Z4YLN8_MOUSE Loading...

Coiled coil domain containing 88A

AlphaFold DB , UniProt , Accession Z4YLN8, Species MOUSE (Mus musculus, Mouse), Gene Ccdc88a, Length 354 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
1I63.2Low88.3Confident191 Ų191108.8 Ų108.898%0.97959%0.589SS**  0-47.40-55.2174.6000111.6T4 K5I1-T4 PolarHBondContact O-N 3.18Å; I1-K5 PolarHBondContact O-N 3.39Å
2T80.3Confident89.1Confident126 Ų126109.3 Ų109.377%0.77359%0.59SS**Hα-helixtrans-62.1-4217948.40000114.3T4 K5 L6T2-T4 VanDerWaalsContact C-N 3.34Å; T2-T4 PolarHBondContact O-N 3.09Å; T2-K5 PolarHBondContact O-N 3.39Å; T2-L6 PolarHBondContact O-N 2.9Å
3S78.9Confident89.7Confident91 Ų91109.8 Ų109.864%0.63659%0.592SS**Hα-helixtrans-60.7-39179-167.60000113.3N7S3-N7 PolarHBondContact O-N 3.41Å; S3-N7 VanDerWaalsContact O-N 3.09Å
4T89.3Confident90.3Very high88 Ų88107.7 Ų107.754%0.5459%0.589SS.*Hα-helixtrans-69.4-39-179-35.90000111.4I1 T2 N7 N8I1-T4 PolarHBondContact O-N 3.18Å; T2-T4 VanDerWaalsContact C-N 3.34Å; T2-T4 PolarHBondContact O-N 3.09Å; T4-N7 PolarHBondContact O-N 3.08Å; T4-N8 PolarHBondContact O-N 3.46Å; T4-N8 VanDerWaalsContact O-N 3.08Å; T4-N8 PolarHBondContact O-ND2 3.34Å; T4-N8 PolarHBondContact O-OD1 2.96Å
5K90.1Very high90.8Very high143 Ų143109.4 Ų109.462%0.62259%0.591SS**Hα-helixtrans-66.3-40.7177.4-172175.4-179178.10112.2I1 T2 N8 Q9I1-K5 PolarHBondContact O-N 3.39Å; T2-K5 PolarHBondContact O-N 3.39Å; K5-N8 PolarHBondContact O-N 3.47Å; K5-Q9 WeakPolarHBondContact O-CG 3.46Å; K5-Q9 PolarHBondContact O-N 3.43Å; K5-Q9 VanDerWaalsContact O-N 3.12Å
6L93.7Very high91.2Very high109 Ų109108.9 Ų108.957%0.57159%0.588SS**Hα-helixtrans-63.2-44.8175.2-170.977000111T2 N8 Q9 C10T2-L6 PolarHBondContact O-N 2.9Å; L6-N8 VanDerWaalsContact C-N 3.35Å; L6-N8 PolarHBondContact O-N 2.92Å; L6-Q9 WeakPolarHBondContact O-CB 3.4Å; L6-Q9 PolarHBondContact O-N 3.38Å; L6-Q9 VanDerWaalsContact O-N 3.15Å; L6-C10 PolarHBondContact O-N 2.92Å; L6-C10 PolarHBondContact O-SG 3.16Å; L6-C10 VanDerWaalsContact O-SG 3.38Å
7N92.6Very high91.6Very high85 Ų85109.8 Ų109.846%0.45559%0.585SS.*Hα-helixtrans-59.6-44.7178.5-166.569.5000112.1S3 T4 Q9 C10 E11S3-N7 PolarHBondContact O-N 3.41Å; S3-N7 VanDerWaalsContact O-N 3.09Å; T4-N7 PolarHBondContact O-N 3.08Å; N7-Q9 VanDerWaalsContact C-N 3.31Å; N7-Q9 PolarHBondContact O-N 3.5Å; N7-C10 WeakPolarHBondContact O-CB 3.49Å; N7-C10 PolarHBondContact O-N 3.38Å; N7-C10 VanDerWaalsContact O-N 3.16Å; N7-E11 PolarHBondContact ND2-OE1 3.42Å; N7-E11 PolarHBondContact O-N 3.38Å
