A0A087YL09_POEFO Loading...

Family with sequence similarity 107 member B

AlphaFold DB , UniProt , Accession A0A087YL09, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 134 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M52.3Low57.2Low252 Ų252148.4 Ų148.4100%1.24180%0.803SS**  0115.70-88.6170.2160.800106.3
2A56.5Low57.6Low104 Ų104148.1 Ų148.186%0.8680%0.801SS**PPolyproline II helixtrans-85.9133.8175.800000108.5
3E56.8Low58.2Low185 Ų185151.2 Ų151.286%0.86481%0.807SS**PPolyproline II helixtrans-63.9144.3172.7-77.7-159.4149.400110.6D5E3-D5 PolarHBondContact O-N 3.46Å
4P60.7Low59.3Low88 Ų88149.6 Ų149.657%0.57180%0.798SS**PPolyproline II helixtrans-72.9122.4176.729.8-29.9000109.7Y6P4-Y6 HydrophobicContact CG-CE2 4.1Å; P4-Y6 VanDerWaalsContact O-CD2 3.3Å; P4-Y6 WeakPolarHBondContact O-CD2 3.45Å; P4-Y6 PolarHBondContact O-N 3.05Å; P4-Y6 VanDerWaalsContact O-N 3.14Å
5D59.4Low60.6Low153 Ų153150.8 Ų150.882%0.81880%0.802SS**  trans-68.5103.6173-137.7-0.4000108E3 L7E3-D5 PolarHBondContact O-N 3.46Å; D5-L7 VanDerWaalsContact C-N 3.32Å; D5-L7 PolarHBondContact O-N 3.12Å
6Y60.3Low61.7Low197 Ų197151.1 Ų151.177%0.77380%0.797SS**  trans-72.995.4172.8-65.4-87.9000106.8P4 E8P4-Y6 HydrophobicContact CG-CE2 4.1Å; P4-Y6 VanDerWaalsContact O-CD2 3.3Å; P4-Y6 WeakPolarHBondContact O-CD2 3.45Å; P4-Y6 PolarHBondContact O-N 3.05Å; P4-Y6 VanDerWaalsContact O-N 3.14Å; Y6-E8 PolarHBondContact O-N 3.1Å
7L53.3Low62.9Low157 Ų157149.6 Ų149.682%0.82280%0.799SS**  trans-46.1109.2169.6-68.3170.1000108.6D5 G9D5-L7 VanDerWaalsContact C-N 3.32Å; D5-L7 PolarHBondContact O-N 3.12Å; L7-G9 PolarHBondContact O-N 3.46Å
8E58.4Low63.7Low210 Ų210152 Ų15298%0.98180%0.801SS**  trans-70.454.6164-160.3167.4-144.800108Y6Y6-E8 PolarHBondContact O-N 3.1Å
9G53.2Low64.6Low49 Ų49154.7 Ų154.751%0.50581%0.805SS.*  trans-95.6119.6174.900000107.5L7 C11L7-G9 PolarHBondContact O-N 3.46Å; G9-C11 PolarHBondContact O-N 2.7Å; G9-C11 VanDerWaalsContact O-N 3.08Å
10D60.8Low65.4Low142 Ų142155.6 Ų155.676%0.75981%0.81SS**  trans-26.5110.5174.1-81.7-45000112.9D12D10-D12 PolarHBondContact O-N 2.91Å
11C57.7Low66.3Low95 Ų95155 Ų15564%0.64281%0.806SS**  trans-70.962.1166.1-69.60000109.5G9 E13 L14G9-C11 PolarHBondContact O-N 2.7Å; G9-C11 VanDerWaalsContact O-N 3.08Å; C11-E13 PolarHBondContact O-N 3.22Å; C11-L14 HydrophobicContact CB-CB 4.44Å; C11-L14 PolarHBondContact O-N 3.24Å
12D61.5Low67.9Low145 Ų145146.8 Ų146.878%0.77577%0.767SS**THydrogen-bonded Turntrans-68.6-8.1172-84-24000112.2D10D10-D12 PolarHBondContact O-N 2.91Å
13E65.4Low69.2Low189 Ų189146.4 Ų146.488%0.88376%0.756SS**THydrogen-bonded Turntrans-87.8-8.3174.2-64.2-172.8170.400113.8C11 I15C11-E13 PolarHBondContact O-N 3.22Å; E13-I15 PolarHBondContact O-N 3.47Å
14L74.2Confident70.5Confident129 Ų129140.3 Ų140.368%0.67573%0.731SS**SBendtrans-80.8113.4176.9-116.871.9000110.5C11 Q16C11-L14 HydrophobicContact CB-CB 4.44Å; C11-L14 PolarHBondContact O-N 3.24Å; L14-Q16 PolarHBondContact O-N 3.4Å
15I78.8Confident71.6Confident167 Ų167142.7 Ų142.786%0.85673%0.733SS**  trans-62.5101.6174.1-60.6173.7000109.1E13E13-I15 PolarHBondContact O-N 3.47Å
16Q77.7Confident72.9Confident155 Ų155139.1 Ų139.172%0.72472%0.72SS**  trans-75.2136.6172.3-64.5-163-7.800110.4L14 K18L14-Q16 PolarHBondContact O-N 3.4Å; Q16-K18 PolarHBondContact O-N 3.17Å
17P82.6Confident74.4Confident127 Ų127132.1 Ų132.183%0.82570%0.7SS**  trans-63.8103.6174.224.3-31000109.9
18K77.1Confident76.2Confident192 Ų192132.1 Ų132.184%0.83569%0.689SS**PPolyproline II helixtrans-74.4125.6173.9-69.6179.5-178.9174.70109.1Q16 L20Q16-K18 PolarHBondContact O-N 3.17Å; K18-L20 PolarHBondContact O-N 3Å; K18-L20 VanDerWaalsContact O-N 3.15Å
19K81Confident77.8Confident204 Ų204128.1 Ų128.189%0.88767%0.674SS**PPolyproline II helixtrans-62.9118.3173.5-65-179.8-176.7175.80108.5I21K19-I21 PolarHBondContact O-N 2.87Å
20L81Confident79.8Confident171 Ų171129.9 Ų129.990%0.89567%0.669SS**PPolyproline II helixtrans-60130.6174.7-65.8174.4000109.2K18 N22K18-L20 PolarHBondContact O-N 3Å; K18-L20 VanDerWaalsContact O-N 3.15Å; L20-N22 PolarHBondContact O-N 3.3Å
21I82.8Confident81.4Confident144 Ų144126 Ų12674%0.73865%0.647SS**PPolyproline II helixtrans-70.9119.8178.7-62.3168.6000107.6K19 P23K19-I21 PolarHBondContact O-N 2.87Å; I21-P23 VanDerWaalsContact O-CD 3.28Å; I21-P23 WeakPolarHBondContact O-CD 3.34Å
22N86.3Confident83.1Confident79 Ų79124 Ų12442%0.42263%0.63SS.*  trans-71.5115.2176.3180-22.2000109.4L20 V24 K25 S26L20-N22 PolarHBondContact O-N 3.3Å; N22-V24 PolarHBondContact O-N 2.91Å; N22-V24 VanDerWaalsContact OD1-CB 3.27Å; N22-V24 WeakPolarHBondContact OD1-CB 3.3Å; N22-V24 PolarHBondContact OD1-N 3.02Å; N22-K25 HydrophobicContact CB-CB 4.02Å; N22-K25 HydrophobicContact CB-CG 3.96Å; N22-K25 CarbonylContact O-C 3.59Å; N22-K25 WeakPolarHBondContact O-CA 3.24Å; N22-K25 PolarHBondContact O-N 3.02Å; N22-K25 PolarHBondContact OD1-N 3.48Å; N22-S26 PolarHBondContact O-N 2.92Å
23P84.4Confident84.5Confident96 Ų96121.4 Ų121.462%0.62362%0.615SS**Hα-helixtrans-62.6-27.1-176.325.3-34.3000113.3I21 S26 S27I21-P23 VanDerWaalsContact O-CD 3.28Å; I21-P23 WeakPolarHBondContact O-CD 3.34Å; P23-S26 VanDerWaalsContact CA-OG 3.28Å; P23-S26 WeakPolarHBondContact CA-OG 3.32Å; P23-S26 PolarHBondContact O-OG 3Å; P23-S27 WeakPolarHBondContact O-CB 3.42Å; P23-S27 PolarHBondContact O-N 3.29Å; P23-S27 VanDerWaalsContact O-N 3.13Å
24V84.1Confident85.8Confident57 Ų57117.2 Ų117.235%0.34560%0.595SS.*Hα-helixtrans-72.5-32.3175.2170.90000111.4N22 H30N22-V24 PolarHBondContact O-N 2.91Å; N22-V24 VanDerWaalsContact OD1-CB 3.27Å; N22-V24 WeakPolarHBondContact OD1-CB 3.3Å; N22-V24 PolarHBondContact OD1-N 3.02Å; V24-H30 WeakPolarHBondContact CG1-CE1 3.36Å; V24-H30 WeakPolarHBondContact CG1-ND1 3.45Å
25K84.2Confident86.7Confident138 Ų138115.9 Ų115.960%0.658%0.581SS**Hα-helixtrans-86.5-22.8176.7-60.7-65.1-173.8179.90112.2N22 Q31N22-K25 HydrophobicContact CB-CB 4.02Å; N22-K25 HydrophobicContact CB-CG 3.96Å; N22-K25 CarbonylContact O-C 3.59Å; N22-K25 WeakPolarHBondContact O-CA 3.24Å; N22-K25 PolarHBondContact O-N 3.02Å; N22-K25 PolarHBondContact OD1-N 3.48Å; K25-Q31 PolarHBondContact O-NE2 2.94Å
26S85.7Confident87.2Confident79 Ų79113.1 Ų113.155%0.55256%0.564SS**Hα-helixtrans-78.6-31.8172.660.60000112.6N22 P23 R28N22-S26 PolarHBondContact O-N 2.92Å; P23-S26 VanDerWaalsContact CA-OG 3.28Å; P23-S26 WeakPolarHBondContact CA-OG 3.32Å; P23-S26 PolarHBondContact O-OG 3Å; S26-R28 PolarHBondContact O-N 3.35Å
27S91.6Very high87.7Confident49 Ų49110.5 Ų110.534%0.34356%0.555SS.*  trans-77.9109.6178.1-179.40000112.4P23 N29 H30 Q31P23-S27 WeakPolarHBondContact O-CB 3.42Å; P23-S27 PolarHBondContact O-N 3.29Å; P23-S27 VanDerWaalsContact O-N 3.13Å; S27-N29 VanDerWaalsContact C-N 3.33Å; S27-N29 PolarHBondContact O-N 3.44Å; S27-H30 PolarHBondContact O-N 3.21Å; S27-H30 PolarHBondContact OG-N 2.8Å; S27-Q31 PolarHBondContact O-N 3.35Å
