH1-OD1 3.39Å; R80-D141 PolarHBondContact NH1-OD1 3.4Å; R80-D141 IonicContact NH1-OD2 2.59Å; R80-D141 PolarHBondContact NH1-OD2 3.44Å; R80-D141 IonicContact NH2-OD1 2.78Å; R80-D141 PolarHBondContact NH2-OD1 3.45Å; I137-D141 PolarHBondContact O-N 3.17Å; A138-D141 WeakPolarHBondContact O-CA 3.34Å; A138-D141 WeakPolarHBondContact O-CB 3.18Å; A138-D141 PolarHBondContact O-N 3.4Å; A139-D141 VanDerWaalsContact C-N 3.25Å; A139-D141 PolarHBondContact O-N 3.09Å
142S61.7Low62Low105 Ų10589.6 Ų89.673%0.73452%0.524SS*.Hα-helixtrans-92.1-9.1-177.7-56.40000113.4A138 A139 P144A138-S142 PolarHBondContact O-N 3.04Å; A139-S142 PolarHBondContact O-N 3.44Å; S142-P144 WeakPolarHBondContact O-CD 3.4Å
143A49.2Very low59.2Low63 Ų6390.2 Ų90.252%0.52154%0.539SS..SBendtrans-84.5118.8173.700000109.4A139A139-A143 PolarHBondContact O-N 2.53Å
144P43.1Very low56.3Low108 Ų10894.6 Ų94.670%0.70158%0.575SS**  trans-61.8151.4165.326.8-31.5000109.3S142 A146S142-P144 WeakPolarHBondContact O-CD 3.4Å; P144-A146 PolarHBondContact O-N 3.27Å
145P44.3Very low53.4Low127 Ų127100 Ų10083%0.82561%0.606SS**  trans-60.9105.7171.926.7-32.2000107.6T147P145-T147 PolarHBondContact O-N 3.05Å; P145-T147 VanDerWaalsContact O-N 3.08Å
146A36.3Very low50.5Low91 Ų91104.3 Ų104.375%0.75262%0.621SS**  trans-63.2114.2177.600000108.2P144 Q148P144-A146 PolarHBondContact O-N 3.27Å; A146-Q148 PolarHBondContact O-N 2.77Å
147T32.5Very low47.6Very low121 Ų121111.5 Ų111.574%0.74265%0.654SS**  trans-45.5121.115937.60000109.1P145 T149P145-T147 PolarHBondContact O-N 3.05Å; P145-T147 VanDerWaalsContact O-N 3.08Å; T147-T149 PolarHBondContact O-N 2.75Å
148Q42.7Very low44.8Very low188 Ų188116 Ų11688%0.87969%0.691SS**  trans-67.897.5169.1-65.5179.44.700108.2A146A146-Q148 PolarHBondContact O-N 2.77Å
149T29.7Very low41.8Very low122 Ų122121.8 Ų121.875%0.74872%0.718SS**  trans-93.498.6158.337.60000108T147T147-T149 PolarHBondContact O-N 2.75Å
150T29.6Very low39.4Very low139 Ų139126.2 Ų126.285%0.85373%0.734SS**  trans-81.5121.7153.940.10000108
151K38.8Very low37.4Very low193 Ų193135.8 Ų135.884%0.83976%0.763SS**  trans-111.6132.2164.7-82.9-175.1176.4-179.50108.3
152E31.8Very low35.5Very low190 Ų190138.1 Ų138.189%0.88878%0.78SS**  trans169.8130.7153.6-97174166.200104.9
153S32.5Very low34.1Very low112 Ų112139.8 Ų139.878%0.78378%0.781SS**  cis-165.7170.59.8-66.70000109.6
154A30.7Very low33.1Very low92 Ų92143 Ų14376%0.7679%0.794SS**  trans-41159-177.200000117.9
155D30.7Very low32.4Very low141 Ų141143.9 Ų143.975%0.75479%0.793SS**  -177.9159.858.9-140.8-41.6000113.9
156K32.6Very low31.6Very low171 Ų171147.1 Ų147.174%0.74379%0.789SS**  trans86.3103.4156.6-56.8-172.6-175.7-1740125.5
157E28.6Very low31.1Very low190 Ų190147 Ų14789%0.88878%0.779SS**  59.7149.5117.4-64-160.3145.300126.7
158A29.5Very low30.9Very low95 Ų95148.1 Ų148.179%0.78578%0.776SS**  trans86.3101.5165.500000117
