A0A077YY70_TRITR Loading...

SUZ domain containing protein

AlphaFold DB , UniProt , Accession A0A077YY70, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 143 aa.

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

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M38.8Very low54Low218 Ų218132.4 Ų132.4100%1.07473%0.729SS**  0106.50-68.5-171.1-64.700106
2I44.5Very low54.3Low176 Ų176132.7 Ų132.790%0.90372%0.722SS**  trans-98.7104.9172.7-62170.8000103.8A4I2-A4 PolarHBondContact O-N 2.69Å
3E50Low54.7Low164 Ų164128.5 Ų128.577%0.76670%0.703SS**  trans-71.9118.2-178.9-63.5175.6-164.600107.7N5E3-N5 PolarHBondContact O-N 2.74Å
4A54.1Low55.1Low103 Ų103127.1 Ų127.185%0.85169%0.693SS**  trans-69.498.3175.200000108.5I2I2-A4 PolarHBondContact O-N 2.69Å
5N53.2Low55.2Low130 Ų130127.3 Ų127.370%0.69569%0.687SS**  trans-123.656.1179.1-164.441.7000111E3E3-N5 PolarHBondContact O-N 2.74Å
6D59.4Low55.4Low129 Ų129124.3 Ų124.369%0.6968%0.679SS**  trans-116.9-1.2-173.1-60.72.7000112.8L10D6-L10 PolarHBondContact O-N 3.38Å
7G56.3Low55.6Low58 Ų58128.2 Ų128.260%0.59868%0.682SS**Hα-helixtrans-67-47.3-179.600000113.2K9 L10 E11G7-K9 VanDerWaalsContact C-N 3.26Å; G7-K9 PolarHBondContact O-N 3.11Å; G7-L10 PolarHBondContact O-N 3.41Å; G7-E11 PolarHBondContact O-N 3.37Å
8S58.5Low55.8Low86 Ų86129.9 Ų129.960%0.60169%0.685SS**Hα-helixtrans-67-28.6-178.2-50.70000113.1E12S8-E12 PolarHBondContact O-N 3.33Å
9K59.2Low56Low151 Ų151130.6 Ų130.666%0.65769%0.689SS**Hα-helixtrans-76.3-26.9-179.2-146175.7-169.8179.90112.2G7 V13G7-K9 VanDerWaalsContact C-N 3.26Å; G7-K9 PolarHBondContact O-N 3.11Å; K9-V13 WeakPolarHBondContact O-CG2 3.21Å; K9-V13 PolarHBondContact O-N 3.01Å
10L60.5Low56.2Low112 Ų112127.9 Ų127.959%0.58669%0.686SS**Hα-helixtrans-74.1-40.1174.9-175.863.3000111.4D6 G7 V13 L14D6-L10 PolarHBondContact O-N 3.38Å; G7-L10 PolarHBondContact O-N 3.41Å; L10-V13 PolarHBondContact O-N 3.3Å; L10-L14 HydrophobicContact CG-CD1 4.33Å; L10-L14 WeakPolarHBondContact O-CG 3.42Å; L10-L14 PolarHBondContact O-N 3.42Å
11E59.8Low56.4Low129 Ų129129.9 Ų129.960%0.60369%0.691SS**Hα-helixtrans-59.9-46.9174.5-115.3177.3-179.300111.3G7 V13 L14 E15G7-E11 PolarHBondContact O-N 3.37Å; E11-V13 VanDerWaalsContact C-N 3.29Å; E11-V13 PolarHBondContact O-N 3.02Å; E11-L14 PolarHBondContact O-N 3.39Å; E11-L14 VanDerWaalsContact O-N 3.09Å; E11-E15 PolarHBondContact O-N 3.07Å
12E57.3Low57.3Low136 Ų136127.4 Ų127.464%0.63668%0.683SS**Hα-helixtrans-60.4-36.6177.7-170.9-178.5-174.600112.7S8S8-E12 PolarHBondContact O-N 3.33Å
13V59.9Low57.9Low79 Ų79121.6 Ų121.648%0.47967%0.666SS.*Hα-helixtrans-68.5-43175.1171.90000110.8K9 L10 E11 S16K9-V13 WeakPolarHBondContact O-CG2 3.21Å; K9-V13 PolarHBondContact O-N 3.01Å; L10-V13 PolarHBondContact O-N 3.3Å; E11-V13 VanDerWaalsContact C-N 3.29Å; E11-V13 PolarHBondContact O-N 3.02Å; V13-S16 WeakPolarHBondContact O-CB 3.45Å; V13-S16 PolarHBondContact O-N 3.32Å
14L59.8Low58.3Low108 Ų108119.6 Ų119.657%0.56567%0.665SS**Hα-helixtrans-64.8-40.7-178.1-72170.9000112.3L10 E11 S16 W17L10-L14 HydrophobicContact CG-CD1 4.33Å; L10-L14 WeakPolarHBondContact O-CG 3.42Å; L10-L14 PolarHBondContact O-N 3.42Å; E11-L14 PolarHBondContact O-N 3.39Å; E11-L14 VanDerWaalsContact O-N 3.09Å; L14-S16 PolarHBondContact O-N 3.49Å; L14-W17 PolarHBondContact O-N 2.92Å; L14-W17 VanDerWaalsContact O-N 3.12Å
15E57.2Low58.7Low130 Ų130118.3 Ų118.361%0.60765%0.646SS**Hα-helixtrans-61-31.9176.5-70.9177.9177.400112E11 W17 E18E11-E15 PolarHBondContact O-N 3.07Å; E15-W17 VanDerWaalsContact C-N 3.28Å; E15-W17 PolarHBondContact O-N 2.92Å; E15-E18 PolarHBondContact O-N 2.88Å
16S58.3Low59.3Low80 Ų80117.8 Ų117.856%0.55965%0.65SS**Hα-helixtrans-69.5-18.5177.3-177.40000114.5V13 L14V13-S16 WeakPolarHBondContact O-CB 3.45Å; V13-S16 PolarHBondContact O-N 3.32Å; L14-S16 PolarHBondContact O-N 3.49Å
17W58.1Low60.2Low190 Ų190113.4 Ų113.472%0.7264%0.636SS**Hα-helixtrans-83.8-28179.4-73.881.4000112.8L14 E15L14-W17 PolarHBondContact O-N 2.92Å; L14-W17 VanDerWaalsContact O-N 3.12Å; E15-W17 VanDerWaalsContact C-N 3.28Å; E15-W17 PolarHBondContact O-N 2.92Å
18E59.8Low61.4Low160 Ų160114.1 Ų114.175%0.74863%0.625SS**Hα-helixtrans-70.4-36.1177.6-69-168.3138.500111.3E15 A20E15-E18 PolarHBondContact O-N 2.88Å; E18-A20 VanDerWaalsContact C-N 3.27Å; E18-A20 PolarHBondContact O-N 2.94Å
19D59.1Low62.7Low142 Ų142115.7 Ų115.776%0.75963%0.627SS**THydrogen-bonded Turntrans-73.6-13.7179.3-76.3-19000114.3Q21D19-Q21 PolarHBondContact O-N 3.48Å
20A60.4Low64.2Low76 Ų76113.1 Ų113.163%0.62862%0.617SS**THydrogen-bonded Turntrans-80.7-11.3-176.900000114.1E18E18-A20 VanDerWaalsContact C-N 3.27Å; E18-A20 PolarHBondContact O-N 2.94Å
21Q59.7Low65.6Low170 Ų170114.6 Ų114.679%0.79462%0.615SS**SBendtrans-92.3-31.7-171.9-65.3-140.9-39.500115.2D19D19-Q21 PolarHBondContact O-N 3.48Å
22D57.4Low67.2Low167 Ų167112.3 Ų112.389%0.89361%0.606SS**SBendtrans-99.4-1.1-166.6-85.5-9.9000115.6
23G57.6Low68.9Low54 Ų54113.5 Ų113.556%0.55761%0.605SS**SBendtrans-108.2-29.6-164.600000118.7
24V59Low70.6Confident121 Ų121114.5 Ų114.573%0.73360%0.604SS**  trans-144.482.6-150.4-161.40000115.2
25T61.8Low72.2Confident76 Ų76113 Ų11347%0.46660%0.602SS.*  -143.387.8121.8270000109.2G27 L28T25-G27 PolarHBondContact O-N 3.34Å; T25-L28 WeakPolarHBondContact O-CB 3.41Å; T25-L28 PolarHBondContact O-N 2.95Å; T25-L28 WeakPolarHBondContact OG1-CB 3.45Å
26P66.6Low74.1Confident120 Ų120112.3 Ų112.378%0.77960%0.602SS**THydrogen-bonded Turntrans-51.5119.7172.4-24.234000109.4