28R91.3Very high87.9Confident157 Ų157107.4 Ų107.459%0.59253%0.531SS*.Hα-helixtrans-58.1-44.4174.5-179.360.3-179.6-162.8-4.7112.2S26 H30 Q31 D32S26-R28 PolarHBondContact O-N 3.35Å; R28-H30 VanDerWaalsContact C-N 3.29Å; R28-H30 PolarHBondContact O-N 2.86Å; R28-Q31 PolarHBondContact O-N 3.39Å; R28-Q31 VanDerWaalsContact O-N 3.11Å; R28-D32 VanDerWaalsContact CD-OD1 3.31Å; R28-D32 WeakPolarHBondContact CD-OD1 3.38Å; R28-D32 IonicContact CZ-OD1 3.87Å; R28-D32 IonicContact CZ-OD2 2.81Å; R28-D32 IonicContact NE-OD1 3.08Å; R28-D32 PolarHBondContact NE-OD1 3.22Å; R28-D32 IonicContact NE-OD2 3.93Å; R28-D32 PolarHBondContact NE-OD2 2.97Å; R28-D32 VanDerWaalsContact NE-OD2 3.08Å; R28-D32 IonicContact NH2-OD1 2.91Å; R28-D32 WeakPolarHBondContact O-CB 3.4Å; R28-D32 PolarHBondContact O-N 3.04Å; R28-D32 VanDerWaalsContact O-OD1 3.11Å
29N93.5Very high88.4Confident127 Ų127102.5 Ų102.568%0.67951%0.512SS*.Hα-helixtrans-57.7-42.1-179.5-17140.2000112.1S27 D32 L33S27-N29 VanDerWaalsContact C-N 3.33Å; S27-N29 PolarHBondContact O-N 3.44Å; N29-D32 PolarHBondContact O-N 3.43Å; N29-L33 WeakPolarHBondContact O-CB 3.49Å; N29-L33 PolarHBondContact O-N 3.36Å
30H94.7Very high88.6Confident85 Ų8594.9 Ų94.939%0.39448%0.481SS..Hα-helixtrans-66.1-41.7177.4-173.1-55.9000111.7V24 S27 R28 D32 H34V24-H30 WeakPolarHBondContact CG1-CE1 3.36Å; V24-H30 WeakPolarHBondContact CG1-ND1 3.45Å; S27-H30 PolarHBondContact O-N 3.21Å; S27-H30 PolarHBondContact OG-N 2.8Å; R28-H30 VanDerWaalsContact C-N 3.29Å; R28-H30 PolarHBondContact O-N 2.86Å; H30-D32 VanDerWaalsContact C-N 3.28Å; H30-D32 PolarHBondContact O-N 2.84Å; H30-H34 WeakPolarHBondContact O-CB 3.44Å; H30-H34 PolarHBondContact O-N 3.35Å
31Q93.4Very high88.7Confident62 Ų6292.8 Ų92.829%0.2947%0.466SS..Hα-helixtrans-63.3-38.9176.4-63.8-171.118.900111.8K25 S27 R28 H34 R35K25-Q31 PolarHBondContact O-NE2 2.94Å; S27-Q31 PolarHBondContact O-N 3.35Å; R28-Q31 PolarHBondContact O-N 3.39Å; R28-Q31 VanDerWaalsContact O-N 3.11Å; Q31-H34 PolarHBondContact O-N 2.9Å; Q31-R35 WeakPolarHBondContact O-CG 3.34Å; Q31-R35 PolarHBondContact O-N 3.01Å; Q31-R35 PolarHBondContact O-NH1 3.34Å
32D93.7Very high88.6Confident53 Ų5394.4 Ų94.428%0.28347%0.468SS..Hα-helixtrans-68.2-45.7-177.3-66.54.2000110.2R28 N29 H30 H34 R35 E36R28-D32 VanDerWaalsContact CD-OD1 3.31Å; R28-D32 WeakPolarHBondContact CD-OD1 3.38Å; R28-D32 IonicContact CZ-OD1 3.87Å; R28-D32 IonicContact CZ-OD2 2.81Å; R28-D32 IonicContact NE-OD1 3.08Å; R28-D32 PolarHBondContact NE-OD1 3.22Å; R28-D32 IonicContact NE-OD2 3.93Å; R28-D32 PolarHBondContact NE-OD2 2.97Å; R28-D32 VanDerWaalsContact NE-OD2 3.08Å; R28-D32 IonicContact NH2-OD1 2.91Å; R28-D32 WeakPolarHBondContact O-CB 3.4Å; R28-D32 PolarHBondContact O-N 3.04Å; R28-D32 VanDerWaalsContact O-OD1 3.11Å; N29-D32 PolarHBondContact O-N 3.43Å; H30-D32 VanDerWaalsContact C-N 3.28Å; H30-D32 PolarHBondContact O-N 2.84Å; D32-H34 VanDerWaalsContact C-N 3.34Å; D32-H34 PolarHBondContact O-N 3.3Å; D32-R35 VanDerWaalsContact CG-NH2 3.29Å; D32-R35 PolarHBondContact O-N 3.26Å; D32-R35 IonicContact OD1-CZ 3.54Å; D32-R35 IonicContact OD1-NH1 2.72Å; D32-R35 PolarHBondContact OD1-NH1 3.41Å; D32-R35 IonicContact OD1-NH2 3.97Å; D32-R35 PolarHBondContact OD1-NH2 2.9Å; D32-R35 IonicContact OD2-NH2 2.78Å; D32-E36 PolarHBondContact O-N 3.22Å
33L91.6Very high88.5Confident90 Ų9098.7 Ų98.747%0.47148%0.479SS..Hα-helixtrans-58-44.1171.4179.263000112.2N29 R35 E36 L37N29-L33 WeakPolarHBondContact O-CB 3.49Å; N29-L33 PolarHBondContact O-N 3.36Å; L33-R35 VanDerWaalsContact C-N 3.34Å; L33-R35 PolarHBondContact O-N 3.18Å; L33-E36 PolarHBondContact O-N 3.32Å; L33-L37 HydrophobicContact CD1-CD1 4.28Å; L33-L37 HydrophobicContact CD1-CG 4.2Å; L33-L37 HydrophobicContact CG-CD1 4.08Å; L33-L37 HydrophobicContact CG-CG 4.42Å; L33-L37 WeakPolarHBondContact O-CB 3.33Å; L33-L37 VanDerWaalsContact O-CG 3.31Å; L33-L37 WeakPolarHBondContact O-CG 3.39Å; L33-L37 PolarHBondContact O-N 3.06Å
34H92Very high88Confident100 Ų10096.5 Ų96.546%0.46347%0.473SS..Hα-helixtrans-61.5-42177.9177.872.5000112.2H30 Q31 D32 I38H30-H34 WeakPolarHBondContact O-CB 3.44Å; H30-H34 PolarHBondContact O-N 3.35Å; Q31-H34 PolarHBondContact O-N 2.9Å; D32-H34 VanDerWaalsContact C-N 3.34Å; D32-H34 PolarHBondContact O-N 3.3Å; H34-I38 VanDerWaalsContact NE2-CD1 3.27Å; H34-I38 WeakPolarHBondContact NE2-CD1 3.42Å; H34-I38 WeakPolarHBondContact O-CG1 3.46Å; H34-I38 PolarHBondContact O-N 2.9Å; H34-I38 VanDerWaalsContact O-N 3.13Å
35R93.5Very high87.5Confident102 Ų10299.7 Ų99.739%0.38549%0.488SS..Hα-helixtrans-63.7-44.9175.4-69.9-165.4-50.8-81.16.3111.1Q31 D32 L33 I38 M39Q31-R35 WeakPolarHBondContact O-CG 3.34Å; Q31-R35 PolarHBondContact O-N 3.01Å; Q31-R35 PolarHBondContact O-NH1 3.34Å; D32-R35 VanDerWaalsContact CG-NH2 3.29Å; D32-R35 PolarHBondContact O-N 3.26Å; D32-R35 IonicContact OD1-CZ 3.54Å; D32-R35 IonicContact OD1-NH1 2.72Å; D32-R35 PolarHBondContact OD1-NH1 3.41Å; D32-R35 IonicContact OD1-NH2 3.97Å; D32-R35 PolarHBondContact OD1-NH2 2.9Å; D32-R35 IonicContact OD2-NH2 2.78Å; L33-R35 VanDerWaalsContact C-N 3.34Å; L33-R35 PolarHBondContact O-N 3.18Å; R35-I38 PolarHBondContact O-N 3.3Å; R35-M39 VanDerWaalsContact O-CG 3.27Å; R35-M39 WeakPolarHBondContact O-CG 3.43Å; R35-M39 PolarHBondContact O-N 2.89Å
36E89.6Confident86.8Confident108 Ų10895 Ų9551%0.50547%0.474SS..Hα-helixtrans-60.5-46.2178.4-168.8-173.3159.200112D32 L33 I38 M39 N40D32-E36 PolarHBondContact O-N 3.22Å; L33-E36 PolarHBondContact O-N 3.32Å; E36-I38 PolarHBondContact O-N 3.25Å; E36-M39 PolarHBondContact O-N 3.42Å; E36-M39 VanDerWaalsContact O-N 3.13Å; E36-N40 WeakPolarHBondContact O-CB 3.5Å; E36-N40 PolarHBondContact O-N 3.33Å
37L87.9Confident85.7Confident101 Ų10196.9 Ų96.953%0.52949%0.485SS..Hα-helixtrans-59.6-44.6177.5-72.5172.9000112L33 M39 N40 Q41L33-L37 HydrophobicContact CD1-CD1 4.28Å; L33-L37 HydrophobicContact CD1-CG 4.2Å; L33-L37 HydrophobicContact CG-CD1 4.08Å; L33-L37 HydrophobicContact CG-CG 4.42Å; L33-L37 WeakPolarHBondContact O-CB 3.33Å; L33-L37 VanDerWaalsContact O-CG 3.31Å; L33-L37 WeakPolarHBondContact O-CG 3.39Å; L33-L37 PolarHBondContact O-N 3.06Å; L37-M39 VanDerWaalsContact C-N 3.34Å; L37-M39 PolarHBondContact O-N 3.04Å; L37-N40 PolarHBondContact O-N 3.33Å; L37-Q41 WeakPolarHBondContact O-CB 3.29Å; L37-Q41 PolarHBondContact O-N 3.44Å
38I87Confident84.2Confident61 Ų6197.9 Ų97.931%0.31348%0.484SS..Hα-helixtrans-62.5-42.7175-72.3177.4000111H34 R35 E36 Q41 K42H34-I38 VanDerWaalsContact NE2-CD1 3.27Å; H34-I38 WeakPolarHBondContact NE2-CD1 3.42Å; H34-I38 WeakPolarHBondContact O-CG1 3.46Å; H34-I38 PolarHBondContact O-N 2.9Å; H34-I38 VanDerWaalsContact O-N 3.13Å; R35-I38 PolarHBondContact O-N 3.3Å; E36-I38 PolarHBondContact O-N 3.25Å; I38-Q41 PolarHBondContact O-N 2.86Å; I38-K42 HydrophobicContact CG2-CD 4.09Å; I38-K42 HydrophobicContact CG2-CG 4.46Å; I38-K42 WeakPolarHBondContact O-CB 3.48Å; I38-K42 WeakPolarHBondContact O-CG 3.48Å; I38-K42 PolarHBondContact O-N 3.42Å