159D25.8Very low30.2Very low147 Ų147144.4 Ų144.479%0.78676%0.762SS**  91.911476-170.742.6000112.2
160I33.5Very low30.4Very low144 Ų144145.8 Ų145.874%0.73876%0.76SS**  175.7112.4127.4-82.9159.2000106.7V162I160-V162 HydrophobicContact CG2-CG2 4.46Å
161R33.3Very low30.2Very low230 Ų230146.7 Ų146.787%0.86875%0.752SS**  trans-93.1129.2157.6-72.9177.3172.8166.9-2107.9
162V29.3Very low29.7Very low131 Ų131145.6 Ų145.679%0.79475%0.75SS**  trans-136.2108.2147.5175.40000108.6I160I160-V162 HydrophobicContact CG2-CG2 4.46Å
163D31.3Very low29.5Very low140 Ų140144.4 Ų144.475%0.74974%0.744SS**  trans-63.1145.7158.3-116.5-75.3000110.2
164T28.4Very low29.1Very low131 Ų131144.9 Ų144.980%0.80475%0.747SS**  -169.1115.7129.2-49.80000111.4
165N29.3Very low28.8Very low127 Ų127147.1 Ų147.168%0.67975%0.746SS**  trans19.9128.6149.7-96.1-18.5000121.4
166R25.8Very low28.5Very low195 Ų195147.1 Ų147.174%0.73675%0.752SS**  69.3125.980.9-151.4-168.9166.2150.2-2.6110.5
167T26.1Very low28.4Very low87 Ų87146.7 Ų146.753%0.53475%0.752SS.*  176.2136.572.3-50.90000110.2
168E29.4Very low28.4Very low145 Ų145145.6 Ų145.668%0.67875%0.748SS**  trans61.3146.4143.4-74.5158.4-16300119.8
169D27.4Very low28.5Very low110 Ų110149.5 Ų149.559%0.58875%0.749SS**  cis-167151.923.1-121.1-33.9000111.7
170Q33.2Very low28.8Very low151 Ų151151.6 Ų151.671%0.70675%0.752SS**  trans39148.5139.5-69.6172.666.900121
171K26.1Very low29.1Very low159 Ų159154.8 Ų154.869%0.69176%0.76SS**  cis-169.5153.412.4-133.7175.2169.9-175.90102.5
172E27.6Very low29.7Very low169 Ų169152.7 Ų152.779%0.7976%0.757SS**  -179.4156.268.2-136.2167.3-168.900110.5
173Q27.6Very low30.4Very low166 Ų166156.4 Ų156.478%0.77676%0.763SS**  trans-83.6158.3-167.6-63.6160.7-48.700113.5
174S25.2Very low31.5Very low121 Ų121156 Ų15685%0.84676%0.76SS**  -154.7127.4123.849.50000111.5
175N24.4Very low32.6Very low139 Ų139156 Ų15674%0.74376%0.755SS**  trans-71.4146.1171.3-91.9-56.9000110.7
176T25.1Very low34Very low142 Ų142159.2 Ų159.287%0.87176%0.763SS**  trans-155130.5134.2-61.30000108.6
177E29Very low35.6Very low161 Ų161160.1 Ų160.175%0.75277%0.766SS**  trans-66.9161.4-177.5-75.1-163.4131.800115.5
178E28.3Very low37.3Very low168 Ų168160.3 Ų160.379%0.78576%0.761SS**  trans49.1114.7149.2-78.4-164.9116.900120.6
179E31.9Very low38.9Very low176 Ų176162.9 Ų162.982%0.82277%0.765SS**  -173.9132.796.7-101.3-128.4112.900112.2K181E179-K181 PolarHBondContact O-N 3.37Å
180K33.3Very low40.5Very low192 Ų192164.8 Ų164.884%0.83577%0.768SS**  trans-65.6109.7174.7-74.8168.4177166.10110.6K182K180-K182 VanDerWaalsContact C-N 3.3Å; K180-K182 PolarHBondContact O-N 3.16Å
181K38.4Very low42Very low210 Ų210163.1 Ų163.191%0.91376%0.76SS**  trans-73.383.8164.1-71.2-177.6-178.1173.40110.9E179 K183E179-K181 PolarHBondContact O-N 3.37Å; K181-K183 PolarHBondContact O-N 2.89Å
182K46.9Very low43.6Very low186 Ų186158.2 Ų158.281%0.80975%0.749SS**  trans-56.3129.2158.7-89.1178.5176.2174.90108.8K180 L184K180-K182 VanDerWaalsContact C-N 3.3Å; K180-K182 PolarHBondContact O-N 3.16Å; K182-L184 PolarHBondContact O-N 3.04Å