27G77.1Confident75.8Confident37 Ų37115.4 Ų115.438%0.38161%0.605SS.*THydrogen-bonded Turntrans85.99.5-17900000116.1T25 D29 Q30 R31T25-G27 PolarHBondContact O-N 3.34Å; G27-D29 VanDerWaalsContact C-N 3.32Å; G27-Q30 PolarHBondContact O-N 2.95Å; G27-R31 WeakPolarHBondContact O-CG 3.36Å; G27-R31 PolarHBondContact O-N 3.35Å
28L83.2Confident77.6Confident72 Ų72111.6 Ų111.638%0.37760%0.596SS.*Hα-helixtrans-57.3-47.7166.8178.962.6000110.8T25 Q30 R31 I32T25-L28 WeakPolarHBondContact O-CB 3.41Å; T25-L28 PolarHBondContact O-N 2.95Å; T25-L28 WeakPolarHBondContact OG1-CB 3.45Å; L28-Q30 PolarHBondContact O-N 3.4Å; L28-R31 PolarHBondContact O-N 2.93Å; L28-R31 VanDerWaalsContact O-N 3.13Å; L28-I32 HydrophobicContact CD1-CD1 4.09Å; L28-I32 HydrophobicContact CD1-CG1 4.24Å; L28-I32 HydrophobicContact CD2-CD1 4.41Å; L28-I32 HydrophobicContact CG-CD1 3.79Å; L28-I32 HydrophobicContact CG-CG1 4.36Å; L28-I32 VanDerWaalsContact O-CG1 3.31Å; L28-I32 WeakPolarHBondContact O-CG1 3.39Å; L28-I32 PolarHBondContact O-N 3.19Å
29D86Confident79.2Confident119 Ų119109.2 Ų109.264%0.63659%0.588SS**Hα-helixtrans-59.6-36.5176.2-63.3-34.4000112.3G27 I32 R33G27-D29 VanDerWaalsContact C-N 3.32Å; D29-I32 PolarHBondContact O-N 3.46Å; D29-R33 WeakPolarHBondContact O-CB 3.45Å; D29-R33 VanDerWaalsContact O-CG 3.3Å; D29-R33 WeakPolarHBondContact O-CG 3.5Å; D29-R33 PolarHBondContact O-N 3.47Å
30Q90Very high80.9Confident98 Ų98106.7 Ų106.746%0.45857%0.571SS.*Hα-helixtrans-66.2-45.5176.2-174.758.533.900111.5G27 L28 I32 R33 E34G27-Q30 PolarHBondContact O-N 2.95Å; L28-Q30 PolarHBondContact O-N 3.4Å; Q30-I32 VanDerWaalsContact C-N 3.35Å; Q30-R33 PolarHBondContact O-N 2.92Å; Q30-E34 WeakPolarHBondContact O-CB 3.45Å; Q30-E34 PolarHBondContact O-N 3.37Å
31R90.6Very high82.4Confident142 Ų142108 Ų10854%0.53657%0.565SS.*Hα-helixtrans-63.6-39.2175.7-71.7-174.4-66167.40.7112G27 L28 E34 C35G27-R31 WeakPolarHBondContact O-CG 3.36Å; G27-R31 PolarHBondContact O-N 3.35Å; L28-R31 PolarHBondContact O-N 2.93Å; L28-R31 VanDerWaalsContact O-N 3.13Å; R31-E34 PolarHBondContact O-N 3.47Å; R31-C35 VanDerWaalsContact O-CB 3.27Å; R31-C35 WeakPolarHBondContact O-CB 3.43Å; R31-C35 PolarHBondContact O-N 2.88Å
32I92.7Very high84Confident81 Ų81102.3 Ų102.342%0.41555%0.547SS..Hα-helixtrans-62.3-48.1174.8-69.6169.5000109.9L28 D29 Q30 E34 C35 L36L28-I32 HydrophobicContact CD1-CD1 4.09Å; L28-I32 HydrophobicContact CD1-CG1 4.24Å; L28-I32 HydrophobicContact CD2-CD1 4.41Å; L28-I32 HydrophobicContact CG-CD1 3.79Å; L28-I32 HydrophobicContact CG-CG1 4.36Å; L28-I32 VanDerWaalsContact O-CG1 3.31Å; L28-I32 WeakPolarHBondContact O-CG1 3.39Å; L28-I32 PolarHBondContact O-N 3.19Å; D29-I32 PolarHBondContact O-N 3.46Å; Q30-I32 VanDerWaalsContact C-N 3.35Å; I32-E34 VanDerWaalsContact C-N 3.34Å; I32-E34 PolarHBondContact O-N 3.49Å; I32-C35 PolarHBondContact O-N 2.88Å; I32-L36 HydrophobicContact CG2-CD1 4.12Å; I32-L36 WeakPolarHBondContact O-CG 3.48Å; I32-L36 PolarHBondContact O-N 3.43Å
33R92.9Very high85.7Confident161 Ų161101.4 Ų101.461%0.60853%0.531SS*.Hα-helixtrans-60.9-41.6177.4-74.9-171-60.8-161.82.5112.6D29 Q30 K37D29-R33 WeakPolarHBondContact O-CB 3.45Å; D29-R33 VanDerWaalsContact O-CG 3.3Å; D29-R33 WeakPolarHBondContact O-CG 3.5Å; D29-R33 PolarHBondContact O-N 3.47Å; Q30-R33 PolarHBondContact O-N 2.92Å; R33-K37 WeakPolarHBondContact O-CB 3.41Å; R33-K37 PolarHBondContact O-N 3.32Å
34E94.9Very high87.3Confident100 Ų100104.2 Ų104.247%0.46753%0.528SS..Hα-helixtrans-65.6-44.4176.9-174174.7-173.600112Q30 R31 I32 L36 K37 Q38Q30-E34 WeakPolarHBondContact O-CB 3.45Å; Q30-E34 PolarHBondContact O-N 3.37Å; R31-E34 PolarHBondContact O-N 3.47Å; I32-E34 VanDerWaalsContact C-N 3.34Å; I32-E34 PolarHBondContact O-N 3.49Å; E34-L36 VanDerWaalsContact C-N 3.34Å; E34-L36 PolarHBondContact O-N 2.92Å; E34-K37 PolarHBondContact O-N 3.41Å; E34-Q38 WeakPolarHBondContact O-CG 3.2Å; E34-Q38 PolarHBondContact O-N 3.2Å
35C94.7Very high88.8Confident78 Ų78104.4 Ų104.453%0.52752%0.521SS..Hα-helixtrans-59.9-43.7176.5-177.20000111.9R31 I32 Q38 N39R31-C35 VanDerWaalsContact O-CB 3.27Å; R31-C35 WeakPolarHBondContact O-CB 3.43Å; R31-C35 PolarHBondContact O-N 2.88Å; I32-C35 PolarHBondContact O-N 2.88Å; C35-Q38 PolarHBondContact O-N 3.14Å; C35-N39 WeakPolarHBondContact O-CB 3.47Å; C35-N39 PolarHBondContact O-N 2.91Å
36L95.6Very high90.1Very high114 Ų114106.6 Ų106.660%0.59753%0.526SS*.Hα-helixtrans-63.7-41176-70.3174.7000112.1I32 E34 N39 E40I32-L36 HydrophobicContact CG2-CD1 4.12Å; I32-L36 WeakPolarHBondContact O-CG 3.48Å; I32-L36 PolarHBondContact O-N 3.43Å; E34-L36 VanDerWaalsContact C-N 3.34Å; E34-L36 PolarHBondContact O-N 2.92Å; L36-N39 PolarHBondContact O-N 3.28Å; L36-E40 PolarHBondContact O-N 3.35Å
37K95.6Very high91.2Very high146 Ų146106.8 Ų106.864%0.63552%0.516SS*.Hα-helixtrans-62.8-46.9176.4-176.9-175.6170-170.20111.7R33 E34 N39 E40 E41R33-K37 WeakPolarHBondContact O-CB 3.41Å; R33-K37 PolarHBondContact O-N 3.32Å; E34-K37 PolarHBondContact O-N 3.41Å; K37-N39 VanDerWaalsContact C-N 3.32Å; K37-N39 PolarHBondContact O-N 3.18Å; K37-E40 PolarHBondContact O-N 3.3Å; K37-E41 PolarHBondContact O-N 2.97Å
38Q94.4Very high91.6Very high110 Ų110109.9 Ų109.951%0.51452%0.524SS..Hα-helixtrans-62-39.5177.2-72.4175.5-6.900111.8E34 C35 E41 A42E34-Q38 WeakPolarHBondContact O-CG 3.2Å; E34-Q38 PolarHBondContact O-N 3.2Å; C35-Q38 PolarHBondContact O-N 3.14Å; Q38-E41 PolarHBondContact O-N 2.92Å; Q38-A42 WeakPolarHBondContact O-CB 3.3Å; Q38-A42 PolarHBondContact O-N 3.23Å