39M88Confident83Confident90 Ų9097.8 Ų97.844%0.44350%0.495SS..Hα-helixtrans-63.5-43.3178.2-72.1-18082.300111.4R35 E36 L37 Q41 K42 R43R35-M39 VanDerWaalsContact O-CG 3.27Å; R35-M39 WeakPolarHBondContact O-CG 3.43Å; R35-M39 PolarHBondContact O-N 2.89Å; E36-M39 PolarHBondContact O-N 3.42Å; E36-M39 VanDerWaalsContact O-N 3.13Å; L37-M39 VanDerWaalsContact C-N 3.34Å; L37-M39 PolarHBondContact O-N 3.04Å; M39-Q41 PolarHBondContact O-N 2.9Å; M39-K42 PolarHBondContact O-N 2.91Å; M39-R43 VanDerWaalsContact O-CB 3.28Å; M39-R43 WeakPolarHBondContact O-CB 3.49Å; M39-R43 WeakPolarHBondContact O-CG 3.45Å; M39-R43 PolarHBondContact O-N 3.43Å
40N85.3Confident81.8Confident43 Ų4394.2 Ų94.223%0.2347%0.473CS..Hα-helixtrans-66.3-36.8178.2-72-16.8000112.2E36 L37 R43 G44 L45E36-N40 WeakPolarHBondContact O-CB 3.5Å; E36-N40 PolarHBondContact O-N 3.33Å; L37-N40 PolarHBondContact O-N 3.33Å; N40-R43 PolarHBondContact O-N 2.94Å; N40-G44 PolarHBondContact O-N 3.07Å; N40-L45 PolarHBondContact O-N 2.94Å
41Q81.2Confident81Confident127 Ų12794 Ų9459%0.59348%0.48SS*.Hα-helixtrans-65.4-47173.3-174.81791.200111.6L37 I38 M39 R43 G44L37-Q41 WeakPolarHBondContact O-CB 3.29Å; L37-Q41 PolarHBondContact O-N 3.44Å; I38-Q41 PolarHBondContact O-N 2.86Å; M39-Q41 PolarHBondContact O-N 2.9Å; Q41-R43 VanDerWaalsContact C-N 3.29Å; Q41-R43 PolarHBondContact O-N 3.48Å; Q41-G44 PolarHBondContact O-N 3.31Å; Q41-G44 VanDerWaalsContact O-N 3.16Å
42K81.2Confident80.4Confident178 Ų17897.1 Ų97.177%0.77449%0.494SS*.Hα-helixtrans-63-34.9176.7-74.9-179.6178-175.80112.6I38 M39 G44I38-K42 HydrophobicContact CG2-CD 4.09Å; I38-K42 HydrophobicContact CG2-CG 4.46Å; I38-K42 WeakPolarHBondContact O-CB 3.48Å; I38-K42 WeakPolarHBondContact O-CG 3.48Å; I38-K42 PolarHBondContact O-N 3.42Å; M39-K42 PolarHBondContact O-N 2.91Å; K42-G44 VanDerWaalsContact C-N 3.3Å
43R84.4Confident79.9Confident170 Ų170100.5 Ų100.564%0.64251%0.512SS*.THydrogen-bonded Turntrans-82-4.7177.3-70174.3176.6-174.9-2.2113.6M39 N40 Q41 L45M39-R43 VanDerWaalsContact O-CB 3.28Å; M39-R43 WeakPolarHBondContact O-CB 3.49Å; M39-R43 WeakPolarHBondContact O-CG 3.45Å; M39-R43 PolarHBondContact O-N 3.43Å; N40-R43 PolarHBondContact O-N 2.94Å; Q41-R43 VanDerWaalsContact C-N 3.29Å; Q41-R43 PolarHBondContact O-N 3.48Å; R43-L45 HydrophobicContact CB-CD1 4.06Å; R43-L45 HydrophobicContact CB-CG 4.06Å; R43-L45 PolarHBondContact O-N 3.49Å
44G74.6Confident79.5Confident49 Ų49100 Ų10051%0.50551%0.507SS..THydrogen-bonded Turntrans69.214.8179.600000114.9N40 Q41 K42N40-G44 PolarHBondContact O-N 3.07Å; Q41-G44 PolarHBondContact O-N 3.31Å; Q41-G44 VanDerWaalsContact O-N 3.16Å; K42-G44 VanDerWaalsContact C-N 3.3Å
45L72.9Confident79.2Confident125 Ų12599.2 Ų99.265%0.65450%0.502SS*.  trans-83-23.4-177.4-66.1172.9000113N40 R43N40-L45 PolarHBondContact O-N 2.94Å; R43-L45 HydrophobicContact CB-CD1 4.06Å; R43-L45 HydrophobicContact CB-CG 4.06Å; R43-L45 PolarHBondContact O-N 3.49Å
46A68.6Low79Confident38 Ų3898.4 Ų98.431%0.31451%0.508SS..SBendtrans-72.6143.9176.500000110.8Q48A46-Q48 WeakPolarHBondContact O-CG 3.38Å; A46-Q48 PolarHBondContact O-N 3.13Å
47P62.6Low79.1Confident119 Ų11998 Ų9877%0.77351%0.509SS*.  trans-52.7104.5165.4-21.231.4000107.9N49P47-N49 PolarHBondContact O-N 3.36Å
48Q61.4Low79.2Confident71 Ų7196.1 Ų96.133%0.33250%0.498SS..  trans-71.388.6-177.7-71.1-69.6-38.200106.5A46 K50A46-Q48 WeakPolarHBondContact O-CG 3.38Å; A46-Q48 PolarHBondContact O-N 3.13Å; Q48-K50 HydrophobicContact CB-CD 4.11Å; Q48-K50 HydrophobicContact CB-CG 3.94Å; Q48-K50 PolarHBondContact O-N 2.89Å
49N66.3Low79.4Confident154 Ų15499.4 Ų99.482%0.82451%0.51SS*.  trans-67.356.4154.1-70.8-12.6000107.7P47P47-N49 PolarHBondContact O-N 3.36Å
50K67Low79.8Confident52 Ų52102.7 Ų102.723%0.22652%0.517CS..  trans-51.3133.8171.3-90.4164.7-173.2-163.50106.2Q48 E52 Q54 K55 E58Q48-K50 HydrophobicContact CB-CD 4.11Å; Q48-K50 HydrophobicContact CB-CG 3.94Å; Q48-K50 PolarHBondContact O-N 2.89Å; K50-E52 PolarHBondContact O-N 3.04Å; K50-Q54 HydrophobicContact CB-CB 4.49Å; K50-Q54 HydrophobicContact CD-CG 4.47Å; K50-Q54 HydrophobicContact CG-CG 4.34Å; K50-K55 HydrophobicContact CB-CG 3.78Å; K50-K55 VanDerWaalsContact O-CE 3.29Å; K50-K55 WeakPolarHBondContact O-CE 3.34Å; K50-E58 WeakPolarHBondContact CE-OE1 3.41Å; K50-E58 IonicContact NZ-OE1 3.4Å; K50-E58 PolarHBondContact NZ-OE1 3.43Å; K50-E58 IonicContact NZ-OE2 2.79Å; K50-E58 PolarHBondContact NZ-OE2 3.45Å
51P79Confident80.2Confident81 Ų81107.7 Ų107.753%0.52654%0.537SS..  trans-54.9142.6173.124.5-32.1000108.4L53 Q54 K55P51-L53 PolarHBondContact O-N 3.14Å; P51-L53 VanDerWaalsContact O-N 3.08Å; P51-Q54 HydrophobicContact CG-CB 3.86Å; P51-Q54 WeakPolarHBondContact O-CB 3.33Å; P51-Q54 PolarHBondContact O-N 3.36Å; P51-K55 PolarHBondContact O-N 3.32Å
52E79.8Confident80.9Confident127 Ų127109.8 Ų109.859%0.59354%0.54SS*.Hα-helixtrans-51.9-37.7-175.7-71-56.5128.900112K50 Q54 K55 V56K50-E52 PolarHBondContact O-N 3.04Å; E52-Q54 VanDerWaalsContact C-N 3.34Å; E52-Q54 PolarHBondContact O-N 2.89Å; E52-K55 PolarHBondContact O-N 3.42Å; E52-K55 IonicContact OE1-NZ 2.7Å; E52-K55 PolarHBondContact OE1-NZ 3.07Å; E52-V56 WeakPolarHBondContact O-CG2 3.34Å; E52-V56 PolarHBondContact O-N 2.93Å
53L84.7Confident81.5Confident125 Ų125106.3 Ų106.365%0.65453%0.526SS*.Hα-helixtrans-55.9-44.5174.1-177.961.3000113P51 V56 L57P51-L53 PolarHBondContact O-N 3.14Å; P51-L53 VanDerWaalsContact O-N 3.08Å; L53-V56 PolarHBondContact O-N 3.22Å; L53-L57 HydrophobicContact CD1-CD1 4.42Å; L53-L57 HydrophobicContact CD1-CG 4.39Å; L53-L57 HydrophobicContact CG-CD1 4.25Å; L53-L57 VanDerWaalsContact O-CG 3.31Å; L53-L57 WeakPolarHBondContact O-CG 3.38Å; L53-L57 PolarHBondContact O-N 3.25Å
54Q82.2Confident82Confident79 Ų79103.3 Ų103.337%0.36952%0.519SS..Hα-helixtrans-67.4-40.6179.2-177.4177.6-13.300111.4K50 P51 E52 V56 L57 E58K50-Q54 HydrophobicContact CB-CB 4.49Å; K50-Q54 HydrophobicContact CD-CG 4.47Å; K50-Q54 HydrophobicContact CG-CG 4.34Å; P51-Q54 HydrophobicContact CG-CB 3.86Å; P51-Q54 WeakPolarHBondContact O-CB 3.33Å; P51-Q54 PolarHBondContact O-N 3.36Å; E52-Q54 VanDerWaalsContact C-N 3.34Å; E52-Q54 PolarHBondContact O-N 2.89Å; Q54-V56 VanDerWaalsContact C-N 3.32Å; Q54-V56 PolarHBondContact O-N 3.43Å; Q54-L57 PolarHBondContact O-N 3.08Å; Q54-E58 HydrophobicContact CG-CG 4.44Å; Q54-E58 PolarHBondContact NE2-OE1 3.42Å; Q54-E58 WeakPolarHBondContact O-CB 3.39Å; Q54-E58 WeakPolarHBondContact O-CG 3.28Å; Q54-E58 PolarHBondContact O-N 2.93Å
55K85.4Confident83Confident83 Ų83104.6 Ų104.636%0.36152%0.517SS..Hα-helixtrans-60.1-44.3174.7-64179-175162.30111.2K50 P51 E52 E58 K59K50-K55 HydrophobicContact CB-CG 3.78Å; K50-K55 VanDerWaalsContact O-CE 3.29Å; K50-K55 WeakPolarHBondContact O-CE 3.34Å; P51-K55 PolarHBondContact O-N 3.32Å; E52-K55 PolarHBondContact O-N 3.42Å; E52-K55 IonicContact OE1-NZ 2.7Å; E52-K55 PolarHBondContact OE1-NZ 3.07Å; K55-E58 PolarHBondContact O-N 2.97Å; K55-K59 VanDerWaalsContact O-CB 3.27Å; K55-K59 WeakPolarHBondContact O-CB 3.42Å; K55-K59 PolarHBondContact O-N 3.46Å
56V89.9Confident83.9Confident85 Ų85103.7 Ų103.752%0.51551%0.512SS..Hα-helixtrans-64.3-44178.51710000111.4E52 L53 Q54 K59 R60E52-V56 WeakPolarHBondContact O-CG2 3.34Å; E52-V56 PolarHBondContact O-N 2.93Å; L53-V56 PolarHBondContact O-N 3.22Å; Q54-V56 VanDerWaalsContact C-N 3.32Å; Q54-V56 PolarHBondContact O-N 3.43Å; V56-K59 PolarHBondContact O-N 3.25Å; V56-R60 WeakPolarHBondContact O-CB 3.48Å; V56-R60 PolarHBondContact O-N 2.87Å