183K44.8Very low45.2Very low210 Ų210159.6 Ų159.691%0.91375%0.747SS**  trans-59115.1170.7-75175.2176.3171.80109.3K181K181-K183 PolarHBondContact O-N 2.89Å
184L53Low46.7Very low130 Ų130158.1 Ų158.168%0.68174%0.74SS**  trans-67.8144.3176.8-65.6168.9000111.6K182 E188K182-L184 PolarHBondContact O-N 3.04Å; L184-E188 HydrophobicContact CB-CB 4.45Å; L184-E188 WeakPolarHBondContact CD2-OE2 3.03Å
185N52.4Low48.3Very low132 Ų132160.5 Ų160.571%0.70674%0.738SS**  trans-85.2155.4-177.7-119.2-14.5000110.8R187 E188N185-R187 PolarHBondContact O-N 3.33Å; N185-E188 PolarHBondContact N-OE2 2.98Å; N185-E188 PolarHBondContact O-N 3.24Å
186K59.3Low49.8Very low194 Ų194162.9 Ų162.984%0.84374%0.742SS**THydrogen-bonded Turntrans-52.1-16.6-167.7-168.9167.4-179.21720116.7
187R58.6Low50.9Low215 Ų215163.6 Ų163.681%0.81174%0.74SS**THydrogen-bonded Turntrans-77.4-43.8176.4-88.5179.3171168.3-3.6113N185 R189 K190 E191N185-R187 PolarHBondContact O-N 3.33Å; R187-R189 VanDerWaalsContact C-N 3.29Å; R187-R189 PolarHBondContact O-N 3.45Å; R187-K190 WeakPolarHBondContact O-CB 3.43Å; R187-K190 PolarHBondContact O-N 3.24Å; R187-E191 PolarHBondContact O-N 3.36Å
188E60.7Low52Low91 Ų91158.8 Ų158.843%0.42573%0.734SS.*Hα-helixtrans-67.3-32.3-173.9-62.7168112.300111.7L184 N185 K190 E191 A192L184-E188 HydrophobicContact CB-CB 4.45Å; L184-E188 WeakPolarHBondContact CD2-OE2 3.03Å; N185-E188 PolarHBondContact N-OE2 2.98Å; N185-E188 PolarHBondContact O-N 3.24Å; E188-K190 VanDerWaalsContact C-N 3.27Å; E188-K190 PolarHBondContact O-N 3.18Å; E188-E191 PolarHBondContact O-N 2.87Å; E188-A192 PolarHBondContact O-N 2.73Å; E188-A192 VanDerWaalsContact O-N 3.16Å
189R63.4Low52.4Low199 Ų199160.9 Ų160.975%0.75174%0.741SS**Hα-helixtrans-66.9-25.1175.1-158.4178.3-139.1-144.94.1113.5R187R187-R189 VanDerWaalsContact C-N 3.29Å; R187-R189 PolarHBondContact O-N 3.45Å
190K60.4Low52.4Low149 Ų149157.1 Ų157.165%0.64874%0.739SS**Hα-helixtrans-84.8-28.6-179.4-165.7178.5178.7-174.60111.8R187 E188 Q194R187-K190 WeakPolarHBondContact O-CB 3.43Å; R187-K190 PolarHBondContact O-N 3.24Å; E188-K190 VanDerWaalsContact C-N 3.27Å; E188-K190 PolarHBondContact O-N 3.18Å; K190-Q194 PolarHBondContact O-NE2 3.13Å; K190-Q194 VanDerWaalsContact O-NE2 3.09Å
191E64.8Low52.8Low116 Ų116154.1 Ų154.154%0.54274%0.739SS.*Hα-helixtrans-78.5-38.6176.8-70.7170.6140.800111.3R187 E188 R193 Q194 Q195R187-E191 PolarHBondContact O-N 3.36Å; E188-E191 PolarHBondContact O-N 2.87Å; E191-R193 PolarHBondContact O-N 3.1Å; E191-Q194 PolarHBondContact O-N 2.91Å; E191-Q195 PolarHBondContact O-N 2.79Å
192A61Low52.6Low57 Ų57154.4 Ų154.447%0.47174%0.741SS.*Hα-helixtrans-62.1-23.9174.400000114.3E188E188-A192 PolarHBondContact O-N 2.73Å; E188-A192 VanDerWaalsContact O-N 3.16Å