39N94.1Very high91.7Very high109 Ų109111 Ų11158%0.58353%0.529SS*.Hα-helixtrans-64.7-41.5177.1-166.9-82.3000111.8C35 L36 K37 R43C35-N39 WeakPolarHBondContact O-CB 3.47Å; C35-N39 PolarHBondContact O-N 2.91Å; L36-N39 PolarHBondContact O-N 3.28Å; K37-N39 VanDerWaalsContact C-N 3.32Å; K37-N39 PolarHBondContact O-N 3.18Å; N39-R43 WeakPolarHBondContact O-CB 3.43Å; N39-R43 PolarHBondContact O-N 2.91Å
40E94.8Very high91.5Very high89 Ų89110 Ų11042%0.41652%0.524SS..Hα-helixtrans-65.3-40.9176.3-167.5-173.4161.100112.1L36 K37 R43 K44L36-E40 PolarHBondContact O-N 3.35Å; K37-E40 PolarHBondContact O-N 3.3Å; E40-R43 PolarHBondContact O-N 2.97Å; E40-K44 WeakPolarHBondContact O-CG 3.5Å; E40-K44 PolarHBondContact O-N 3.2Å; E40-K44 WeakPolarHBondContact OE1-CE 3.31Å; E40-K44 IonicContact OE1-NZ 2.69Å; E40-K44 PolarHBondContact OE1-NZ 3.31Å
41E92.6Very high90.9Very high103 Ų103110.6 Ų110.648%0.48153%0.527SS..Hα-helixtrans-63.6-49.5175.6-172.7165.6-155.300111.3K37 Q38 R43 K44 E45K37-E41 PolarHBondContact O-N 2.97Å; Q38-E41 PolarHBondContact O-N 2.92Å; E41-R43 VanDerWaalsContact C-N 3.28Å; E41-R43 PolarHBondContact O-N 3.32Å; E41-K44 PolarHBondContact O-N 3.05Å; E41-E45 WeakPolarHBondContact O-CG 3.35Å; E41-E45 PolarHBondContact O-N 3.23Å
42A93.4Very high90.2Very high52 Ų52108.9 Ų108.943%0.4353%0.525SS..Hα-helixtrans-58.9-38.5175.800000112.3Q38 E45 Q46Q38-A42 WeakPolarHBondContact O-CB 3.3Å; Q38-A42 PolarHBondContact O-N 3.23Å; A42-E45 PolarHBondContact O-N 2.92Å; A42-Q46 WeakPolarHBondContact O-CB 3.41Å; A42-Q46 PolarHBondContact O-N 3.28Å
43R92.1Very high89Confident147 Ų147109.9 Ų109.956%0.55553%0.527SS*.Hα-helixtrans-65.7-40.7175.6-168.4-175.469.8174.2-0.3111.8N39 E40 E41 Q46 E47N39-R43 WeakPolarHBondContact O-CB 3.43Å; N39-R43 PolarHBondContact O-N 2.91Å; E40-R43 PolarHBondContact O-N 2.97Å; E41-R43 VanDerWaalsContact C-N 3.28Å; E41-R43 PolarHBondContact O-N 3.32Å; R43-Q46 PolarHBondContact O-N 3.43Å; R43-E47 WeakPolarHBondContact O-CB 3.45Å; R43-E47 PolarHBondContact O-N 3.47Å
44K92.4Very high87.6Confident113 Ų113106.3 Ų106.349%0.49153%0.527SS..Hα-helixtrans-67.1-41.2176.5-74.2172.6-175.7165.50111.8E40 E41 E47 L48E40-K44 WeakPolarHBondContact O-CG 3.5Å; E40-K44 PolarHBondContact O-N 3.2Å; E40-K44 WeakPolarHBondContact OE1-CE 3.31Å; E40-K44 IonicContact OE1-NZ 2.69Å; E40-K44 PolarHBondContact OE1-NZ 3.31Å; E41-K44 PolarHBondContact O-N 3.05Å; K44-E47 PolarHBondContact O-N 3.44Å; K44-L48 WeakPolarHBondContact O-CB 3.41Å; K44-L48 PolarHBondContact O-N 2.9Å
45E89.2Confident85.9Confident126 Ų126108.7 Ų108.759%0.58954%0.536SS*.Hα-helixtrans-62.2-43.9174.5-71.8-179.2172.100111.4E41 A42 E47 L48 L49E41-E45 WeakPolarHBondContact O-CG 3.35Å; E41-E45 PolarHBondContact O-N 3.23Å; A42-E45 PolarHBondContact O-N 2.92Å; E45-E47 PolarHBondContact O-N 3.43Å; E45-L48 PolarHBondContact O-N 3.42Å; E45-L49 WeakPolarHBondContact O-CB 3.4Å; E45-L49 PolarHBondContact O-N 3.46Å
46Q89.4Confident84Confident122 Ų122111.4 Ų111.457%0.5755%0.545SS*.Hα-helixtrans-61.3-43.9175.2-175.1-177.940.500111.7A42 R43 L49 L50A42-Q46 WeakPolarHBondContact O-CB 3.41Å; A42-Q46 PolarHBondContact O-N 3.28Å; R43-Q46 PolarHBondContact O-N 3.43Å; Q46-L49 PolarHBondContact O-N 3Å; Q46-L50 HydrophobicContact CG-CD1 4Å; Q46-L50 WeakPolarHBondContact O-CB 3.33Å; Q46-L50 WeakPolarHBondContact O-CD1 3.34Å; Q46-L50 WeakPolarHBondContact O-CG 3.32Å; Q46-L50 PolarHBondContact O-N 3.3Å
47E89.3Confident81.8Confident124 Ų124109.8 Ų109.858%0.57954%0.54SS*.Hα-helixtrans-62.7-41.9177.3-174.3177.2-179.500111.8R43 K44 E45 L50 Q51R43-E47 WeakPolarHBondContact O-CB 3.45Å; R43-E47 PolarHBondContact O-N 3.47Å; K44-E47 PolarHBondContact O-N 3.44Å; E45-E47 PolarHBondContact O-N 3.43Å; E47-L50 PolarHBondContact O-N 2.95Å; E47-Q51 PolarHBondContact O-N 2.88Å
48L85.5Confident79.4Confident102 Ų102109.7 Ų109.753%0.53455%0.552SS.*Hα-helixtrans-64.5-43.6176.5-168145.6000111.3K44 E45 L50 Q51 E52K44-L48 WeakPolarHBondContact O-CB 3.41Å; K44-L48 PolarHBondContact O-N 2.9Å; E45-L48 PolarHBondContact O-N 3.42Å; L48-L50 PolarHBondContact O-N 3.04Å; L48-Q51 PolarHBondContact O-N 3.38Å; L48-E52 HydrophobicContact CD2-CG 4.26Å; L48-E52 PolarHBondContact O-N 2.93Å
49L84.9Confident77.1Confident94 Ų94108.4 Ų108.449%0.49256%0.56SS.*Hα-helixtrans-63.4-41.1176.9-17366.7000112.1E45 Q46 Q51 E52 Q53E45-L49 WeakPolarHBondContact O-CB 3.4Å; E45-L49 PolarHBondContact O-N 3.46Å; Q46-L49 PolarHBondContact O-N 3Å; L49-Q51 VanDerWaalsContact C-N 3.33Å; L49-E52 PolarHBondContact O-N 3.05Å; L49-Q53 WeakPolarHBondContact O-CB 3.47Å; L49-Q53 WeakPolarHBondContact O-CG 3.46Å; L49-Q53 PolarHBondContact O-N 2.93Å
50L82Confident74.8Confident100 Ų100111.6 Ų111.652%0.52457%0.571SS.*Hα-helixtrans-63.1-39.5173.9-79.3159.8000111.6Q46 E47 L48 Q53 S54Q46-L50 HydrophobicContact CG-CD1 4Å; Q46-L50 WeakPolarHBondContact O-CB 3.33Å; Q46-L50 WeakPolarHBondContact O-CD1 3.34Å; Q46-L50 WeakPolarHBondContact O-CG 3.32Å; Q46-L50 PolarHBondContact O-N 3.3Å; E47-L50 PolarHBondContact O-N 2.95Å; L48-L50 PolarHBondContact O-N 3.04Å; L50-Q53 PolarHBondContact O-N 3.4Å; L50-S54 WeakPolarHBondContact O-CB 3.27Å; L50-S54 PolarHBondContact O-N 3.38Å; L50-S54 PolarHBondContact O-OG 2.77Å
51Q79Confident72.5Confident110 Ų110113.6 Ų113.651%0.51459%0.585SS.*Hα-helixtrans-65.8-40.7175.9-170.1-179.289.100111.6E47 L48 L49 S54 K55E47-Q51 PolarHBondContact O-N 2.88Å; L48-Q51 PolarHBondContact O-N 3.38Å; L49-Q51 VanDerWaalsContact C-N 3.33Å; Q51-S54 WeakPolarHBondContact CA-OG 3.39Å; Q51-S54 PolarHBondContact O-N 3.36Å; Q51-S54 PolarHBondContact O-OG 3.23Å; Q51-K55 PolarHBondContact O-N 3.23Å