57L92.3Very high85.2Confident101 Ų101108.9 Ų108.953%0.52953%0.527SS..Hα-helixtrans-64.5-44.1177.1-71.5175.7000112.2L53 Q54 R60 K61L53-L57 HydrophobicContact CD1-CD1 4.42Å; L53-L57 HydrophobicContact CD1-CG 4.39Å; L53-L57 HydrophobicContact CG-CD1 4.25Å; L53-L57 VanDerWaalsContact O-CG 3.31Å; L53-L57 WeakPolarHBondContact O-CG 3.38Å; L53-L57 PolarHBondContact O-N 3.25Å; Q54-L57 PolarHBondContact O-N 3.08Å; L57-R60 PolarHBondContact O-N 3.14Å; L57-K61 WeakPolarHBondContact O-CB 3.38Å; L57-K61 PolarHBondContact O-N 2.96Å
58E89.9Confident86.5Confident60 Ų60105.8 Ų105.828%0.2851%0.512SS..Hα-helixtrans-62-43.4175.4-74.3178.6-166.300111.4K50 Q54 K55 K61 R62K50-E58 WeakPolarHBondContact CE-OE1 3.41Å; K50-E58 IonicContact NZ-OE1 3.4Å; K50-E58 PolarHBondContact NZ-OE1 3.43Å; K50-E58 IonicContact NZ-OE2 2.79Å; K50-E58 PolarHBondContact NZ-OE2 3.45Å; Q54-E58 HydrophobicContact CG-CG 4.44Å; Q54-E58 PolarHBondContact NE2-OE1 3.42Å; Q54-E58 WeakPolarHBondContact O-CB 3.39Å; Q54-E58 WeakPolarHBondContact O-CG 3.28Å; Q54-E58 PolarHBondContact O-N 2.93Å; K55-E58 PolarHBondContact O-N 2.97Å; E58-K61 PolarHBondContact O-N 2.96Å; E58-R62 WeakPolarHBondContact O-CG 3.42Å; E58-R62 PolarHBondContact O-N 2.9Å
59K91.1Very high87.9Confident130 Ų130107.4 Ų107.457%0.56552%0.519SS*.Hα-helixtrans-60.7-49.6175.6-176.1-180174.8-177.40111.3K55 V56 K61 R62 E63K55-K59 VanDerWaalsContact O-CB 3.27Å; K55-K59 WeakPolarHBondContact O-CB 3.42Å; K55-K59 PolarHBondContact O-N 3.46Å; V56-K59 PolarHBondContact O-N 3.25Å; K59-K61 VanDerWaalsContact C-N 3.32Å; K59-K61 PolarHBondContact O-N 3.36Å; K59-R62 WeakPolarHBondContact O-CB 3.38Å; K59-R62 PolarHBondContact O-N 3.38Å; K59-R62 VanDerWaalsContact O-N 3.17Å; K59-E63 WeakPolarHBondContact CE-OE1 3.42Å; K59-E63 HydrophobicContact CG-CG 4.49Å; K59-E63 WeakPolarHBondContact O-CG 3.34Å; K59-E63 PolarHBondContact O-N 3.17Å
60R95.2Very high88.9Confident159 Ų159106.8 Ų106.860%0.651%0.509SS*.Hα-helixtrans-58.6-43.2177.5-177.2-179.4178.5124.6-2.6111.8V56 L57 E63 Q64V56-R60 WeakPolarHBondContact O-CB 3.48Å; V56-R60 PolarHBondContact O-N 2.87Å; L57-R60 PolarHBondContact O-N 3.14Å; R60-E63 PolarHBondContact O-N 3.27Å; R60-Q64 WeakPolarHBondContact O-CG 2.96Å; R60-Q64 PolarHBondContact O-N 3.31Å
61K95.4Very high89.9Confident149 Ų149110.2 Ų110.265%0.64853%0.526SS*.Hα-helixtrans-62.1-44177.2-172.4177.7-179.11790111.2L57 E58 K59 Q64 V65L57-K61 WeakPolarHBondContact O-CB 3.38Å; L57-K61 PolarHBondContact O-N 2.96Å; E58-K61 PolarHBondContact O-N 2.96Å; K59-K61 VanDerWaalsContact C-N 3.32Å; K59-K61 PolarHBondContact O-N 3.36Å; K61-Q64 PolarHBondContact O-N 3.48Å; K61-V65 WeakPolarHBondContact O-CG2 3.33Å; K61-V65 PolarHBondContact O-N 3.48Å; K61-V65 VanDerWaalsContact O-N 3.14Å
62R94.9Very high90.1Very high171 Ų171112 Ų11265%0.64553%0.527SS*.Hα-helixtrans-62.2-45.8175.6-72175.4-178.8-178.50.3111.8E58 K59 Q64 V65 I66E58-R62 WeakPolarHBondContact O-CG 3.42Å; E58-R62 PolarHBondContact O-N 2.9Å; K59-R62 WeakPolarHBondContact O-CB 3.38Å; K59-R62 PolarHBondContact O-N 3.38Å; K59-R62 VanDerWaalsContact O-N 3.17Å; R62-Q64 VanDerWaalsContact C-N 3.32Å; R62-Q64 PolarHBondContact O-N 2.9Å; R62-V65 PolarHBondContact O-N 3.31Å; R62-I66 WeakPolarHBondContact O-CG1 3.48Å; R62-I66 PolarHBondContact O-N 3.48Å
63E94.8Very high90.1Very high104 Ų104111.4 Ų111.449%0.48653%0.525SS..Hα-helixtrans-62-39178.1-74.1173.6177.200112.3K59 R60 I66 K67K59-E63 WeakPolarHBondContact CE-OE1 3.42Å; K59-E63 HydrophobicContact CG-CG 4.49Å; K59-E63 WeakPolarHBondContact O-CG 3.34Å; K59-E63 PolarHBondContact O-N 3.17Å; R60-E63 PolarHBondContact O-N 3.27Å; E63-I66 PolarHBondContact O-N 3.42Å; E63-K67 VanDerWaalsContact O-CB 3.28Å; E63-K67 WeakPolarHBondContact O-CB 3.28Å; E63-K67 PolarHBondContact O-N 2.9Å
64Q94.1Very high90Very high108 Ų108109.7 Ų109.751%0.50551%0.513SS..Hα-helixtrans-63-45.1174.8-76.7176.8-0.400112.2R60 K61 R62 K67 A68R60-Q64 WeakPolarHBondContact O-CG 2.96Å; R60-Q64 PolarHBondContact O-N 3.31Å; K61-Q64 PolarHBondContact O-N 3.48Å; R62-Q64 VanDerWaalsContact C-N 3.32Å; R62-Q64 PolarHBondContact O-N 2.9Å; Q64-K67 PolarHBondContact O-N 2.93Å; Q64-A68 WeakPolarHBondContact O-CB 3.41Å; Q64-A68 PolarHBondContact O-N 3.31Å
65V95Very high89.6Confident75 Ų75108.5 Ų108.546%0.45552%0.517SS..Hα-helixtrans-62.7-45.7177.2173.10000110.8K61 R62 K67 A68 Q69K61-V65 WeakPolarHBondContact O-CG2 3.33Å; K61-V65 PolarHBondContact O-N 3.48Å; K61-V65 VanDerWaalsContact O-N 3.14Å; R62-V65 PolarHBondContact O-N 3.31Å; V65-K67 VanDerWaalsContact C-N 3.32Å; V65-K67 PolarHBondContact O-N 3.21Å; V65-A68 PolarHBondContact O-N 3.05Å; V65-Q69 WeakPolarHBondContact O-CG 3.37Å; V65-Q69 PolarHBondContact O-N 3.2Å
66I93.1Very high88.9Confident106 Ų106108.5 Ų108.554%0.54452%0.518SS..Hα-helixtrans-61.8-42.5177.7-69.1161.8000110.7R62 E63 Q69 K70R62-I66 WeakPolarHBondContact O-CG1 3.48Å; R62-I66 PolarHBondContact O-N 3.48Å; E63-I66 PolarHBondContact O-N 3.42Å; I66-Q69 PolarHBondContact O-N 3.28Å; I66-K70 WeakPolarHBondContact O-CB 3.3Å; I66-K70 PolarHBondContact O-N 2.97Å
67K94.4Very high88Confident147 Ų147113 Ų11364%0.63953%0.531SS*.Hα-helixtrans-62.2-46.2177.3-174-177.8175.6-171.50111.2E63 Q64 V65 K70 E71E63-K67 VanDerWaalsContact O-CB 3.28Å; E63-K67 WeakPolarHBondContact O-CB 3.28Å; E63-K67 PolarHBondContact O-N 2.9Å; Q64-K67 PolarHBondContact O-N 2.93Å; V65-K67 VanDerWaalsContact C-N 3.32Å; V65-K67 PolarHBondContact O-N 3.21Å; K67-K70 PolarHBondContact O-N 3.17Å; K67-E71 WeakPolarHBondContact O-CB 3.35Å; K67-E71 PolarHBondContact O-N 3.37Å
68A91.1Very high87.1Confident55 Ų55115.3 Ų115.346%0.45554%0.537SS..Hα-helixtrans-60.5-46.3177.700000111.6Q64 V65 K70 E71 E72Q64-A68 WeakPolarHBondContact O-CB 3.41Å; Q64-A68 PolarHBondContact O-N 3.31Å; V65-A68 PolarHBondContact O-N 3.05Å; A68-K70 VanDerWaalsContact C-N 3.33Å; A68-K70 PolarHBondContact O-N 3.41Å; A68-E71 PolarHBondContact O-N 3.49Å; A68-E72 WeakPolarHBondContact O-CB 3.49Å; A68-E72 PolarHBondContact O-N 3.15Å
69Q89.8Confident86.6Confident104 Ų104115.5 Ų115.549%0.48654%0.535SS..Hα-helixtrans-61.8-40.2175.9-74.2-179-3.400112.5V65 I66 E72 Q73V65-Q69 WeakPolarHBondContact O-CG 3.37Å; V65-Q69 PolarHBondContact O-N 3.2Å; I66-Q69 PolarHBondContact O-N 3.28Å; Q69-E72 PolarHBondContact O-N 3.27Å; Q69-Q73 WeakPolarHBondContact O-CB 3.33Å; Q69-Q73 VanDerWaalsContact O-CG 3.29Å; Q69-Q73 WeakPolarHBondContact O-CG 3.35Å; Q69-Q73 PolarHBondContact O-N 2.94Å
70K88.8Confident86.3Confident141 Ų141112.6 Ų112.661%0.61353%0.531SS*.Hα-helixtrans-67.2-41178.3-170.8178.8179.3-1770111.5I66 K67 A68 Q73 E74I66-K70 WeakPolarHBondContact O-CB 3.3Å; I66-K70 PolarHBondContact O-N 2.97Å; K67-K70 PolarHBondContact O-N 3.17Å; A68-K70 VanDerWaalsContact C-N 3.33Å; A68-K70 PolarHBondContact O-N 3.41Å; K70-Q73 PolarHBondContact O-N 3.46Å; K70-E74 WeakPolarHBondContact O-CB 3.27Å; K70-E74 PolarHBondContact O-N 3.36Å