193R60Low51.9Low197 Ų197157.1 Ų157.174%0.74375%0.746SS**Hα-helixtrans-79.5-27174.2-85.6-176.5174.7-168.7-3.1113.4E191E191-R193 PolarHBondContact O-N 3.1Å
194Q59.2Low51.4Low136 Ų136154.3 Ų154.364%0.63674%0.741SS**Hα-helixtrans-79.3-28.5-177.8-74.4171.666.700112.2K190 E191K190-Q194 PolarHBondContact O-NE2 3.13Å; K190-Q194 VanDerWaalsContact O-NE2 3.09Å; E191-Q194 PolarHBondContact O-N 2.91Å
195Q59.4Low50.4Low171 Ų171156.9 Ų156.980%0.79975%0.749SS**THydrogen-bonded Turntrans-79.4-14.1179.7-66-177.711.700114.3E191E191-Q195 PolarHBondContact O-N 2.79Å
196K55.5Low49.2Very low188 Ų188156.9 Ų156.982%0.81775%0.749SS**THydrogen-bonded Turntrans-89.5-2.1-179.3-71.8-168.5176.7-169.70114.9
197N48.6Very low47.8Very low158 Ų158156 Ų15685%0.84575%0.745SS**SBendtrans-100.822-172.9-125.749.9000114.9
198G51.4Low46.3Very low60 Ų60152 Ų15262%0.61975%0.745SS**SBendtrans-137.678.5-178.200000113.5
199K38Very low44.7Very low212 Ų212151.8 Ų151.892%0.92276%0.759SS**  trans162.9115.3141.7-97162.6173.1175.30111.5
200A32Very low43.1Very low96 Ų96151.7 Ų151.779%0.79377%0.767SS**  trans-153.9118.5142.800000108.2
201P41.3Very low41.4Very low129 Ų129148.1 Ų148.184%0.83877%0.772SS**PPolyproline II helixtrans-79.7139171.232.4-29.5000109.3
202K33Very low39.7Very low217 Ų217151.4 Ų151.494%0.94379%0.787SS**PPolyproline II helixtrans-101.9132.8165.6-89.5-169.6176.5-178.80110
203R32.5Very low38Very low243 Ų243153.8 Ų153.892%0.91780%0.796SS**PPolyproline II helixtrans-78.6148.6-174.7-169.4176.4-177.3-128.24.4110.9
204D33.9Very low36.8Very low150 Ų150153.5 Ų153.580%0.80280%0.801SS**PPolyproline II helixtrans-52.1139.9173.2-98.3-81.1000115
205E32.2Very low35.2Very low185 Ų185155.2 Ų155.286%0.86481%0.806SS**  -166.6106.1125.6-102.7-172117.900112.4
206N28.8Very low33.6Very low132 Ų132153.1 Ų153.171%0.70681%0.809SS**  trans66.2136.5130.2-140.32000125.7
207K29.8Very low32.4Very low174 Ų174150.9 Ų150.976%0.75780%0.801SS**  trans96.693.4154.1-64.9-167.4178.1178.40122.4
208T25.2Very low31.3Very low133 Ų133149.6 Ų149.682%0.81680%0.799SS**  51.2113.6122.6-22.90000121.4
209A28.7Very low30.1Very low85 Ų85150.4 Ų150.470%0.70281%0.808SS**  161.4121.4103.900000112.6
210E28.4Very low29.8Very low198 Ų198150 Ų15093%0.92581%0.806SS**  trans30.5118.4147-57.5-178134.700119.8
211G25.5Very low29.7Very low73 Ų73155 Ų15575%0.75381%0.813SS**  123.9130.477.100000105
212E29.3Very low29Very low185 Ų185157.9 Ų157.986%0.86481%0.812SS**  -172.4137.157.6-87.5-176.8110.700109.6
213T26Very low29Very low108 Ų108157 Ų15766%0.66381%0.808SS**  trans22.4118.6140.537.30000122
214K32.9Very low28.8Very low191 Ų191155 Ų15583%0.8381%0.806SS**  155.9106.690.2-101.9157.9-170.2178.30113.1
215K25.7Very low28.7Very low171 Ų171155.4 Ų155.474%0.74381%0.808SS**  trans35.1113.1135.3-158.2175.1-176.7-176.70119.8Q217K215-Q217 HydrophobicContact CG-CG 4.35Å
216C26.1Very low28.6Very low128 Ų128158.6 Ų158.687%0.86581%0.813SS**  trans-95.5129.1154.5-166.20000109.3