8N94.9Very high92Very high88 Ų88105.4 Ų105.447%0.47157%0.57SS.*Hα-helixtrans-62.4-37.5176.6-65.2-14.1000112.4T4 K5 L6 E11 L12T4-N8 PolarHBondContact O-N 3.46Å; T4-N8 VanDerWaalsContact O-N 3.08Å; T4-N8 PolarHBondContact O-ND2 3.34Å; T4-N8 PolarHBondContact O-OD1 2.96Å; K5-N8 PolarHBondContact O-N 3.47Å; L6-N8 VanDerWaalsContact C-N 3.35Å; L6-N8 PolarHBondContact O-N 2.92Å; N8-E11 PolarHBondContact O-N 2.96Å; N8-L12 WeakPolarHBondContact O-CB 3.44Å; N8-L12 PolarHBondContact O-N 2.94Å
9Q95.6Very high92.3Very high106 Ų106104.3 Ų104.350%0.49556%0.564SS.*Hα-helixtrans-66.4-40.4174.7-74.4-177.1-27.200111.8K5 L6 N7 L12 L13K5-Q9 WeakPolarHBondContact O-CG 3.46Å; K5-Q9 PolarHBondContact O-N 3.43Å; K5-Q9 VanDerWaalsContact O-N 3.12Å; L6-Q9 WeakPolarHBondContact O-CB 3.4Å; L6-Q9 PolarHBondContact O-N 3.38Å; L6-Q9 VanDerWaalsContact O-N 3.15Å; N7-Q9 VanDerWaalsContact C-N 3.31Å; N7-Q9 PolarHBondContact O-N 3.5Å; Q9-L12 PolarHBondContact O-N 3.3Å; Q9-L13 WeakPolarHBondContact O-CB 3.49Å; Q9-L13 VanDerWaalsContact O-CG 3.29Å; Q9-L13 WeakPolarHBondContact O-CG 3.43Å; Q9-L13 PolarHBondContact O-N 3.19Å
10C95.4Very high92.6Very high70 Ų70104.2 Ų104.247%0.47356%0.562SS.*Hα-helixtrans-63.4-42.8175-68.80000112.2L6 N7 L13 S14L6-C10 PolarHBondContact O-N 2.92Å; L6-C10 PolarHBondContact O-SG 3.16Å; L6-C10 VanDerWaalsContact O-SG 3.38Å; N7-C10 WeakPolarHBondContact O-CB 3.49Å; N7-C10 PolarHBondContact O-N 3.38Å; N7-C10 VanDerWaalsContact O-N 3.16Å; C10-L13 PolarHBondContact O-N 3.42Å; C10-S14 WeakPolarHBondContact O-CB 2.83Å; C10-S14 PolarHBondContact O-N 3.04Å
11E96.9Very high92.8Very high100 Ų100103.6 Ų103.647%0.46756%0.556SS.*Hα-helixtrans-62.2-46.4176.4-77.1174.5-167.600111.9N7 N8 L13 S14 Q15N7-E11 PolarHBondContact ND2-OE1 3.42Å; N7-E11 PolarHBondContact O-N 3.38Å; N8-E11 PolarHBondContact O-N 2.96Å; E11-L13 PolarHBondContact O-N 3.15Å; E11-S14 PolarHBondContact O-N 3.49Å; E11-Q15 WeakPolarHBondContact O-CG 3.39Å; E11-Q15 PolarHBondContact O-N 3.22Å
12L98Very high94.5Very high114 Ų11498.8 Ų98.860%0.59753%0.529SS*.Hα-helixtrans-61.7-44.6177.3-17963.9000111.8N8 Q9 S14 Q15 L16N8-L12 WeakPolarHBondContact O-CB 3.44Å; N8-L12 PolarHBondContact O-N 2.94Å; Q9-L12 PolarHBondContact O-N 3.3Å; L12-S14 VanDerWaalsContact C-N 3.29Å; L12-S14 PolarHBondContact O-N 2.99Å; L12-Q15 PolarHBondContact O-N 3.29Å; L12-L16 PolarHBondContact O-N 2.91Å
13L97.6Very high95.3Very high117 Ų11797.8 Ų97.861%0.61352%0.516SS*.Hα-helixtrans-61.5-39.1176.1-75.8170.5000111.6Q9 C10 E11 L16 K17Q9-L13 WeakPolarHBondContact O-CB 3.49Å; Q9-L13 VanDerWaalsContact O-CG 3.29Å; Q9-L13 WeakPolarHBondContact O-CG 3.43Å; Q9-L13 PolarHBondContact O-N 3.19Å; C10-L13 PolarHBondContact O-N 3.42Å; E11-L13 PolarHBondContact O-N 3.15Å; L13-L16 PolarHBondContact O-N 3.47Å; L13-K17 VanDerWaalsContact O-CB 3.29Å; L13-K17 WeakPolarHBondContact O-CB 3.5Å; L13-K17 PolarHBondContact O-N 3.49Å