71E86.9Confident85.9Confident124 Ų124111.6 Ų111.658%0.57954%0.537SS*.Hα-helixtrans-65.2-41.2176.2-174.7170.6-17800111.5K67 A68 E74 A75K67-E71 WeakPolarHBondContact O-CB 3.35Å; K67-E71 PolarHBondContact O-N 3.37Å; A68-E71 PolarHBondContact O-N 3.49Å; E71-E74 PolarHBondContact O-N 3.37Å; E71-A75 WeakPolarHBondContact O-CB 3.49Å; E71-A75 PolarHBondContact O-N 3.08Å
72E83.9Confident85.7Confident118 Ų118110.2 Ų110.255%0.55154%0.537SS*.Hα-helixtrans-59.9-49.4172.1-176.5179.4-172.100111.1A68 Q69 E74 A75 H76A68-E72 WeakPolarHBondContact O-CB 3.49Å; A68-E72 PolarHBondContact O-N 3.15Å; Q69-E72 PolarHBondContact O-N 3.27Å; E72-E74 VanDerWaalsContact C-N 3.3Å; E72-E74 PolarHBondContact O-N 2.86Å; E72-A75 WeakPolarHBondContact O-CB 3.43Å; E72-A75 PolarHBondContact O-N 3.37Å; E72-H76 PolarHBondContact O-CD2 2.89Å; E72-H76 PolarHBondContact O-N 3.38Å; E72-H76 IonicContact OE1-NE2 3.86Å
73Q79.5Confident85.3Confident116 Ų116106.1 Ų106.154%0.54253%0.525SS..Hα-helixtrans-61-37.5176.2-73.6177.511.900112.8Q69 K70 H76 K77Q69-Q73 WeakPolarHBondContact O-CB 3.33Å; Q69-Q73 VanDerWaalsContact O-CG 3.29Å; Q69-Q73 WeakPolarHBondContact O-CG 3.35Å; Q69-Q73 PolarHBondContact O-N 2.94Å; K70-Q73 PolarHBondContact O-N 3.46Å; Q73-H76 PolarHBondContact O-N 3.47Å; Q73-K77 WeakPolarHBondContact O-CG 3.3Å; Q73-K77 PolarHBondContact O-N 2.92Å
74E81.3Confident85Confident88 Ų88104.1 Ų104.141%0.41152%0.517SS..Hα-helixtrans-71.3-37.9177.1-164176.2155.200111.5K70 E71 E72 H76 K77 K78K70-E74 WeakPolarHBondContact O-CB 3.27Å; K70-E74 PolarHBondContact O-N 3.36Å; E71-E74 PolarHBondContact O-N 3.37Å; E72-E74 VanDerWaalsContact C-N 3.3Å; E72-E74 PolarHBondContact O-N 2.86Å; E74-H76 VanDerWaalsContact C-N 3.34Å; E74-K77 PolarHBondContact O-N 3.4Å; E74-K78 HydrophobicContact CG-CD 4.35Å; E74-K78 WeakPolarHBondContact O-CB 3.41Å; E74-K78 VanDerWaalsContact O-CG 3.3Å; E74-K78 WeakPolarHBondContact O-CG 3.33Å; E74-K78 PolarHBondContact O-N 3.39Å; E74-K78 VanDerWaalsContact OE1-CE 3.24Å; E74-K78 WeakPolarHBondContact OE1-CE 3.35Å; E74-K78 IonicContact OE1-NZ 3.1Å; E74-K78 PolarHBondContact OE1-NZ 2.82Å
75A74.8Confident85Confident55 Ų55104 Ų10446%0.45552%0.516SS..Hα-helixtrans-61.9-42.3170.900000111.1E71 E72 K77 K78 R79E71-A75 WeakPolarHBondContact O-CB 3.49Å; E71-A75 PolarHBondContact O-N 3.08Å; E72-A75 WeakPolarHBondContact O-CB 3.43Å; E72-A75 PolarHBondContact O-N 3.37Å; A75-K77 VanDerWaalsContact C-N 3.34Å; A75-K77 PolarHBondContact O-N 2.93Å; A75-K78 CarbonylContact O-C 3.54Å; A75-K78 PolarHBondContact O-N 3Å; A75-R79 WeakPolarHBondContact O-CG 3.42Å; A75-R79 PolarHBondContact O-N 3.33Å; A75-R79 VanDerWaalsContact O-N 3.17Å
76H69.8Low85Confident82 Ų82105.3 Ų105.338%0.3852%0.52SS..Hα-helixtrans-60.1-40.3172.9-80.9-75.8000112.9E72 Q73 E74 K78 R79E72-H76 PolarHBondContact O-CD2 2.89Å; E72-H76 PolarHBondContact O-N 3.38Å; E72-H76 IonicContact OE1-NE2 3.86Å; Q73-H76 PolarHBondContact O-N 3.47Å; E74-H76 VanDerWaalsContact C-N 3.34Å; H76-K78 VanDerWaalsContact C-N 3.35Å; H76-R79 PolarHBondContact CE1-NH2 3.5Å; H76-R79 PolarHBondContact ND1-NE 2.86Å; H76-R79 PolarHBondContact ND1-NH1 3.24Å; H76-R79 PolarHBondContact ND1-NH2 3.2Å; H76-R79 WeakPolarHBondContact O-CB 3.44Å; H76-R79 WeakPolarHBondContact O-CG 3.34Å; H76-R79 PolarHBondContact O-N 3.45Å
77K72.4Confident85Confident179 Ų179103.5 Ų103.578%0.77851%0.51SS*.Hα-helixtrans-71.5-28.9176.3-72.7177.1-176.7-174.50113.2Q73 E74 A75 R79Q73-K77 WeakPolarHBondContact O-CG 3.3Å; Q73-K77 PolarHBondContact O-N 2.92Å; E74-K77 PolarHBondContact O-N 3.4Å; A75-K77 VanDerWaalsContact C-N 3.34Å; A75-K77 PolarHBondContact O-N 2.93Å; K77-R79 VanDerWaalsContact C-N 3.29Å
78K73.4Confident85Confident150 Ų150101.8 Ų101.865%0.65250%0.503SS*.THydrogen-bonded Turntrans-83.7-0.5176.2-71.8175.1-176.9167.90113.3E74 A75 H76 S80E74-K78 HydrophobicContact CG-CD 4.35Å; E74-K78 WeakPolarHBondContact O-CB 3.41Å; E74-K78 VanDerWaalsContact O-CG 3.3Å; E74-K78 WeakPolarHBondContact O-CG 3.33Å; E74-K78 PolarHBondContact O-N 3.39Å; E74-K78 VanDerWaalsContact OE1-CE 3.24Å; E74-K78 WeakPolarHBondContact OE1-CE 3.35Å; E74-K78 IonicContact OE1-NZ 3.1Å; E74-K78 PolarHBondContact OE1-NZ 2.82Å; A75-K78 CarbonylContact O-C 3.54Å; A75-K78 PolarHBondContact O-N 3Å; H76-K78 VanDerWaalsContact C-N 3.35Å; K78-S80 PolarHBondContact O-N 2.93Å
79R78.8Confident85.3Confident64 Ų64107.4 Ų107.424%0.24251%0.512CS..  trans-59.7137.1174.7-69.2-174.8180-170.4-4.9109.8A75 H76 K77 E83 I84 M87A75-R79 WeakPolarHBondContact O-CG 3.42Å; A75-R79 PolarHBondContact O-N 3.33Å; A75-R79 VanDerWaalsContact O-N 3.17Å; H76-R79 PolarHBondContact CE1-NH2 3.5Å; H76-R79 PolarHBondContact ND1-NE 2.86Å; H76-R79 PolarHBondContact ND1-NH1 3.24Å; H76-R79 PolarHBondContact ND1-NH2 3.2Å; H76-R79 WeakPolarHBondContact O-CB 3.44Å; H76-R79 WeakPolarHBondContact O-CG 3.34Å; H76-R79 PolarHBondContact O-N 3.45Å; K77-R79 VanDerWaalsContact C-N 3.29Å; R79-E83 HydrophobicContact CB-CB 4.43Å; R79-E83 HydrophobicContact CB-CG 4.49Å; R79-E83 WeakPolarHBondContact CD-OE1 3.47Å; R79-E83 WeakPolarHBondContact CG-OE1 3.36Å; R79-E83 IonicContact NE-OE1 2.6Å; R79-I84 HydrophobicContact CB-CG1 4.17Å; R79-M87 PolarHBondContact NH1-SD 2.85Å
80S84.4Confident85.5Confident70 Ų70107.6 Ų107.649%0.4951%0.513SS..  trans-64.8148.4176.8176.30000110.2K78 L82 E83 I84K78-S80 PolarHBondContact O-N 2.93Å; S80-L82 PolarHBondContact O-N 3.46Å; S80-L82 VanDerWaalsContact O-N 3.12Å; S80-L82 PolarHBondContact OG-N 2.67Å; S80-E83 WeakPolarHBondContact O-CA 3.47Å; S80-E83 WeakPolarHBondContact O-CB 3.3Å; S80-E83 PolarHBondContact O-N 3.45Å; S80-I84 PolarHBondContact O-N 3.11Å
81D87.7Confident85.9Confident137 Ų137106 Ų10673%0.73351%0.508SS*.Hα-helixtrans-51.4-36.6173.5-68.3-19.1000111.8I84 E85D81-I84 PolarHBondContact O-N 2.93Å; D81-E85 PolarHBondContact O-N 3.47Å
82L91.4Very high86.4Confident120 Ų120106.8 Ų106.863%0.62851%0.509SS*.Hα-helixtrans-64.4-41.4174.6177.663.4000112.6S80 I84 E85 L86S80-L82 PolarHBondContact O-N 3.46Å; S80-L82 VanDerWaalsContact O-N 3.12Å; S80-L82 PolarHBondContact OG-N 2.67Å; L82-I84 VanDerWaalsContact C-N 3.34Å; L82-E85 PolarHBondContact O-N 3.11Å; L82-L86 HydrophobicContact CD1-CG 4.41Å; L82-L86 HydrophobicContact CG-CD1 4.28Å; L82-L86 WeakPolarHBondContact O-CB 3.31Å; L82-L86 WeakPolarHBondContact O-CG 3.45Å; L82-L86 PolarHBondContact O-N 3.21Å
83E86.6Confident87Confident86 Ų86105.5 Ų105.540%0.40251%0.506SS..Hα-helixtrans-67.3-38.4179.6-170.6-174.3162.400111.1R79 S80 L86 M87R79-E83 HydrophobicContact CB-CB 4.43Å; R79-E83 HydrophobicContact CB-CG 4.49Å; R79-E83 WeakPolarHBondContact CD-OE1 3.47Å; R79-E83 WeakPolarHBondContact CG-OE1 3.36Å; R79-E83 IonicContact NE-OE1 2.6Å; S80-E83 WeakPolarHBondContact O-CA 3.47Å; S80-E83 WeakPolarHBondContact O-CB 3.3Å; S80-E83 PolarHBondContact O-N 3.45Å; E83-L86 PolarHBondContact O-N 3.39Å; E83-M87 PolarHBondContact O-N 3.36Å
84I88.5Confident87.7Confident61 Ų61104.9 Ų104.931%0.31350%0.503SS..Hα-helixtrans-61.7-45.4173.3-66.4163000110.3R79 S80 D81 L82 M87 K88R79-I84 HydrophobicContact CB-CG1 4.17Å; S80-I84 PolarHBondContact O-N 3.11Å; D81-I84 PolarHBondContact O-N 2.93Å; L82-I84 VanDerWaalsContact C-N 3.34Å; I84-M87 PolarHBondContact O-N 2.84Å; I84-K88 HydrophobicContact CG2-CD 4.49Å; I84-K88 WeakPolarHBondContact O-CG 3.29Å; I84-K88 PolarHBondContact O-N 2.91Å