217Q30.8Very low28.6Very low141 Ų141160.9 Ų160.966%0.65982%0.816SS**  trans-161.1139.3163-76.4-15917.700106.2K215K215-Q217 HydrophobicContact CG-CG 4.35Å
218T25.8Very low28.6Very low130 Ų130163.1 Ų163.180%0.79882%0.82SS**  cis-174.9163.714.720.60000106.4
219G27.1Very low28.7Very low78 Ų78164.6 Ų164.680%0.80482%0.815SS**  trans136.484.7153.100000116.4
220K30.4Very low28.6Very low202 Ų202169.8 Ų169.888%0.87882%0.818SS**  trans-65.1143.4161.3-68.8167.7174.1170.20109.7
221Q30.1Very low28.6Very low201 Ų201168.2 Ų168.294%0.93981%0.811SS**  -174.4159117.8-102.5174.3-16.200114.5
222K27.8Very low28.7Very low191 Ų191167.5 Ų167.583%0.8380%0.803SS**  trans-85.5153.2-160.8-78.8170168.1170.90114.5
223K32.3Very low28.6Very low197 Ų197165.4 Ų165.486%0.85780%0.798SS**  trans46.3123138.4-71.2-172.3171.4-172.40119.4
224K27.6Very low28.6Very low201 Ų201168.2 Ų168.287%0.87480%0.803SS**  -165.8137.3121.2-140.4170.6179.6174.30113.2
225D32.7Very low28.3Very low159 Ų159165 Ų16585%0.8580%0.795SS**  trans-44.7141.4161.8-70.1-95.1000114
226R30.3Very low28.5Very low253 Ų253164.4 Ų164.496%0.95580%0.795SS**  trans-155.7132.1146.9-153.1168171.3-179.4-4.3113.1
227K28.6Very low28.5Very low179 Ų179163.2 Ų163.278%0.77878%0.784SS**  trans-89.8157.4177.2171.3170179.3166.20110.6
228R29.7Very low28.4Very low221 Ų221164 Ų16483%0.83479%0.788SS**  trans76.9145.6166.5-109.7179.7-163.5161.83.4114.4
229K26.2Very low28.5Very low164 Ų164164.7 Ų164.771%0.71379%0.786SS**  cis-167.1157.125.1-160.5-178.6175.7-149.30109.4
230Y27.3Very low28.6Very low195 Ų195163.9 Ų163.977%0.76578%0.779SS**  trans-41.4144.9158.5-180-92.6000116.8
231E27.7Very low28.6Very low165 Ų165160.1 Ų160.177%0.77177%0.772SS**  trans176.3133.2146-93.4153.6-152.400105.6
232G28.7Very low28.7Very low57 Ų57157.5 Ų157.559%0.58876%0.76SS**  cis99.589.216.600000110.6
233D26.2Very low28.9Very low142 Ų142156.1 Ų156.176%0.75976%0.756SS**  trans-178117156.2-135.6-127.1000106.3
234E26.4Very low28.9Very low167 Ų167152.9 Ų152.978%0.7875%0.748SS**  60.7132.674.5-59.6-169.8177.500110.1
235D27.3Very low29.2Very low123 Ų123147.6 Ų147.666%0.65874%0.737SS**  cis-168.8177.819.7-165.3-122.1000109.6
236Q28.9Very low29.2Very low158 Ų158150.2 Ų150.274%0.73874%0.741SS**  trans95.5101.1159.7-60.1177.750.600116.2
237T25.8Very low29.5Very low104 Ų104146.5 Ų146.564%0.63873%0.732SS**  51.612462.876.90000110.7
238E30.7Very low29.6Very low157 Ų157145.1 Ų145.173%0.73474%0.738SS**  -164.313375.3-77.6-163.9131.700109.3
239N27.3Very low30Very low144 Ų144142.5 Ų142.577%0.7773%0.733SS**  70.2131.1107.2-59.8-41000114
240G28.6Very low30.4Very low62 Ų62141.9 Ų141.964%0.63974%0.736SS**  cis153.8175.99.300000109.2
241V31.3Very low30.7Very low123 Ų123138.5 Ų138.575%0.74573%0.731SS**  trans83.8130.8143.4170.40000117.1
242E32Very low31Very low146 Ų146139.2 Ų139.268%0.68273%0.734SS**  cis-168.7160.22.9-110.9173.6-164.500112.3
243E32.1Very low31.2Very low161 Ų161140.7 Ų140.775%0.75274%0.741SS**  trans45.7149137.7-66.3-179.216000122