14S97.3Very high96.2Very high80 Ų8097.9 Ų97.956%0.55951%0.509SS*.Hα-helixtrans-67.6-38.2178-158.60000112.1C10 E11 L12 G18C10-S14 WeakPolarHBondContact O-CB 2.83Å; C10-S14 PolarHBondContact O-N 3.04Å; E11-S14 PolarHBondContact O-N 3.49Å; L12-S14 VanDerWaalsContact C-N 3.29Å; L12-S14 PolarHBondContact O-N 2.99Å; S14-G18 PolarHBondContact O-N 3.12Å
15Q97.8Very high96.7Very high133 Ų13399.9 Ų99.962%0.62151%0.507SS*.Hα-helixtrans-65.3-46.5173.7-72.3177.312.800111.6E11 L12 K17 G18 N19E11-Q15 WeakPolarHBondContact O-CG 3.39Å; E11-Q15 PolarHBondContact O-N 3.22Å; L12-Q15 PolarHBondContact O-N 3.29Å; Q15-K17 VanDerWaalsContact C-N 3.31Å; Q15-K17 PolarHBondContact O-N 3.41Å; Q15-G18 PolarHBondContact O-N 3.35Å; Q15-N19 PolarHBondContact O-N 2.93Å
16L98.1Very high97.1Very high101 Ų10198 Ų9853%0.52950%0.5SS..Hα-helixtrans-61.2-43.1178.3-163.386.2000111.1L12 L13 N19 L20L12-L16 PolarHBondContact O-N 2.91Å; L13-L16 PolarHBondContact O-N 3.47Å; L16-N19 PolarHBondContact O-N 2.99Å; L16-L20 WeakPolarHBondContact O-CG 3.35Å; L16-L20 PolarHBondContact O-N 2.91Å
17K97.6Very high97.3Very high124 Ų12497.5 Ų97.554%0.53950%0.497SS..Hα-helixtrans-59.6-48174.5178.7-179.7169.4-1790111.4L13 Q15 N19 L20 E21L13-K17 VanDerWaalsContact O-CB 3.29Å; L13-K17 WeakPolarHBondContact O-CB 3.5Å; L13-K17 PolarHBondContact O-N 3.49Å; Q15-K17 VanDerWaalsContact C-N 3.31Å; Q15-K17 PolarHBondContact O-N 3.41Å; K17-N19 VanDerWaalsContact C-N 3.3Å; K17-N19 PolarHBondContact O-N 3.45Å; K17-L20 PolarHBondContact O-N 2.99Å; K17-E21 WeakPolarHBondContact CE-OE1 3.29Å; K17-E21 HydrophobicContact CG-CG 4.47Å; K17-E21 IonicContact NZ-OE1 3.8Å; K17-E21 WeakPolarHBondContact O-CB 3.29Å; K17-E21 WeakPolarHBondContact O-CG 3.42Å; K17-E21 PolarHBondContact O-N 3.15Å
18G98.3Very high97.6Very high31 Ų3198.1 Ų98.132%0.3250%0.5SS..Hα-helixtrans-59.3-41.3177.900000112.6S14 Q15 E21 E22S14-G18 PolarHBondContact O-N 3.12Å; Q15-G18 PolarHBondContact O-N 3.35Å; G18-E21 PolarHBondContact O-N 3.43Å; G18-E22 PolarHBondContact O-N 3.16Å
19N98.2Very high97.8Very high84 Ų8498.3 Ų98.345%0.44950%0.501SS..Hα-helixtrans-63.2-47.7176.3-170.515.9000111.7Q15 L16 K17 E21 E22 E23Q15-N19 PolarHBondContact O-N 2.93Å; L16-N19 PolarHBondContact O-N 2.99Å; K17-N19 VanDerWaalsContact C-N 3.3Å; K17-N19 PolarHBondContact O-N 3.45Å; N19-E21 VanDerWaalsContact C-N 3.3Å; N19-E21 PolarHBondContact O-N 2.93Å; N19-E22 PolarHBondContact O-N 3Å; N19-E22 VanDerWaalsContact O-N 3.15Å; N19-E23 PolarHBondContact O-N 3.33Å
20L98.2Very high97.9Very high102 Ų10299 Ų9953%0.53450%0.504SS..Hα-helixtrans-61.7-38.2176.4-70.2172.8000112.3L16 K17 E22 N24L16-L20 WeakPolarHBondContact O-CG 3.35Å; L16-L20 PolarHBondContact O-N 2.91Å; K17-L20 PolarHBondContact O-N 2.99Å; L20-E22 VanDerWaalsContact C-N 3.33Å; L20-N24 WeakPolarHBondContact O-CB 3.45Å; L20-N24 PolarHBondContact O-N 3.37Å