52E75Confident70.4Confident106 Ų106115 Ų11550%0.49560%0.6SS.*Hα-helixtrans-66.6-41.4174.5-70.4-165.9138.200112.5L48 L49 S54 K55 N56L48-E52 HydrophobicContact CD2-CG 4.26Å; L48-E52 PolarHBondContact O-N 2.93Å; L49-E52 PolarHBondContact O-N 3.05Å; E52-S54 VanDerWaalsContact C-N 3.34Å; E52-S54 PolarHBondContact O-N 2.93Å; E52-K55 PolarHBondContact O-N 3.13Å; E52-N56 PolarHBondContact O-N 2.83Å
53Q67.8Low68.5Low101 Ų101121.1 Ų121.147%0.47262%0.62SS.*Hα-helixtrans-61.3-42.7173.4-76.3-175.335.300111.4L49 L50 K55 N56 V57L49-Q53 WeakPolarHBondContact O-CB 3.47Å; L49-Q53 WeakPolarHBondContact O-CG 3.46Å; L49-Q53 PolarHBondContact O-N 2.93Å; L50-Q53 PolarHBondContact O-N 3.4Å; Q53-K55 PolarHBondContact O-N 3.24Å; Q53-K55 VanDerWaalsContact O-N 3.11Å; Q53-N56 CarbonylContact O-C 3.58Å; Q53-N56 PolarHBondContact O-N 2.73Å; Q53-V57 HydrophobicContact CB-CG2 4.47Å; Q53-V57 WeakPolarHBondContact O-CG2 3.49Å; Q53-V57 PolarHBondContact O-N 3.49Å
54S62.3Low66.8Low87 Ų87118.2 Ų118.261%0.60862%0.616SS**Hα-helixtrans-63-19.8178.968.20000114L50 Q51 E52L50-S54 WeakPolarHBondContact O-CB 3.27Å; L50-S54 PolarHBondContact O-N 3.38Å; L50-S54 PolarHBondContact O-OG 2.77Å; Q51-S54 WeakPolarHBondContact CA-OG 3.39Å; Q51-S54 PolarHBondContact O-N 3.36Å; Q51-S54 PolarHBondContact O-OG 3.23Å; E52-S54 VanDerWaalsContact C-N 3.34Å; E52-S54 PolarHBondContact O-N 2.93Å
55K60.4Low65.2Low149 Ų149118.8 Ų118.865%0.64862%0.624SS**Hα-helixtrans-81.9-21.6172-67.4174.5-173.8168.10113.4Q51 E52 Q53Q51-K55 PolarHBondContact O-N 3.23Å; E52-K55 PolarHBondContact O-N 3.13Å; Q53-K55 PolarHBondContact O-N 3.24Å; Q53-K55 VanDerWaalsContact O-N 3.11Å
56N54.1Low63.9Low136 Ų136119.3 Ų119.373%0.72763%0.631SS**Hα-helixtrans-107.9-9.4-177.1-67.4-28.3000113.9E52 Q53 T58E52-N56 PolarHBondContact O-N 2.83Å; Q53-N56 CarbonylContact O-C 3.58Å; Q53-N56 PolarHBondContact O-N 2.73Å; N56-T58 PolarHBondContact O-N 3.3Å
57V49.1Very low62.4Low80 Ų80119 Ų11949%0.48563%0.633SS.*  trans-96.364.2-179.2-175.90000110.7Q53 A59Q53-V57 HydrophobicContact CB-CG2 4.47Å; Q53-V57 WeakPolarHBondContact O-CG2 3.49Å; Q53-V57 PolarHBondContact O-N 3.49Å; V57-A59 VanDerWaalsContact C-N 3.3Å
58T46.7Very low61Low144 Ų144121.5 Ų121.588%0.88364%0.636SS**SBendtrans-92.24.6152.7-36.40000111.1N56N56-T58 PolarHBondContact O-N 3.3Å
59A46.4Very low59.7Low82 Ų82124.2 Ų124.268%0.67865%0.649SS**SBendtrans-147.572.8-179.100000111.6V57V57-A59 VanDerWaalsContact C-N 3.3Å
60Q45.2Very low58.6Low176 Ų176126.3 Ų126.382%0.82266%0.659SS**  trans173.173.7150-96.7169.76.700109.2
61N45.5Very low57.8Low131 Ų131126.7 Ų126.770%0.70167%0.671SS**  trans-112.376.9174.1-177.234.3000108.3
62V48.5Very low57.6Low133 Ų133123.7 Ų123.781%0.80667%0.669SS**SBendtrans-138.1-11172.4-169.50000115
63E54.2Low57.8Low180 Ų180124.6 Ų124.684%0.84168%0.684SS**SBendtrans-120.26.4-175.3-61.3-159.9155.800117.2
64D56.4Low58.3Low87 Ų87127.5 Ų127.547%0.46570%0.701SS.*THydrogen-bonded Turntrans-88.4-3.8179.5-85.9-44000115.7N66 L67 R68D64-N66 VanDerWaalsContact C-N 3.27Å; D64-N66 PolarHBondContact O-N 3.44Å; D64-L67 PolarHBondContact O-N 3.26Å; D64-R68 PolarHBondContact O-N 3.31Å
65D58.9Low59.3Low124 Ų124134.6 Ų134.666%0.66372%0.715SS**Hα-helixtrans-69.1-23.6-178.2-97-14.3000113.3M69D65-M69 WeakPolarHBondContact O-CG 3.47Å
66N60.8Low60.4Low138 Ų138135.1 Ų135.174%0.73872%0.723SS**Hα-helixtrans-74-31.1176.9-88.4-34.8000113.3D64D64-N66 VanDerWaalsContact C-N 3.27Å; D64-N66 PolarHBondContact O-N 3.44Å
67L58.7Low61.9Low116 Ų116136.5 Ų136.561%0.60773%0.729SS**Hα-helixtrans-82.4-32.9-179.4-68.4175.4000112.2D64 M69 L70D64-L67 PolarHBondContact O-N 3.26Å; L67-M69 VanDerWaalsContact C-N 3.28Å; L67-M69 PolarHBondContact O-N 2.86Å; L67-L70 HydrophobicContact CD2-CD1 4.32Å; L67-L70 WeakPolarHBondContact O-CB 3.48Å; L67-L70 PolarHBondContact O-N 2.92Å
68R59.2Low63.6Low175 Ų175140.4 Ų140.466%0.6674%0.74SS**Hα-helixtrans-65.3-31.5175.7-68.2-171.7-171.4169.55.9112.7D64 L70 S71D64-R68 PolarHBondContact O-N 3.31Å; R68-L70 PolarHBondContact O-N 3.21Å; R68-S71 PolarHBondContact O-N 2.95Å; R68-S71 VanDerWaalsContact O-N 3.14Å
69M59.5Low65.3Low160 Ų160141.9 Ų141.979%0.78873%0.729SS**THydrogen-bonded Turntrans-63.1-20.5172.7-70.1-112.173.200113.2D65 L67D65-M69 WeakPolarHBondContact O-CG 3.47Å; L67-M69 VanDerWaalsContact C-N 3.28Å; L67-M69 PolarHBondContact O-N 2.86Å
70L61.5Low66.8Low138 Ų138144.1 Ų144.172%0.72374%0.737SS**THydrogen-bonded Turntrans-89-8.5177-61.4175.8000113.6L67 R68 G72L67-L70 HydrophobicContact CD2-CD1 4.32Å; L67-L70 WeakPolarHBondContact O-CB 3.48Å; L67-L70 PolarHBondContact O-N 2.92Å; R68-L70 PolarHBondContact O-N 3.21Å; L70-G72 PolarHBondContact O-N 3.13Å
71S65.4Low68.1Low108 Ų108143.9 Ų143.976%0.75574%0.736SS**  trans-79.635.2176.4-172.20000112.8R68R68-S71 PolarHBondContact O-N 2.95Å; R68-S71 VanDerWaalsContact O-N 3.14Å
72G74.5Confident69Low47 Ų47143.6 Ų143.649%0.48574%0.744SS.*SBendtrans-82.715117000000110.9L70 I74L70-G72 PolarHBondContact O-N 3.13Å; G72-I74 PolarHBondContact O-N 3.29Å
73P79.8Confident69.4Low124 Ų124140.2 Ų140.281%0.80574%0.736SS**PPolyproline II helixtrans-52131.8170.5-24.132.4000111.2R75P73-R75 PolarHBondContact O-N 3.25Å
74I78.5Confident69.1Low162 Ų162140.8 Ų140.883%0.83174%0.736SS**PPolyproline II helixtrans-59.8120178.4-62.5167.9000108.6G72G72-I74 PolarHBondContact O-N 3.29Å