244D31.7Very low31.5Very low129 Ų129138.9 Ų138.969%0.6975%0.746SS**  cis-161.6152.840.6-173-125000114.2
245S33.7Very low31.9Very low91 Ų91139.8 Ų139.864%0.63675%0.75SS**  trans-0.2145.8153.8-50.60000123.4
246K32.8Very low32.4Very low213 Ų213139.8 Ų139.893%0.92676%0.76SS**  171.815194-152.4165.1-173.4171.50113.9
247K36.8Very low32.9Very low176 Ų176140.7 Ų140.777%0.76576%0.764SS**  trans-82.3149.3-170.5172.8-173.4-177.3-178.10115.3
248T29.9Very low33.6Very low150 Ų150144.5 Ų144.592%0.9278%0.775SS**  trans-155.2148.7142.77.80000112.5
249K38Very low34Very low166 Ų166142.4 Ų142.472%0.72277%0.773SS**  trans-131.2158.8-168.8-159.4-169.4-172.8-160.50107.8
250I34.4Very low34.6Very low150 Ų150144.4 Ų144.477%0.76978%0.777SS**  trans147.9105.4155-77.1156.9000107.4
251D34.7Very low35.2Very low124 Ų124148.8 Ų148.866%0.66379%0.786SS**  67.4140.189.5-53.7-53.7000111.9
252E34.4Very low35.8Very low180 Ų180152.2 Ų152.284%0.84179%0.794SS**  cis-168.4160.613-142.2-175.2126.200109.8
253A31.7Very low36.4Very low88 Ų88149.2 Ų149.273%0.72779%0.794SS**  trans28.4136.3149.900000125.3
254A32.5Very low37Very low105 Ų105150.1 Ų150.187%0.86880%0.8SS**  178.5137.2113.300000113.1
255E34.9Very low37.8Very low186 Ų186150 Ų15087%0.86981%0.81SS**  trans-62.6158.2173.6-71.2173.196.900114.8
256S37.2Very low38.7Very low122 Ų122154.3 Ų154.385%0.85382%0.82SS**  -176.5130.6118.530.50000111.7
257E40.7Very low39.3Very low178 Ų178147.9 Ų147.983%0.83281%0.814SS**  trans-84.8145.2166.9-50.9-164.4140.400110.2
258E40.9Very low39.8Very low184 Ų184146.9 Ų146.986%0.8682%0.817SS**  trans-159.2102.6147.5-71.6-154.2126.400106.8
259T37.2Very low40.7Very low113 Ų113149.9 Ų149.969%0.69384%0.835SS**  59.4119.291.955.20000117.4
260E40.7Very low40.9Very low185 Ų185149.1 Ų149.186%0.86484%0.841SS**  trans52.3119.4141.9-64.1-178.7131.300120.8
261D41.8Very low41.2Very low154 Ų154149 Ų14982%0.82485%0.845SS**  -158.3119.8118.2-138.6-65.6000111.9
262Q43.1Very low41.5Very low196 Ų196150.4 Ų150.492%0.91686%0.855SS**  trans-131101.1169-178.5172.142.400107.2
263A45.9Very low42Very low83 Ų83148.6 Ų148.669%0.68686%0.856SS**  trans-142.3100.9170.400000112.5
264M44.9Very low42.6Very low179 Ų179152.4 Ų152.488%0.88286%0.864SS**  trans12121.9145.3-60.5-177.3173.300119.2
265S48.4Very low43.3Very low127 Ų127155.6 Ų155.689%0.88886%0.863SS**  trans-100.2100.7152.553.10000110.2
266Q50.7Low43.9Very low182 Ų182153.4 Ų153.485%0.8586%0.863SS**  trans-130.9124.9158.7-74.1-170.1-11.400108.8
267G47Very low44.4Very low78 Ų78155.8 Ų155.880%0.80486%0.864SS**  trans96.4110.8142.800000119.8
268N46.8Very low44.7Very low155 Ų155154 Ų15483%0.82987%0.866SS**  84.6103.4126.4-142.653.9000119.8
269T49.1Very low45Very low212 Ų212151.3 Ų151.3100%1.30187%0.867SS**  -167.20115.27.90000110.7

Retrieved 269 of 269 residues in 472.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).