85E94.4Very high88.5Confident107 Ų107106.9 Ų106.950%0.551%0.512SS..Hα-helixtrans-69.5-36.8-179.1-158.859.2-15100112.5D81 L82 K88 R89D81-E85 PolarHBondContact O-N 3.47Å; L82-E85 PolarHBondContact O-N 3.11Å; E85-K88 PolarHBondContact O-N 3.43Å; E85-K88 WeakPolarHBondContact OE2-CD 3.42Å; E85-K88 IonicContact OE2-NZ 3.08Å; E85-K88 PolarHBondContact OE2-NZ 3.21Å; E85-K88 VanDerWaalsContact OE2-NZ 3.1Å; E85-R89 WeakPolarHBondContact O-CB 3.42Å; E85-R89 PolarHBondContact O-N 3.03Å
86L94.8Very high89.4Confident102 Ų102108.1 Ų108.153%0.53451%0.511SS..Hα-helixtrans-60.9-44.7171.6-74.5174.1000111.8L82 E83 R89 Q90L82-L86 HydrophobicContact CD1-CG 4.41Å; L82-L86 HydrophobicContact CG-CD1 4.28Å; L82-L86 WeakPolarHBondContact O-CB 3.31Å; L82-L86 WeakPolarHBondContact O-CG 3.45Å; L82-L86 PolarHBondContact O-N 3.21Å; E83-L86 PolarHBondContact O-N 3.39Å; L86-R89 PolarHBondContact O-N 3.24Å; L86-Q90 PolarHBondContact O-N 3.36Å
87M91.4Very high90.6Very high68 Ų68109.6 Ų109.634%0.33552%0.518SS..Hα-helixtrans-61.3-44.9174.6-95.4-155-51.100112.4R79 E83 I84 R89 Q90 Q91R79-M87 PolarHBondContact NH1-SD 2.85Å; E83-M87 PolarHBondContact O-N 3.36Å; I84-M87 PolarHBondContact O-N 2.84Å; M87-R89 VanDerWaalsContact C-N 3.29Å; M87-R89 PolarHBondContact O-N 3.08Å; M87-Q90 WeakPolarHBondContact O-CB 3.46Å; M87-Q90 PolarHBondContact O-N 3.42Å; M87-Q91 WeakPolarHBondContact O-CG 3.34Å; M87-Q91 PolarHBondContact O-N 2.78Å
88K95.3Very high91.8Very high110 Ų110105.4 Ų105.448%0.47850%0.503SS..Hα-helixtrans-60.2-42.8177-73.3174.3-171.5164.50111.3I84 E85 Q90 Q91 K92I84-K88 HydrophobicContact CG2-CD 4.49Å; I84-K88 WeakPolarHBondContact O-CG 3.29Å; I84-K88 PolarHBondContact O-N 2.91Å; E85-K88 PolarHBondContact O-N 3.43Å; E85-K88 WeakPolarHBondContact OE2-CD 3.42Å; E85-K88 IonicContact OE2-NZ 3.08Å; E85-K88 PolarHBondContact OE2-NZ 3.21Å; E85-K88 VanDerWaalsContact OE2-NZ 3.1Å; K88-Q90 VanDerWaalsContact C-N 3.34Å; K88-Q91 PolarHBondContact O-N 2.72Å; K88-K92 WeakPolarHBondContact O-CB 3.42Å; K88-K92 PolarHBondContact O-N 3Å
89R96.4Very high92.7Very high173 Ų173103.7 Ų103.765%0.65350%0.498SS*.Hα-helixtrans-61.8-43.9176.3-174.8176.3-179.2177.8-0.1111.1E85 L86 M87 K92 L93E85-R89 WeakPolarHBondContact O-CB 3.42Å; E85-R89 PolarHBondContact O-N 3.03Å; L86-R89 PolarHBondContact O-N 3.24Å; M87-R89 VanDerWaalsContact C-N 3.29Å; M87-R89 PolarHBondContact O-N 3.08Å; R89-K92 PolarHBondContact O-N 3.25Å; R89-L93 HydrophobicContact CG-CD1 4.46Å; R89-L93 WeakPolarHBondContact O-CG 3.09Å; R89-L93 PolarHBondContact O-N 3.47Å
90Q95.8Very high93.4Very high108 Ų108105.9 Ų105.951%0.50551%0.511SS..Hα-helixtrans-59.8-50.4175.8-178.8179.71.900111.6L86 M87 K88 K92 L93 E94L86-Q90 PolarHBondContact O-N 3.36Å; M87-Q90 WeakPolarHBondContact O-CB 3.46Å; M87-Q90 PolarHBondContact O-N 3.42Å; K88-Q90 VanDerWaalsContact C-N 3.34Å; Q90-K92 PolarHBondContact O-N 2.86Å; Q90-L93 WeakPolarHBondContact O-CB 3.22Å; Q90-L93 PolarHBondContact O-N 3.37Å; Q90-E94 PolarHBondContact NE2-OE1 2.92Å; Q90-E94 PolarHBondContact O-N 2.78Å
91Q95.8Very high93.7Very high108 Ų108108 Ų10851%0.50551%0.513SS..Hα-helixtrans-57.7-38.3178-74.4-179.5-12.600112.5M87 K88 E94 Q95M87-Q91 WeakPolarHBondContact O-CG 3.34Å; M87-Q91 PolarHBondContact O-N 2.78Å; K88-Q91 PolarHBondContact O-N 2.72Å; Q91-E94 PolarHBondContact O-N 3.03Å; Q91-Q95 WeakPolarHBondContact O-CG 3.45Å; Q91-Q95 PolarHBondContact O-N 2.81Å
92K97.2Very high94Very high141 Ų141107 Ų10761%0.61350%0.502SS*.Hα-helixtrans-65.4-40.2176.2-170.3176-173.4177.50112K88 R89 Q90 L96K88-K92 WeakPolarHBondContact O-CB 3.42Å; K88-K92 PolarHBondContact O-N 3Å; R89-K92 PolarHBondContact O-N 3.25Å; Q90-K92 PolarHBondContact O-N 2.86Å; K92-L96 WeakPolarHBondContact O-CG 3.46Å; K92-L96 PolarHBondContact O-N 2.74Å; K92-L96 VanDerWaalsContact O-N 3.14Å
93L96.6Very high93.9Very high91 Ų91104.9 Ų104.948%0.47649%0.491SS..Hα-helixtrans-65.9-45.2176.3-68.9171.8000111.2R89 Q90 Q95 L96 E97R89-L93 HydrophobicContact CG-CD1 4.46Å; R89-L93 WeakPolarHBondContact O-CG 3.09Å; R89-L93 PolarHBondContact O-N 3.47Å; Q90-L93 WeakPolarHBondContact O-CB 3.22Å; Q90-L93 PolarHBondContact O-N 3.37Å; L93-Q95 VanDerWaalsContact C-N 3.3Å; L93-Q95 PolarHBondContact O-N 3.44Å; L93-L96 PolarHBondContact O-N 3.12Å; L93-L96 VanDerWaalsContact O-N 3.13Å; L93-E97 PolarHBondContact O-N 3.14Å
94E95.9Very high93.9Very high102 Ų102106.1 Ų106.148%0.47750%0.496SS..Hα-helixtrans-59.3-40176.6-73.3173.2-171.500112.1Q90 Q91 E97 L98Q90-E94 PolarHBondContact NE2-OE1 2.92Å; Q90-E94 PolarHBondContact O-N 2.78Å; Q91-E94 PolarHBondContact O-N 3.03Å; E94-E97 PolarHBondContact O-N 2.8Å; E94-L98 WeakPolarHBondContact O-CB 3.22Å; E94-L98 PolarHBondContact O-N 3Å
95Q96.1Very high93.9Very high130 Ų130109.2 Ų109.261%0.60751%0.51SS*.Hα-helixtrans-63.6-42.6174.7-75174.719.900112.5Q91 L93 L98 E99Q91-Q95 WeakPolarHBondContact O-CG 3.45Å; Q91-Q95 PolarHBondContact O-N 2.81Å; L93-Q95 VanDerWaalsContact C-N 3.3Å; L93-Q95 PolarHBondContact O-N 3.44Å; Q95-L98 PolarHBondContact O-N 3.2Å; Q95-E99 WeakPolarHBondContact O-CB 2.82Å; Q95-E99 PolarHBondContact O-N 3.27Å
96L95.6Very high93.4Very high81 Ų81110.3 Ų110.342%0.42452%0.515SS..Hα-helixtrans-67.6-35.8177.9-72170.9000112.3K92 L93 Q100K92-L96 WeakPolarHBondContact O-CG 3.46Å; K92-L96 PolarHBondContact O-N 2.74Å; K92-L96 VanDerWaalsContact O-N 3.14Å; L93-L96 PolarHBondContact O-N 3.12Å; L93-L96 VanDerWaalsContact O-N 3.13Å; L96-Q100 WeakPolarHBondContact O-CB 3.44Å; L96-Q100 WeakPolarHBondContact O-CG 3.48Å; L96-Q100 PolarHBondContact O-N 2.81Å; L96-Q100 PolarHBondContact O-NE2 3.35Å
97E94.9Very high92.6Very high113 Ų113111.4 Ų111.453%0.52852%0.517SS..Hα-helixtrans-65.3-45173.1-75.5-179.4-178.700111L93 E94 E99 Q100 Q101L93-E97 PolarHBondContact O-N 3.14Å; E94-E97 PolarHBondContact O-N 2.8Å; E97-E99 VanDerWaalsContact C-N 3.35Å; E97-E99 PolarHBondContact O-N 3.29Å; E97-Q100 PolarHBondContact O-N 3.5Å; E97-Q101 WeakPolarHBondContact O-CG 3.47Å; E97-Q101 PolarHBondContact O-N 3.16Å
98L95.8Very high92.1Very high91 Ų91115.5 Ų115.548%0.47654%0.535SS..Hα-helixtrans-64.1-40.2177.5-171.867.8000112E94 Q95 Q101 K102E94-L98 WeakPolarHBondContact O-CB 3.22Å; E94-L98 PolarHBondContact O-N 3Å; Q95-L98 PolarHBondContact O-N 3.2Å; L98-Q101 PolarHBondContact O-N 3.42Å; L98-K102 WeakPolarHBondContact O-CG 3.28Å; L98-K102 PolarHBondContact O-N 2.96Å
99E93.7Very high91.5Very high115 Ų115116.6 Ų116.654%0.53755%0.547SS..Hα-helixtrans-65.7-42.1175.7-171.7173.3-162.900111.5Q95 E97 Q101 K102 I103Q95-E99 WeakPolarHBondContact O-CB 2.82Å; Q95-E99 PolarHBondContact O-N 3.27Å; E97-E99 VanDerWaalsContact C-N 3.35Å; E97-E99 PolarHBondContact O-N 3.29Å; E99-Q101 PolarHBondContact O-N 3.06Å; E99-K102 PolarHBondContact O-N 3.41Å; E99-I103 HydrophobicContact CG-CD1 4.06Å; E99-I103 VanDerWaalsContact O-CG1 3.28Å; E99-I103 WeakPolarHBondContact O-CG1 3.48Å; E99-I103 PolarHBondContact O-N 3.37Å