21E97.9Very high98.1Very high92 Ų92100.2 Ų100.243%0.4351%0.505SS..Hα-helixtrans-65.7-36.7175.7-75176.2176.300112K17 G18 N19 R25K17-E21 WeakPolarHBondContact CE-OE1 3.29Å; K17-E21 HydrophobicContact CG-CG 4.47Å; K17-E21 IonicContact NZ-OE1 3.8Å; K17-E21 WeakPolarHBondContact O-CB 3.29Å; K17-E21 WeakPolarHBondContact O-CG 3.42Å; K17-E21 PolarHBondContact O-N 3.15Å; G18-E21 PolarHBondContact O-N 3.43Å; N19-E21 VanDerWaalsContact C-N 3.3Å; N19-E21 PolarHBondContact O-N 2.93Å; E21-R25 WeakPolarHBondContact O-CG 3.32Å; E21-R25 PolarHBondContact O-N 2.94Å
22E98.2Very high98.2Very high91 Ų91101.7 Ų101.743%0.42551%0.512SS..Hα-helixtrans-70.7-46.3176.7-175.4158.1-134.600112.5G18 N19 L20 N24 R25 H26G18-E22 PolarHBondContact O-N 3.16Å; N19-E22 PolarHBondContact O-N 3Å; N19-E22 VanDerWaalsContact O-N 3.15Å; L20-E22 VanDerWaalsContact C-N 3.33Å; E22-N24 VanDerWaalsContact C-N 3.27Å; E22-N24 PolarHBondContact O-N 3Å; E22-R25 WeakPolarHBondContact O-CB 3.2Å; E22-R25 PolarHBondContact O-N 3.46Å; E22-R25 VanDerWaalsContact O-N 3.16Å; E22-R25 IonicContact OE1-NH2 3.92Å; E22-H26 PolarHBondContact O-CD2 2.93Å; E22-H26 VanDerWaalsContact O-CD2 3.22Å; E22-H26 PolarHBondContact O-N 3.37Å
23E97.6Very high98.2Very high105 Ų10599.9 Ų99.949%0.49151%0.506SS..Hα-helixtrans-59.5-40.2173.2-69.7-168.4138.400111.4N19 H26 L27N19-E23 PolarHBondContact O-N 3.33Å; E23-H26 PolarHBondContact O-N 2.95Å; E23-L27 VanDerWaalsContact O-CG 3.32Å; E23-L27 WeakPolarHBondContact O-CG 3.37Å; E23-L27 PolarHBondContact O-N 3.45Å
24N97.9Very high98.3Very high92 Ų9298.8 Ų98.849%0.49250%0.5SS..Hα-helixtrans-62.5-43.4175.4-167.5-9.7000111.6L20 E22 H26 L27 L28L20-N24 WeakPolarHBondContact O-CB 3.45Å; L20-N24 PolarHBondContact O-N 3.37Å; E22-N24 VanDerWaalsContact C-N 3.27Å; E22-N24 PolarHBondContact O-N 3Å; N24-H26 VanDerWaalsContact C-N 3.35Å; N24-H26 PolarHBondContact O-N 3.36Å; N24-L27 PolarHBondContact O-N 3.22Å; N24-L28 WeakPolarHBondContact O-CG 3.33Å; N24-L28 PolarHBondContact O-N 3.24Å
25R98.6Very high98.3Very high131 Ų131100.8 Ų100.849%0.49450%0.502SS..Hα-helixtrans-58-46.2172.3-74.4-168.9-58-96.42.5111.8E21 E22 L27 L28 D29E21-R25 WeakPolarHBondContact O-CG 3.32Å; E21-R25 PolarHBondContact O-N 2.94Å; E22-R25 WeakPolarHBondContact O-CB 3.2Å; E22-R25 PolarHBondContact O-N 3.46Å; E22-R25 VanDerWaalsContact O-N 3.16Å; E22-R25 IonicContact OE1-NH2 3.92Å; R25-L27 PolarHBondContact O-N 2.89Å; R25-L28 PolarHBondContact O-N 2.97Å; R25-D29 PolarHBondContact O-N 3.48Å