75R81.8Confident68.6Low237 Ų237145.9 Ų145.989%0.89476%0.759SS**  trans-92.4112.3176-62-174.2-64.3-138.4-1108.9P73 L77P73-R75 PolarHBondContact O-N 3.25Å; R75-L77 PolarHBondContact O-N 3.3Å
76I84.7Confident67.9Low160 Ų160143.4 Ų143.482%0.82176%0.762SS**PPolyproline II helixtrans-76.1116.8175.2-59.2171.5000108.2K78I76-K78 PolarHBondContact O-N 3.47Å
77L85.1Confident67.1Low164 Ų164143 Ų14386%0.85976%0.764SS**PPolyproline II helixtrans-64.9119.8174.9-174.663000109.2R75 R79R75-L77 PolarHBondContact O-N 3.3Å; L77-R79 PolarHBondContact O-N 3.3Å
78K85.5Confident66.3Low163 Ų163145 Ų14571%0.70978%0.776SS**PPolyproline II helixtrans-61.7128.4177.8-173.3174.1176.6178.10109.2I76I76-K78 PolarHBondContact O-N 3.47Å
79R81.2Confident65.5Low175 Ų175140.2 Ų140.266%0.6678%0.781SS**PPolyproline II helixtrans-55.5131.1175.3-63.8-177.5-179.5-147.5-4.8108.9L77 Q81 D95L77-R79 PolarHBondContact O-N 3.3Å; R79-Q81 PolarHBondContact O-N 3.04Å; R79-D95 IonicContact CZ-OD2 3.51Å; R79-D95 IonicContact NH1-OD2 2.77Å; R79-D95 PolarHBondContact NH1-OD2 2.87Å; R79-D95 IonicContact NH2-OD2 3.4Å; R79-D95 PolarHBondContact NH2-OD2 3.07Å
80P78.4Confident64.8Low129 Ų129140 Ų14084%0.83878%0.783SS**PPolyproline II helixtrans-57.9126.9176.221.1-29.9000109.1S82P80-S82 PolarHBondContact O-N 3.12Å
81Q71.9Confident64.1Low171 Ų171144.4 Ų144.480%0.79979%0.79SS**PPolyproline II helixtrans-67120.7175.1-78.2-172.3-54.200107.8R79 G83R79-Q81 PolarHBondContact O-N 3.04Å; Q81-G83 PolarHBondContact O-N 3.09Å
82S65.6Low63.4Low124 Ų124145.4 Ų145.487%0.86779%0.792SS**  trans-59.581.2173.4172.30000110.2P80P80-S82 PolarHBondContact O-N 3.12Å
83G55.6Low62Low63 Ų63148.9 Ų148.965%0.64980%0.799SS**  trans-98.990.8166.300000107.2Q81Q81-G83 PolarHBondContact O-N 3.09Å
84K49.2Very low60.4Low192 Ų192146.9 Ų146.984%0.83579%0.787SS**SBendtrans3.8125.4150.6-49.5175.6-172.4-176.70114.5
85M45.9Very low58.9Low194 Ų194143.9 Ų143.996%0.95677%0.773SS**  trans77.9107.8173.3-83.113189.800117.1
86G43.5Very low57.1Low71 Ų71137.6 Ų137.673%0.73276%0.757SS**  trans155.876.6155.500000114.2
87V44.6Very low55.4Low129 Ų129135.3 Ų135.378%0.78275%0.753SS**  trans35.1130.3141.3-140.60000119.5
88D41.8Very low53.7Low159 Ų159130.8 Ų130.885%0.8574%0.739SS**  trans67.387.7161.9-60-37.5000117.6
89G41.4Very low51.9Low75 Ų75127.5 Ų127.577%0.77374%0.735SS**  trans-176.589.8169.600000112.9R91G89-R91 PolarHBondContact O-N 3.04Å
90D45.1Very low50.1Low155 Ų155124.6 Ų124.683%0.82974%0.742SS**  trans-46.9105.3166.5-173.721000111.3
91R46.6Very low48.5Very low230 Ų230121.6 Ų121.687%0.86872%0.724SS**  trans-177.696.8154.7-105.2165.5157.2122.70.6110.1G89 N93G89-R91 PolarHBondContact O-N 3.04Å; R91-N93 PolarHBondContact O-N 2.77Å
92V50.1Low47.4Very low130 Ų130118.5 Ų118.579%0.78873%0.728SS**  trans-62.685.6162.9-73.30000109.1C94V92-C94 VanDerWaalsContact C-N 3.32Å; V92-C94 PolarHBondContact O-N 3.37Å; V92-C94 VanDerWaalsContact O-N 3.13Å; V92-C94 PolarHBondContact O-SG 2.76Å
93N46.8Very low46.7Very low120 Ų120118.6 Ų118.664%0.64272%0.717SS**  trans-8187.1170-160.221.2000107.7R91 D95R91-N93 PolarHBondContact O-N 2.77Å; N93-D95 PolarHBondContact O-N 3.48Å
94C46.3Very low46.3Very low81 Ų81121.6 Ų121.655%0.54773%0.725SS.*  trans-76.958177.9-43.80000110.6V92 D96V92-C94 VanDerWaalsContact C-N 3.32Å; V92-C94 PolarHBondContact O-N 3.37Å; V92-C94 VanDerWaalsContact O-N 3.13Å; V92-C94 PolarHBondContact O-SG 2.76Å; C94-D96 VanDerWaalsContact C-N 3.27Å
95D45.5Very low46.2Very low99 Ų99114.5 Ų114.553%0.52971%0.707SS.*  trans-97.328.8167.9-88.4-9.9000110.2R79 N93 P97R79-D95 IonicContact CZ-OD2 3.51Å; R79-D95 IonicContact NH1-OD2 2.77Å; R79-D95 PolarHBondContact NH1-OD2 2.87Å; R79-D95 IonicContact NH2-OD2 3.4Å; R79-D95 PolarHBondContact NH2-OD2 3.07Å; N93-D95 PolarHBondContact O-N 3.48Å; D95-P97 WeakPolarHBondContact O-CD 3.37Å
96D44.8Very low46.3Very low105 Ų105112.8 Ų112.856%0.56170%0.701SS**  trans-86.1117.7168-160.1-29000107.7C94 A98 C99C94-D96 VanDerWaalsContact C-N 3.27Å; D96-A98 HydrophobicContact CB-CB 4.47Å; D96-A98 PolarHBondContact O-N 3.24Å; D96-A98 WeakPolarHBondContact OD1-CB 3.35Å; D96-A98 PolarHBondContact OD1-N 3.32Å; D96-C99 WeakPolarHBondContact O-CB 3.48Å; D96-C99 PolarHBondContact O-N 3.39Å
97P48.1Very low46.4Very low113 Ų113110.7 Ų110.773%0.73468%0.679SS**G310 helixtrans-60.8-4.6176.625.5-33.6000113.2D95 C99 S100D95-P97 WeakPolarHBondContact O-CD 3.37Å; P97-C99 PolarHBondContact O-N 3.29Å; P97-S100 PolarHBondContact O-N 3.32Å
98A50.3Low47.1Very low68 Ų68111.5 Ų111.556%0.56269%0.688SS**G310 helixtrans-63-15.6162.800000114.2D96 S100D96-A98 HydrophobicContact CB-CB 4.47Å; D96-A98 PolarHBondContact O-N 3.24Å; D96-A98 WeakPolarHBondContact OD1-CB 3.35Å; D96-A98 PolarHBondContact OD1-N 3.32Å; A98-S100 VanDerWaalsContact C-N 3.26Å; A98-S100 PolarHBondContact O-N 3.3Å
99C47.1Very low48.2Very low94 Ų94107.6 Ų107.664%0.63569%0.685SS**G310 helixtrans-75.6-9.8173.5-88.70000113.9D96 P97D96-C99 WeakPolarHBondContact O-CB 3.48Å; D96-C99 PolarHBondContact O-N 3.39Å; P97-C99 PolarHBondContact O-N 3.29Å
100S44.7Very low49.3Very low115 Ų115111.6 Ų111.680%0.80468%0.677SS**G310 helixtrans-108.127.6-179.1-69.30000114.5P97 A98P97-S100 PolarHBondContact O-N 3.32Å; A98-S100 VanDerWaalsContact C-N 3.26Å; A98-S100 PolarHBondContact O-N 3.3Å
101S43.4Very low50.9Low65 Ų65110.1 Ų110.146%0.45566%0.66SS.*  trans-119.598.4156.366.80000108.4I103S101-I103 PolarHBondContact O-N 3.48Å