100Q92.5Very high90.8Very high109 Ų109110.9 Ų110.951%0.50953%0.531SS..Hα-helixtrans-61.6-42.8173.4-82.3178.190.400112.4L96 E97 K102 I103 Q104L96-Q100 WeakPolarHBondContact O-CB 3.44Å; L96-Q100 WeakPolarHBondContact O-CG 3.48Å; L96-Q100 PolarHBondContact O-N 2.81Å; L96-Q100 PolarHBondContact O-NE2 3.35Å; E97-Q100 PolarHBondContact O-N 3.5Å; Q100-K102 VanDerWaalsContact C-N 3.34Å; Q100-I103 PolarHBondContact O-N 3.49Å; Q100-Q104 WeakPolarHBondContact O-CB 3.35Å; Q100-Q104 VanDerWaalsContact O-CG 3.3Å; Q100-Q104 WeakPolarHBondContact O-CG 3.27Å; Q100-Q104 PolarHBondContact O-N 2.95Å
101Q91.9Very high90.1Very high114 Ų114108.9 Ų108.953%0.53353%0.527SS..Hα-helixtrans-60.9-44.2175.5-75175.710.800111.4E97 L98 E99 I103 Q104 E105E97-Q101 WeakPolarHBondContact O-CG 3.47Å; E97-Q101 PolarHBondContact O-N 3.16Å; L98-Q101 PolarHBondContact O-N 3.42Å; E99-Q101 PolarHBondContact O-N 3.06Å; Q101-I103 PolarHBondContact O-N 2.83Å; Q101-Q104 PolarHBondContact O-N 3.48Å; Q101-E105 WeakPolarHBondContact O-CB 3.31Å; Q101-E105 PolarHBondContact O-N 2.88Å
102K92.8Very high89.3Confident116 Ų116111 Ų11150%0.50454%0.537SS..Hα-helixtrans-61.1-43.9175.2-74.8177.2-179.9-177.10112.4L98 E99 Q100 Q104 E105 E106L98-K102 WeakPolarHBondContact O-CG 3.28Å; L98-K102 PolarHBondContact O-N 2.96Å; E99-K102 PolarHBondContact O-N 3.41Å; Q100-K102 VanDerWaalsContact C-N 3.34Å; K102-Q104 VanDerWaalsContact C-N 3.3Å; K102-Q104 PolarHBondContact O-N 3.13Å; K102-E105 PolarHBondContact O-N 3.35Å; K102-E106 WeakPolarHBondContact O-CB 3.46Å; K102-E106 WeakPolarHBondContact O-CG 3.31Å; K102-E106 PolarHBondContact O-N 3.42Å
103I89.4Confident88.4Confident77 Ų77111.7 Ų111.740%0.39554%0.541SS..Hα-helixtrans-63.2-39.6177.2-70164.3000110.8E99 Q100 Q101 Q107E99-I103 HydrophobicContact CG-CD1 4.06Å; E99-I103 VanDerWaalsContact O-CG1 3.28Å; E99-I103 WeakPolarHBondContact O-CG1 3.48Å; E99-I103 PolarHBondContact O-N 3.37Å; Q100-I103 PolarHBondContact O-N 3.49Å; Q101-I103 PolarHBondContact O-N 2.83Å; I103-Q107 WeakPolarHBondContact O-CB 3.41Å; I103-Q107 VanDerWaalsContact O-CG 3.3Å; I103-Q107 WeakPolarHBondContact O-CG 3.27Å; I103-Q107 PolarHBondContact O-N 2.89Å
104Q87Confident87.6Confident111 Ų111110.7 Ų110.752%0.51954%0.538SS..Hα-helixtrans-65.4-46.6175.8-73.61731500111.2Q100 Q101 K102 E106 Q107 E108Q100-Q104 WeakPolarHBondContact O-CB 3.35Å; Q100-Q104 VanDerWaalsContact O-CG 3.3Å; Q100-Q104 WeakPolarHBondContact O-CG 3.27Å; Q100-Q104 PolarHBondContact O-N 2.95Å; Q101-Q104 PolarHBondContact O-N 3.48Å; K102-Q104 VanDerWaalsContact C-N 3.3Å; K102-Q104 PolarHBondContact O-N 3.13Å; Q104-E106 PolarHBondContact O-N 3.13Å; Q104-Q107 WeakPolarHBondContact O-CB 3.44Å; Q104-Q107 PolarHBondContact O-N 2.93Å; Q104-E108 WeakPolarHBondContact O-CG 3.46Å; Q104-E108 PolarHBondContact O-N 2.99Å
105E88.3Confident86.6Confident127 Ų127110 Ų11059%0.59353%0.533SS*.Hα-helixtrans-61.8-43.9176.9-172.2-178.4179.400111.8Q101 K102 Q107 E108 N109Q101-E105 WeakPolarHBondContact O-CB 3.31Å; Q101-E105 PolarHBondContact O-N 2.88Å; K102-E105 PolarHBondContact O-N 3.35Å; E105-Q107 VanDerWaalsContact C-N 3.34Å; E105-Q107 PolarHBondContact O-N 3.36Å; E105-E108 PolarHBondContact O-N 2.97Å; E105-N109 VanDerWaalsContact O-CB 3.22Å; E105-N109 WeakPolarHBondContact O-CB 3.4Å; E105-N109 PolarHBondContact O-N 3.41Å
106E84.9Confident85.6Confident130 Ų130110.4 Ų110.461%0.60754%0.537SS*.Hα-helixtrans-62.3-40.3174.2-77.4179.9-175.700111.8K102 Q104 N109 T110K102-E106 WeakPolarHBondContact O-CB 3.46Å; K102-E106 WeakPolarHBondContact O-CG 3.31Å; K102-E106 PolarHBondContact O-N 3.42Å; Q104-E106 PolarHBondContact O-N 3.13Å; E106-N109 PolarHBondContact O-N 3.27Å; E106-T110 WeakPolarHBondContact O-CB 3.48Å; E106-T110 PolarHBondContact O-N 3.43Å; E106-T110 PolarHBondContact O-OG1 2.99Å
107Q77.8Confident84.5Confident125 Ų125114.2 Ų114.258%0.58455%0.55SS**Hα-helixtrans-64.4-42.3173.9-80.6-173.95600111.6I103 Q104 E105 T110 K115I103-Q107 WeakPolarHBondContact O-CB 3.41Å; I103-Q107 VanDerWaalsContact O-CG 3.3Å; I103-Q107 WeakPolarHBondContact O-CG 3.27Å; I103-Q107 PolarHBondContact O-N 2.89Å; Q104-Q107 WeakPolarHBondContact O-CB 3.44Å; Q104-Q107 PolarHBondContact O-N 2.93Å; E105-Q107 VanDerWaalsContact C-N 3.34Å; E105-Q107 PolarHBondContact O-N 3.36Å; Q107-T110 PolarHBondContact O-N 2.94Å; Q107-K115 WeakPolarHBondContact O-CE 3.28Å; Q107-K115 PolarHBondContact O-NZ 3.25Å
108E80.3Confident83.2Confident154 Ų154110.3 Ų110.372%0.7254%0.54SS*.Hα-helixtrans-63.4-45176.3-73.9-176.9175.400111.4Q104 E105 T110 K115Q104-E108 WeakPolarHBondContact O-CG 3.46Å; Q104-E108 PolarHBondContact O-N 2.99Å; E105-E108 PolarHBondContact O-N 2.97Å; E108-T110 VanDerWaalsContact C-N 3.29Å; E108-T110 PolarHBondContact O-N 3.21Å; E108-K115 PolarHBondContact O-NZ 3.31Å; E108-K115 VanDerWaalsContact O-NZ 3.14Å
109N82.4Confident82Confident133 Ų133109.9 Ų109.971%0.71154%0.538SS*.Hα-helixtrans-75.6-13.3-178.3-155.8-6.2000113.6E105 E106E105-N109 VanDerWaalsContact O-CB 3.22Å; E105-N109 WeakPolarHBondContact O-CB 3.4Å; E105-N109 PolarHBondContact O-N 3.41Å; E106-N109 PolarHBondContact O-N 3.27Å
110T81.2Confident80.8Confident52 Ų52110.4 Ų110.432%0.31954%0.544SS..SBendtrans-66.1129.4174.7-63.80000110.4E106 Q107 E108 V114 K115E106-T110 WeakPolarHBondContact O-CB 3.48Å; E106-T110 PolarHBondContact O-N 3.43Å; E106-T110 PolarHBondContact O-OG1 2.99Å; Q107-T110 PolarHBondContact O-N 2.94Å; E108-T110 VanDerWaalsContact C-N 3.29Å; E108-T110 PolarHBondContact O-N 3.21Å; T110-V114 HydrophobicContact CG2-CB 3.91Å; T110-V114 HydrophobicContact CG2-CG1 3.99Å; T110-K115 HydrophobicContact CG2-CG 4.4Å; T110-K115 WeakPolarHBondContact O-CE 3.45Å; T110-K115 PolarHBondContact O-NZ 3.34Å; T110-K115 VanDerWaalsContact O-NZ 3.12Å
111P82.8Confident79.6Confident67 Ų67113.7 Ų113.744%0.43555%0.552SS.*  trans-58.3142.2-179.9-24.232.3000113.5F113 V114 K115P111-F113 VanDerWaalsContact C-N 3.29Å; P111-F113 HydrophobicContact CB-CD1 3.61Å; P111-F113 HydrophobicContact CB-CE1 3.26Å; P111-F113 HydrophobicContact CB-CZ 4Å; P111-F113 HydrophobicContact CG-CE1 3.98Å; P111-F113 HydrophobicContact CG-CZ 4.37Å; P111-F113 PolarHBondContact O-N 3.46Å; P111-V114 HydrophobicContact CB-CG2 4.41Å; P111-V114 WeakPolarHBondContact O-CB 3.28Å; P111-V114 PolarHBondContact O-N 3.46Å; P111-K115 PolarHBondContact O-N 2.91Å
112E78.9Confident78.4Confident153 Ų153115.6 Ų115.672%0.71555%0.554SS**Hα-helixtrans-59.4-34.4-174.1-64.8-167164.500114.4V114 K115 M116E112-V114 PolarHBondContact O-N 3.3Å; E112-K115 WeakPolarHBondContact O-CB 3.27Å; E112-K115 PolarHBondContact O-N 3.11Å; E112-K115 VanDerWaalsContact O-N 3.11Å; E112-M116 WeakPolarHBondContact O-CG 3.38Å; E112-M116 PolarHBondContact O-N 3.44Å
113F77.7Confident76.9Confident155 Ų155113.6 Ų113.668%0.6855%0.551SS**Hα-helixtrans-64.1-28.5178.870.2-94000112.5P111 K117P111-F113 VanDerWaalsContact C-N 3.29Å; P111-F113 HydrophobicContact CB-CD1 3.61Å; P111-F113 HydrophobicContact CB-CE1 3.26Å; P111-F113 HydrophobicContact CB-CZ 4Å; P111-F113 HydrophobicContact CG-CE1 3.98Å; P111-F113 HydrophobicContact CG-CZ 4.37Å; P111-F113 PolarHBondContact O-N 3.46Å; F113-K117 WeakPolarHBondContact O-CB 3.31Å; F113-K117 PolarHBondContact O-N 2.6Å; F113-K117 VanDerWaalsContact O-N 3.11Å