102A49.1Very low52.9Low107 Ų107102.5 Ų102.588%0.88464%0.643SS**  trans-66.240.4163.100000111.3P104A102-P104 WeakPolarHBondContact O-CD 3.33Å
103I51.6Low54.6Low126 Ų126101.6 Ų101.665%0.64663%0.632SS**  trans-92.1108.1167.4-55.2173.8000103.9S101 G105S101-I103 PolarHBondContact O-N 3.48Å; I103-G105 PolarHBondContact O-N 3.32Å
104P46.1Very low56.6Low126 Ų12699 Ų9982%0.81863%0.628SS**  trans-70.683.6177.329.6-32000108A102A102-P104 WeakPolarHBondContact O-CD 3.33Å
105G46.5Very low58.7Low43 Ų4399.5 Ų99.544%0.44362%0.622SS.*  trans-155.196.9-172.300000112.3I103 G107I103-G105 PolarHBondContact O-N 3.32Å; G105-G107 PolarHBondContact O-N 3.02Å
106N48.6Very low61Low157 Ų157101 Ų10184%0.8462%0.62SS**  trans56.748.8149.8-57.613000117.7
107G46.9Very low63.2Low27 Ų2798.8 Ų98.828%0.27861%0.61SS.*  trans-70.2156160.700000112.4G105 G109 Y110G105-G107 PolarHBondContact O-N 3.02Å; G107-G109 PolarHBondContact O-N 3.42Å; G107-Y110 VanDerWaalsContact CA-CD2 3.46Å; G107-Y110 VanDerWaalsContact O-CD2 3.29Å; G107-Y110 WeakPolarHBondContact O-CD2 3.29Å; G107-Y110 PolarHBondContact O-N 3.41Å
108P58.1Low65.3Low147 Ų14795.2 Ų95.296%0.95559%0.59SS**THydrogen-bonded Turntrans-69.2101.4171.327.2-31000109.2
109G65.6Low67.3Low76 Ų7693.8 Ų93.878%0.78457%0.574SS**THydrogen-bonded Turntrans134.2-6-176.900000114.4G107 R111G107-G109 PolarHBondContact O-N 3.42Å; G109-R111 PolarHBondContact O-N 3.06Å
110Y63.3Low69.6Low159 Ų15995.1 Ų95.162%0.62457%0.567SS**PPolyproline II helixtrans-75.8122.8173.1-72.4-97.3000110.4G107G107-Y110 VanDerWaalsContact CA-CD2 3.46Å; G107-Y110 VanDerWaalsContact O-CD2 3.29Å; G107-Y110 WeakPolarHBondContact O-CD2 3.29Å; G107-Y110 PolarHBondContact O-N 3.41Å
111R80.1Confident72Confident124 Ų12489.9 Ų89.947%0.46853%0.53SS..PPolyproline II helixtrans-59.2145169.9-68.6-159.7-88.7165.71.3110.8G109 E115 R116 T119G109-R111 PolarHBondContact O-N 3.06Å; R111-E115 WeakPolarHBondContact CA-OE2 3.21Å; R111-E115 HydrophobicContact CB-CB 4.3Å; R111-E115 HydrophobicContact CB-CG 4.2Å; R111-E115 WeakPolarHBondContact CB-OE2 3.44Å; R111-E115 WeakPolarHBondContact CD-OE1 2.88Å; R111-E115 WeakPolarHBondContact CG-OE2 3.46Å; R111-E115 IonicContact NH1-OE1 3.84Å; R111-R116 HydrophobicContact CB-CG 4.11Å; R111-T119 PolarHBondContact NH1-OG1 2.88Å
112S87.5Confident74.5Confident71 Ų7193.6 Ų93.650%0.49754%0.54SS..PPolyproline II helixtrans-55.6151.3177.6174.60000110.8A114 E115 R116S112-A114 PolarHBondContact O-N 2.9Å; S112-E115 PolarHBondContact N-OE2 3.39Å; S112-E115 WeakPolarHBondContact O-CB 3.36Å; S112-E115 PolarHBondContact O-N 3.46Å; S112-R116 PolarHBondContact O-N 3.28Å
113I86.5Confident76.7Confident111 Ų11191 Ų9157%0.56951%0.514SS*.Hα-helixtrans-55.5-42.1176.4-171.964.2000111.3E115 R116 V117I113-E115 VanDerWaalsContact C-N 3.28Å; I113-E115 PolarHBondContact O-N 3.2Å; I113-R116 PolarHBondContact O-N 2.77Å; I113-V117 HydrophobicContact CD1-CG2 4.46Å; I113-V117 HydrophobicContact CG1-CG2 4.37Å; I113-V117 VanDerWaalsContact O-CG2 3.31Å; I113-V117 WeakPolarHBondContact O-CG2 3.5Å; I113-V117 PolarHBondContact O-N 2.88Å
114A87.7Confident78.9Confident66 Ų6688.5 Ų88.555%0.54550%0.496SS..Hα-helixtrans-60.2-40.1177.200000111.6S112 V117 A118S112-A114 PolarHBondContact O-N 2.9Å; A114-V117 PolarHBondContact O-N 3.47Å; A114-A118 VanDerWaalsContact O-CB 3.31Å; A114-A118 WeakPolarHBondContact O-CB 3.32Å; A114-A118 PolarHBondContact O-N 3Å
115E91.7Very high81.3Confident90 Ų9088.3 Ų88.342%0.42148%0.482SS..Hα-helixtrans-68.5-39.5177.7-171-175.5174.300112.1R111 S112 I113 A118 T119R111-E115 WeakPolarHBondContact CA-OE2 3.21Å; R111-E115 HydrophobicContact CB-CB 4.3Å; R111-E115 HydrophobicContact CB-CG 4.2Å; R111-E115 WeakPolarHBondContact CB-OE2 3.44Å; R111-E115 WeakPolarHBondContact CD-OE1 2.88Å; R111-E115 WeakPolarHBondContact CG-OE2 3.46Å; R111-E115 IonicContact NH1-OE1 3.84Å; S112-E115 PolarHBondContact N-OE2 3.39Å; S112-E115 WeakPolarHBondContact O-CB 3.36Å; S112-E115 PolarHBondContact O-N 3.46Å; I113-E115 VanDerWaalsContact C-N 3.28Å; I113-E115 PolarHBondContact O-N 3.2Å; E115-A118 PolarHBondContact O-N 2.93Å; E115-T119 WeakPolarHBondContact O-CB 3.37Å; E115-T119 PolarHBondContact O-N 3.36Å; E115-T119 PolarHBondContact O-OG1 3.03Å
116R92.6Very high83.7Confident130 Ų13095.8 Ų95.849%0.49150%0.497SS..Hα-helixtrans-64.6-44.4174.6-69.7-167.4-66.9173.5-1.6111.5R111 S112 I113 T119 Y120R111-R116 HydrophobicContact CB-CG 4.11Å; S112-R116 PolarHBondContact O-N 3.28Å; I113-R116 PolarHBondContact O-N 2.77Å; R116-T119 PolarHBondContact O-N 3.22Å; R116-Y120 WeakPolarHBondContact O-CB 3.31Å; R116-Y120 PolarHBondContact O-N 3.44Å
117V91.9Very high86Confident59 Ų5993.6 Ų93.636%0.35848%0.484SS..Hα-helixtrans-63.9-43.1177173.10000110.7I113 A114 Y120 N121 Y135I113-V117 HydrophobicContact CD1-CG2 4.46Å; I113-V117 HydrophobicContact CG1-CG2 4.37Å; I113-V117 VanDerWaalsContact O-CG2 3.31Å; I113-V117 WeakPolarHBondContact O-CG2 3.5Å; I113-V117 PolarHBondContact O-N 2.88Å; A114-V117 PolarHBondContact O-N 3.47Å; V117-Y120 PolarHBondContact O-N 2.86Å; V117-N121 WeakPolarHBondContact O-CB 3.31Å; V117-N121 PolarHBondContact O-N 2.84Å; V117-N121 PolarHBondContact O-ND2 3.4Å; V117-Y135 HydrophobicContact CG1-CD2 3.52Å; V117-Y135 HydrophobicContact CG1-CE2 3.77Å
118A91.5Very high88.3Confident39 Ų3999.1 Ų99.132%0.32250%0.501SS..Hα-helixtrans-62-46.4175.200000111.8A114 E115 Y120 N121 E122A114-A118 VanDerWaalsContact O-CB 3.31Å; A114-A118 WeakPolarHBondContact O-CB 3.32Å; A114-A118 PolarHBondContact O-N 3Å; E115-A118 PolarHBondContact O-N 2.93Å; A118-Y120 PolarHBondContact O-N 2.88Å; A118-N121 PolarHBondContact O-N 3.38Å; A118-E122 PolarHBondContact O-N 3.46Å
119T93.5Very high90.1Very high37 Ų3794.7 Ų94.723%0.22748%0.482CS..Hα-helixtrans-61-44177.4-56.20000111.3R111 E115 R116 N121 E122 V123R111-T119 PolarHBondContact NH1-OG1 2.88Å; E115-T119 WeakPolarHBondContact O-CB 3.37Å; E115-T119 PolarHBondContact O-N 3.36Å; E115-T119 PolarHBondContact O-OG1 3.03Å; R116-T119 PolarHBondContact O-N 3.22Å; T119-N121 VanDerWaalsContact C-N 3.32Å; T119-N121 PolarHBondContact O-N 2.98Å; T119-E122 PolarHBondContact O-N 2.85Å; T119-V123 WeakPolarHBondContact O-CG2 3.4Å; T119-V123 PolarHBondContact O-N 3.34Å
120Y95.3Very high91.3Very high122 Ų12294 Ų9448%0.47847%0.466SS..Hα-helixtrans-59.5-44.4176.7175.4-100.7000111.4R116 V117 A118 V123 R124R116-Y120 WeakPolarHBondContact O-CB 3.31Å; R116-Y120 PolarHBondContact O-N 3.44Å; V117-Y120 PolarHBondContact O-N 2.86Å; A118-Y120 PolarHBondContact O-N 2.88Å; Y120-V123 PolarHBondContact O-N 3.01Å; Y120-R124 VanDerWaalsContact O-CB 3.32Å; Y120-R124 WeakPolarHBondContact O-CB 3.34Å; Y120-R124 PolarHBondContact O-N 3.41Å; Y120-R124 PolarHBondContact OH-NH1 3.07Å
121N94.8Very high92.7Very high6 Ų688 Ų883%0.03245%0.446CS..Hα-helixtrans-66.8-38.6179.9-84.8-75.6000113.3V117 A118 T119 R124 F125 D132 Y135V117-N121 WeakPolarHBondContact O-CB 3.31Å; V117-N121 PolarHBondContact O-N 2.84Å; V117-N121 PolarHBondContact O-ND2 3.4Å; A118-N121 PolarHBondContact O-N 3.38Å; T119-N121 VanDerWaalsContact C-N 3.32Å; T119-N121 PolarHBondContact O-N 2.98Å; N121-R124 PolarHBondContact O-N 3.3Å; N121-F125 WeakPolarHBondContact O-CB 3.48Å; N121-F125 PolarHBondContact O-N 2.87Å; N121-D132 WeakPolarHBondContact OD1-CB 3.32Å; N121-D132 PolarHBondContact OD1-N 3.38Å; N121-Y135 HydrophobicContact CB-CD1 3.78Å; N121-Y135 HydrophobicContact CB-CE1 3.89Å; N121-Y135 HydrophobicContact CB-CG 4.11Å; N121-Y135 VanDerWaalsContact CG-CB 3.46Å; N121-Y135 VanDerWaalsContact ND2-CB 3.32Å; N121-Y135 WeakPolarHBondContact ND2-CB 3.4Å; N121-Y135 WeakPolarHBondContact ND2-CD2 3.43Å; N121-Y135 WeakPolarHBondContact OD1-CB 3.49Å; N121-Y135 WeakPolarHBondContact OD1-CD1 3.49Å
122E94.9Very high93.2Very high143 Ų14383.7 Ų83.767%0.66843%0.432SS*.Hα-helixtrans-62-45.7173.5-177.3174.8-16800111.6A118 T119 R124 F125 R126A118-E122 PolarHBondContact O-N 3.46Å; T119-E122 PolarHBondContact O-N 2.85Å; E122-R124 VanDerWaalsContact C-N 3.34Å; E122-R124 PolarHBondContact O-N 3.01Å; E122-F125 PolarHBondContact O-N 3.48Å; E122-R126 PolarHBondContact O-N 3.22Å
123V97.1Very high93.3Very high53 Ų5384.2 Ų84.232%0.32143%0.434SS..Hα-helixtrans-63.9-42.2177172.80000110.9T119 Y120 R126 I127T119-V123 WeakPolarHBondContact O-CG2 3.4Å; T119-V123 PolarHBondContact O-N 3.34Å; Y120-V123 PolarHBondContact O-N 3.01Å; V123-R126 WeakPolarHBondContact O-CB 3.11Å; V123-R126 PolarHBondContact O-N 3.06Å; V123-I127 HydrophobicContact CG1-CD1 3.67Å; V123-I127 HydrophobicContact CG1-CG1 4.38Å; V123-I127 WeakPolarHBondContact O-CG1 3.37Å; V123-I127 PolarHBondContact O-N 3.4Å
124R96.3Very high93.3Very high73 Ų7386 Ų8628%0.27544%0.44SS..Hα-helixtrans-62.3-44.3177.3-168-179.5178.9104.7-0.8111.4Y120 N121 E122 R126 I127 F128 S130Y120-R124 VanDerWaalsContact O-CB 3.32Å; Y120-R124 WeakPolarHBondContact O-CB 3.34Å; Y120-R124 PolarHBondContact O-N 3.41Å; Y120-R124 PolarHBondContact OH-NH1 3.07Å; N121-R124 PolarHBondContact O-N 3.3Å; E122-R124 VanDerWaalsContact C-N 3.34Å; E122-R124 PolarHBondContact O-N 3.01Å; R124-R126 VanDerWaalsContact C-N 3.29Å; R124-R126 PolarHBondContact O-N 3.23Å; R124-I127 PolarHBondContact O-N 3.27Å; R124-F128 HydrophobicContact CG-CD2 3.81Å; R124-F128 WeakPolarHBondContact O-CB 3.21Å; R124-F128 PolarHBondContact O-N 3.45Å; R124-S130 CarbonylContact C-O 3.51Å
125F96.2Very high93.3Very high122 Ų12285.7 Ų85.754%0.53543%0.425SS..Hα-helixtrans-58.5-41.7173.7-177.8-98.7000111.6N121 E122 I127 G129 S130N121-F125 WeakPolarHBondContact O-CB 3.48Å; N121-F125 PolarHBondContact O-N 2.87Å; E122-F125 PolarHBondContact O-N 3.48Å; F125-I127 PolarHBondContact O-N 3.04Å; F125-G129 WeakPolarHBondContact CE2-O 3.37Å; F125-G129 WeakPolarHBondContact O-CA 3.42Å; F125-G129 PolarHBondContact O-N 2.88Å; F125-S130 PolarHBondContact N-O 3.17Å
126R97Very high93Very high199 Ų19985.2 Ų85.275%0.75143%0.425SS*.Hα-helixtrans-66.4-35.3177.8-171173.466.7-172.91113.5E122 V123 R124E122-R126 PolarHBondContact O-N 3.22Å; V123-R126 WeakPolarHBondContact O-CB 3.11Å; V123-R126 PolarHBondContact O-N 3.06Å; R124-R126 VanDerWaalsContact C-N 3.29Å; R124-R126 PolarHBondContact O-N 3.23Å
127I96.7Very high92.8Very high111 Ų11182.4 Ų82.457%0.56943%0.425SS*.Hα-helixtrans-85-42.8-177.1-65.2172.1000111.6V123 R124 F125V123-I127 HydrophobicContact CG1-CD1 3.67Å; V123-I127 HydrophobicContact CG1-CG1 4.38Å; V123-I127 WeakPolarHBondContact O-CG1 3.37Å; V123-I127 PolarHBondContact O-N 3.4Å; R124-I127 PolarHBondContact O-N 3.27Å; F125-I127 PolarHBondContact O-N 3.04Å
128F96.5Very high92.5Very high143 Ų14383.1 Ų83.163%0.62743%0.433SS*.Hα-helixtrans-112.3-2.9-170-62.4-74.5000114R124 S130R124-F128 HydrophobicContact CG-CD2 3.81Å; R124-F128 WeakPolarHBondContact O-CB 3.21Å; R124-F128 PolarHBondContact O-N 3.45Å; F128-S130 PolarHBondContact O-N 2.87Å
129G96Very high92Very high55 Ų5585.4 Ų85.457%0.56744%0.439SS*.SBendtrans72.23.5-177.900000114.7F125F125-G129 WeakPolarHBondContact CE2-O 3.37Å; F125-G129 WeakPolarHBondContact O-CA 3.42Å; F125-G129 PolarHBondContact O-N 2.88Å