114V78.9Confident75.7Confident69 Ų69117.9 Ų117.942%0.41857%0.567SS.*Hα-helixtrans-73-41.4174.3-177.70000110.2T110 P111 E112 K117 G118T110-V114 HydrophobicContact CG2-CB 3.91Å; T110-V114 HydrophobicContact CG2-CG1 3.99Å; P111-V114 HydrophobicContact CB-CG2 4.41Å; P111-V114 WeakPolarHBondContact O-CB 3.28Å; P111-V114 PolarHBondContact O-N 3.46Å; E112-V114 PolarHBondContact O-N 3.3Å; V114-K117 PolarHBondContact O-N 2.79Å; V114-G118 PolarHBondContact O-N 3.34Å
115K76.1Confident74.5Confident89 Ų89118.8 Ų118.839%0.38757%0.571SS.*Hα-helixtrans-60.6-44.6175.2-61.8176177.2163.30111.3Q107 E108 T110 P111 E112 G118Q107-K115 WeakPolarHBondContact O-CE 3.28Å; Q107-K115 PolarHBondContact O-NZ 3.25Å; E108-K115 PolarHBondContact O-NZ 3.31Å; E108-K115 VanDerWaalsContact O-NZ 3.14Å; T110-K115 HydrophobicContact CG2-CG 4.4Å; T110-K115 WeakPolarHBondContact O-CE 3.45Å; T110-K115 PolarHBondContact O-NZ 3.34Å; T110-K115 VanDerWaalsContact O-NZ 3.12Å; P111-K115 PolarHBondContact O-N 2.91Å; E112-K115 WeakPolarHBondContact O-CB 3.27Å; E112-K115 PolarHBondContact O-N 3.11Å; E112-K115 VanDerWaalsContact O-N 3.11Å; K115-G118 PolarHBondContact O-N 2.91Å
116M75.3Confident73.1Confident137 Ų137119.5 Ų119.568%0.67558%0.575SS**Hα-helixtrans-68.8-34.1178.9-70.4-115.5-86.300113.3E112 G118 N119 L120E112-M116 WeakPolarHBondContact O-CG 3.38Å; E112-M116 PolarHBondContact O-N 3.44Å; M116-G118 VanDerWaalsContact C-N 3.31Å; M116-G118 PolarHBondContact O-N 3.08Å; M116-N119 PolarHBondContact O-N 3.47Å; M116-L120 PolarHBondContact O-N 3.19Å
117K71.3Confident71.8Confident162 Ų162116 Ų11670%0.70457%0.568SS**Hα-helixtrans-61.7-37.3176.8-171.6-175.1-179.7-176.30112.5F113 V114 R121F113-K117 WeakPolarHBondContact O-CB 3.31Å; F113-K117 PolarHBondContact O-N 2.6Å; F113-K117 VanDerWaalsContact O-N 3.11Å; V114-K117 PolarHBondContact O-N 2.79Å; K117-R121 PolarHBondContact O-N 2.94Å; K117-R121 VanDerWaalsContact O-N 3.15Å
118G68.1Low70.7Confident30 Ų30111.7 Ų111.731%0.30956%0.557SS.*Hα-helixtrans-65.2-39.2175.700000112.8V114 K115 M116 R121 R122V114-G118 PolarHBondContact O-N 3.34Å; K115-G118 PolarHBondContact O-N 2.91Å; M116-G118 VanDerWaalsContact C-N 3.31Å; M116-G118 PolarHBondContact O-N 3.08Å; G118-R121 PolarHBondContact O-N 2.92Å; G118-R122 PolarHBondContact O-N 2.67Å
119N70.9Confident69.4Low83 Ų83106.7 Ų106.744%0.44455%0.547SS..Hα-helixtrans-68.6-41.1177.5-65.2-13.9000111.7M116 R121 R122 T123M116-N119 PolarHBondContact O-N 3.47Å; N119-R121 VanDerWaalsContact C-N 3.28Å; N119-R121 PolarHBondContact O-N 3.13Å; N119-R122 PolarHBondContact O-N 3.31Å; N119-R122 PolarHBondContact OD1-NH2 3.36Å; N119-T123 PolarHBondContact O-N 3.03Å; N119-T123 PolarHBondContact O-OG1 2.89Å
120L68.1Low68Low125 Ų125107.9 Ų107.965%0.65455%0.548SS*.Hα-helixtrans-66.7-28.4177-159.868.2000113M116 T123 K124M116-L120 PolarHBondContact O-N 3.19Å; L120-T123 PolarHBondContact O-OG1 2.87Å; L120-K124 WeakPolarHBondContact O-CB 3.3Å; L120-K124 PolarHBondContact O-N 3.37Å
121R66.8Low66.6Low179 Ų179113.3 Ų113.368%0.67557%0.57SS**Hα-helixtrans-72.3-38.8173.1-172.8178.6178.7-123.50.3112.1K117 G118 N119 Q125K117-R121 PolarHBondContact O-N 2.94Å; K117-R121 VanDerWaalsContact O-N 3.15Å; G118-R121 PolarHBondContact O-N 2.92Å; N119-R121 VanDerWaalsContact C-N 3.28Å; N119-R121 PolarHBondContact O-N 3.13Å; R121-Q125 PolarHBondContact O-N 3.24Å
122R67Low64.9Low154 Ų154118.7 Ų118.758%0.58159%0.59SS**Hα-helixtrans-66.3-47.1177.1-79.4-174.1-84.1-139.61.3111.9G118 N119 K124 Q125 E126G118-R122 PolarHBondContact O-N 2.67Å; N119-R122 PolarHBondContact O-N 3.31Å; N119-R122 PolarHBondContact OD1-NH2 3.36Å; R122-K124 VanDerWaalsContact C-N 3.31Å; R122-K124 PolarHBondContact O-N 3.15Å; R122-Q125 PolarHBondContact O-N 3.28Å; R122-Q125 VanDerWaalsContact O-N 3.08Å; R122-E126 PolarHBondContact O-N 3.08Å; R122-E126 VanDerWaalsContact O-N 3.07Å
123T62.7Low63.4Low74 Ų74115.3 Ų115.345%0.45459%0.588SS.*Hα-helixtrans-64.5-33.9177.656.30000112.8N119 L120 Q125 E126 A127N119-T123 PolarHBondContact O-N 3.03Å; N119-T123 PolarHBondContact O-OG1 2.89Å; L120-T123 PolarHBondContact O-OG1 2.87Å; T123-Q125 VanDerWaalsContact C-N 3.34Å; T123-Q125 PolarHBondContact O-N 2.91Å; T123-E126 PolarHBondContact O-N 3.14Å; T123-A127 VanDerWaalsContact O-CB 3.3Å; T123-A127 WeakPolarHBondContact O-CB 3.48Å; T123-A127 PolarHBondContact O-N 2.81Å
124K63Low61.5Low166 Ų166117.6 Ų117.672%0.72262%0.615SS**Hα-helixtrans-65-33171.9-103.5-165.7173.6-168.10113.9L120 R122 G128L120-K124 WeakPolarHBondContact O-CB 3.3Å; L120-K124 PolarHBondContact O-N 3.37Å; R122-K124 VanDerWaalsContact C-N 3.31Å; R122-K124 PolarHBondContact O-N 3.15Å; K124-G128 PolarHBondContact O-N 3.25Å; K124-G128 VanDerWaalsContact O-N 3.08Å
125Q61.5Low60.6Low130 Ų130120.1 Ų120.161%0.60763%0.625SS**Hα-helixtrans-74.5-37.2176.6-99.5178.2-45.600112.1R121 R122 T123 G129R121-Q125 PolarHBondContact O-N 3.24Å; R122-Q125 PolarHBondContact O-N 3.28Å; R122-Q125 VanDerWaalsContact O-N 3.08Å; T123-Q125 VanDerWaalsContact C-N 3.34Å; T123-Q125 PolarHBondContact O-N 2.91Å; Q125-G129 PolarHBondContact O-N 2.8Å
126E59Low59.8Low143 Ų143121.7 Ų121.767%0.66864%0.637SS**Hα-helixtrans-67.9-43.6173.6-71174.3174.600111.2R122 T123 G128 G129R122-E126 PolarHBondContact O-N 3.08Å; R122-E126 VanDerWaalsContact O-N 3.07Å; T123-E126 PolarHBondContact O-N 3.14Å; E126-G128 PolarHBondContact O-N 2.98Å; E126-G129 PolarHBondContact O-N 2.89Å
127A57.9Low59Low55 Ų55120.8 Ų120.846%0.45564%0.635SS.*Hα-helixtrans-65.5-33.817600000113.7T123 G129T123-A127 VanDerWaalsContact O-CB 3.3Å; T123-A127 WeakPolarHBondContact O-CB 3.48Å; T123-A127 PolarHBondContact O-N 2.81Å; A127-G129 VanDerWaalsContact C-N 3.33Å
128G55Low58.2Low35 Ų35118.4 Ų118.436%0.36163%0.631SS.*Hα-helixtrans-79.1-10.9175.900000114.9K124 E126K124-G128 PolarHBondContact O-N 3.25Å; K124-G128 VanDerWaalsContact O-N 3.08Å; E126-G128 PolarHBondContact O-N 2.98Å
129G53.4Low57.6Low50 Ų50123.9 Ų123.952%0.51565%0.651SS.*Hα-helixtrans-84.4-24.4173.300000113.3Q125 E126 A127Q125-G129 PolarHBondContact O-N 2.8Å; E126-G129 PolarHBondContact O-N 2.89Å; A127-G129 VanDerWaalsContact C-N 3.33Å
130E52.3Low56.7Low157 Ų157126.7 Ų126.773%0.73467%0.665SS**Hα-helixtrans-79.9-24.9177-67.5-175.8160.900112.6Q132E130-Q132 VanDerWaalsContact C-N 3.3Å; E130-Q132 PolarHBondContact O-N 3.36Å
131E52Low55.9Low166 Ų166126.8 Ų126.878%0.77667%0.666SS**THydrogen-bonded Turntrans-75.9-7.1179.4-73-175.716500114.9
132Q47.3Very low55.1Low181 Ų181122.8 Ų122.885%0.84667%0.665SS**THydrogen-bonded Turntrans-104.55.5177.6-68-167.638.800114.4E130E130-Q132 VanDerWaalsContact C-N 3.3Å; E130-Q132 PolarHBondContact O-N 3.36Å
133A46.8Very low54.1Low82 Ų82120.2 Ų120.268%0.67867%0.672SS**  trans-122.853.3-179.700000112.2
134T38.3Very low53.3Low203 Ų203124.4 Ų124.4100%1.24569%0.692SS**  trans-148.10160.637.20000110.6

Retrieved 134 of 134 residues in 26 ms (Link to these results)