130S91.2Very high91.5Very high62 Ų6290.2 Ų90.243%0.43446%0.459SS..SBendtrans-144.3143.5177.552.60000110.9R124 F125 F128R124-S130 CarbonylContact C-O 3.51Å; F125-S130 PolarHBondContact N-O 3.17Å; F128-S130 PolarHBondContact O-N 2.87Å
131P91.8Very high90.9Very high31 Ų3189.2 Ų89.220%0.20147%0.47CS..  trans-72.9174.7171.934-34000110.1Y135 L136P131-Y135 HydrophobicContact CB-CD1 4.49Å; P131-L136 HydrophobicContact CB-CG 4.49Å; P131-L136 HydrophobicContact CG-CD1 3.7Å; P131-L136 HydrophobicContact CG-CD2 3.71Å; P131-L136 HydrophobicContact CG-CG 3.67Å
132D90.7Very high89.9Confident34 Ų3496.6 Ų96.618%0.18251%0.506CS..  trans-66128176.8-165.914.2000110N121 E134 Y135 L136N121-D132 WeakPolarHBondContact OD1-CB 3.32Å; N121-D132 PolarHBondContact OD1-N 3.38Å; D132-E134 PolarHBondContact O-N 2.82Å; D132-Y135 WeakPolarHBondContact O-CB 3.35Å; D132-Y135 PolarHBondContact O-N 3.48Å; D132-L136 PolarHBondContact O-N 2.98Å; D132-L136 VanDerWaalsContact O-N 3.17Å
133P88.6Confident88.1Confident83 Ų83100.8 Ų100.854%0.53953%0.526SS..Hα-helixtrans-56.3-33.5178.520.2-35000113.2L136 S137P133-L136 PolarHBondContact O-N 3.36Å; P133-S137 PolarHBondContact O-N 3.49Å; P133-S137 PolarHBondContact O-OG 3Å
134E87.9Confident87.6Confident148 Ų148103.2 Ų103.269%0.69254%0.536SS*.Hα-helixtrans-68.4-36.8176.5-64.3-172.9-178.600112D132 S137 S138D132-E134 PolarHBondContact O-N 2.82Å; E134-S137 PolarHBondContact O-N 3.39Å; E134-S138 WeakPolarHBondContact O-CB 3.18Å; E134-S138 PolarHBondContact O-N 3.22Å
135Y87.7Confident87.2Confident60 Ų60104.8 Ų104.824%0.23555%0.55CS..Hα-helixtrans-64.7-43.3176.2178.9-109000112V117 N121 P131 D132 S137 S138 L139V117-Y135 HydrophobicContact CG1-CD2 3.52Å; V117-Y135 HydrophobicContact CG1-CE2 3.77Å; N121-Y135 HydrophobicContact CB-CD1 3.78Å; N121-Y135 HydrophobicContact CB-CE1 3.89Å; N121-Y135 HydrophobicContact CB-CG 4.11Å; N121-Y135 VanDerWaalsContact CG-CB 3.46Å; N121-Y135 VanDerWaalsContact ND2-CB 3.32Å; N121-Y135 WeakPolarHBondContact ND2-CB 3.4Å; N121-Y135 WeakPolarHBondContact ND2-CD2 3.43Å; N121-Y135 WeakPolarHBondContact OD1-CB 3.49Å; N121-Y135 WeakPolarHBondContact OD1-CD1 3.49Å; P131-Y135 HydrophobicContact CB-CD1 4.49Å; D132-Y135 WeakPolarHBondContact O-CB 3.35Å; D132-Y135 PolarHBondContact O-N 3.48Å; Y135-S137 VanDerWaalsContact C-N 3.32Å; Y135-S137 PolarHBondContact O-N 3.19Å; Y135-S138 PolarHBondContact O-N 2.81Å; Y135-L139 HydrophobicContact CD1-CD1 4.05Å; Y135-L139 HydrophobicContact CE1-CD1 3.53Å; Y135-L139 HydrophobicContact CE1-CG 4.31Å; Y135-L139 PolarHBondContact O-N 3.49Å
136L85.7Confident86.7Confident80 Ų80103.8 Ų103.842%0.41955%0.55SS.*Hα-helixtrans-61.9-42.5174.4-69.3-178.8000111.8P131 D132 P133 S138 L139 Q140P131-L136 HydrophobicContact CB-CG 4.49Å; P131-L136 HydrophobicContact CG-CD1 3.7Å; P131-L136 HydrophobicContact CG-CD2 3.71Å; P131-L136 HydrophobicContact CG-CG 3.67Å; D132-L136 PolarHBondContact O-N 2.98Å; D132-L136 VanDerWaalsContact O-N 3.17Å; P133-L136 PolarHBondContact O-N 3.36Å; L136-S138 VanDerWaalsContact C-N 3.3Å; L136-S138 PolarHBondContact O-N 3.07Å; L136-L139 PolarHBondContact O-N 3.33Å; L136-Q140 WeakPolarHBondContact O-CG 3.47Å; L136-Q140 PolarHBondContact O-N 3.26Å
137S87.7Confident86.1Confident70 Ų7098.2 Ų98.249%0.4954%0.539SS..Hα-helixtrans-62-40.1176.7-55.20000111.4P133 E134 Y135 Q140 S141P133-S137 PolarHBondContact O-N 3.49Å; P133-S137 PolarHBondContact O-OG 3Å; E134-S137 PolarHBondContact O-N 3.39Å; Y135-S137 VanDerWaalsContact C-N 3.32Å; Y135-S137 PolarHBondContact O-N 3.19Å; S137-Q140 PolarHBondContact O-N 3.48Å; S137-S141 PolarHBondContact O-N 3.26Å
138S85.4Confident85.4Confident74 Ų7497.4 Ų97.452%0.51754%0.537SS..Hα-helixtrans-66-36.1176-173.80000112.8E134 Y135 L136 M142E134-S138 WeakPolarHBondContact O-CB 3.18Å; E134-S138 PolarHBondContact O-N 3.22Å; Y135-S138 PolarHBondContact O-N 2.81Å; L136-S138 VanDerWaalsContact C-N 3.3Å; L136-S138 PolarHBondContact O-N 3.07Å; S138-M142 WeakPolarHBondContact O-CG 3.12Å
139L81.4Confident84.6Confident88 Ų8894.4 Ų94.446%0.46153%0.531SS..Hα-helixtrans-70.2-38.4176-73.3175.9000112Y135 L136 S141 M142Y135-L139 HydrophobicContact CD1-CD1 4.05Å; Y135-L139 HydrophobicContact CE1-CD1 3.53Å; Y135-L139 HydrophobicContact CE1-CG 4.31Å; Y135-L139 PolarHBondContact O-N 3.49Å; L136-L139 PolarHBondContact O-N 3.33Å; L139-S141 VanDerWaalsContact C-N 3.33Å; L139-M142 PolarHBondContact O-N 2.84Å
140Q82.9Confident83.8Confident137 Ų13797.2 Ų97.264%0.6453%0.528SS*.Hα-helixtrans-66.1-35.4176.1-73.4177.4-20.300112.3L136 S137 M142 Q143L136-Q140 WeakPolarHBondContact O-CG 3.47Å; L136-Q140 PolarHBondContact O-N 3.26Å; S137-Q140 PolarHBondContact O-N 3.48Å; Q140-M142 PolarHBondContact O-N 3.02Å; Q140-Q143 PolarHBondContact O-N 3.21Å
141S82.5Confident83.3Confident101 Ų10199.9 Ų99.971%0.70654%0.535SS*.THydrogen-bonded Turntrans-69.3-13.2176.8-172.70000114S137 L139S137-S141 PolarHBondContact O-N 3.26Å; L139-S141 VanDerWaalsContact C-N 3.33Å
142M72.9Confident82.6Confident162 Ų162105.7 Ų105.780%0.79856%0.563SS**THydrogen-bonded Turntrans-95.4-3.7179.4-68.9-71.6-64.200113.1S138 L139 Q140S138-M142 WeakPolarHBondContact O-CG 3.12Å; L139-M142 PolarHBondContact O-N 2.84Å; Q140-M142 PolarHBondContact O-N 3.02Å
143Q57.5Low81.8Confident231 Ų231112.2 Ų112.2100%1.07960%0.598SS**  trans-95.60172.1-94.4-176-29.700111.2Q140Q140-Q143 PolarHBondContact O-N 3.21Å

Retrieved 143 of 143 residues in 48.6 ms (Link to these results)