26H98.7Very high98.3Very high102 Ų10299.7 Ų99.747%0.47250%0.5SS..Hα-helixtrans-63-40.6178.7-71.9-48.1000113.1E22 E23 N24 L28 D29 Q30E22-H26 PolarHBondContact O-CD2 2.93Å; E22-H26 VanDerWaalsContact O-CD2 3.22Å; E22-H26 PolarHBondContact O-N 3.37Å; E23-H26 PolarHBondContact O-N 2.95Å; N24-H26 VanDerWaalsContact C-N 3.35Å; N24-H26 PolarHBondContact O-N 3.36Å; H26-L28 VanDerWaalsContact C-N 3.33Å; H26-D29 PolarHBondContact O-N 3.39Å; H26-Q30 WeakPolarHBondContact O-CG 3.47Å; H26-Q30 PolarHBondContact O-N 3.35Å
27L98.7Very high98.4Very high99 Ų9999.9 Ų99.952%0.51850%0.498SS..Hα-helixtrans-63.4-40.8175.5-71.6172000111.4E23 N24 R25 Q30 I31E23-L27 VanDerWaalsContact O-CG 3.32Å; E23-L27 WeakPolarHBondContact O-CG 3.37Å; E23-L27 PolarHBondContact O-N 3.45Å; N24-L27 PolarHBondContact O-N 3.22Å; R25-L27 PolarHBondContact O-N 2.89Å; L27-Q30 PolarHBondContact O-N 2.98Å; L27-I31 VanDerWaalsContact O-CG1 3.27Å; L27-I31 WeakPolarHBondContact O-CG1 3.42Å; L27-I31 PolarHBondContact O-N 3.47Å
28L98.6Very high98.4Very high99 Ų9999 Ų9952%0.51850%0.499SS..Hα-helixtrans-63.5-42.4175.6-70.5171.8000112.1N24 R25 H26 Q30 I31 Q32N24-L28 WeakPolarHBondContact O-CG 3.33Å; N24-L28 PolarHBondContact O-N 3.24Å; R25-L28 PolarHBondContact O-N 2.97Å; H26-L28 VanDerWaalsContact C-N 3.33Å; L28-Q30 VanDerWaalsContact C-N 3.34Å; L28-Q30 PolarHBondContact O-N 3.32Å; L28-I31 PolarHBondContact O-N 2.9Å; L28-Q32 PolarHBondContact O-N 3.3Å
29D98.6Very high98.4Very high91 Ų91105.2 Ų105.249%0.48751%0.513SS..Hα-helixtrans-63.3-39.4175.8-76.3-8.2000111.9R25 H26 Q32 T33R25-D29 PolarHBondContact O-N 3.48Å; H26-D29 PolarHBondContact O-N 3.39Å; D29-Q32 PolarHBondContact O-N 2.91Å; D29-T33 WeakPolarHBondContact O-CB 3.49Å; D29-T33 PolarHBondContact O-N 2.98Å; D29-T33 PolarHBondContact O-OG1 2.87Å
30Q98.7Very high98.4Very high120 Ų120104 Ų10456%0.56151%0.509SS*.Hα-helixtrans-64.4-43.5174.3-73.5179.111.400111.7H26 L27 L28 Q32 T33 L34H26-Q30 WeakPolarHBondContact O-CG 3.47Å; H26-Q30 PolarHBondContact O-N 3.35Å; L27-Q30 PolarHBondContact O-N 2.98Å; L28-Q30 VanDerWaalsContact C-N 3.34Å; L28-Q30 PolarHBondContact O-N 3.32Å; Q30-Q32 VanDerWaalsContact C-N 3.33Å; Q30-Q32 PolarHBondContact O-N 2.93Å; Q30-T33 PolarHBondContact O-N 3.45Å; Q30-L34 WeakPolarHBondContact O-CB 3.41Å; Q30-L34 WeakPolarHBondContact O-CG 3.41Å; Q30-L34 PolarHBondContact O-N 3.26Å
31I98.4Very high98.4Very high97 Ų97104.1 Ų104.150%0.49751%0.51SS..Hα-helixtrans-60.4-45.1175.5-70.8164.6000110.3L27 L28 T33 L34 M35L27-I31 VanDerWaalsContact O-CG1 3.27Å; L27-I31 WeakPolarHBondContact O-CG1 3.42Å; L27-I31 PolarHBondContact O-N 3.47Å; L28-I31 PolarHBondContact O-N 2.9Å; I31-T33 VanDerWaalsContact C-N 3.34Å; I31-T33 PolarHBondContact O-N 3.24Å; I31-L34 PolarHBondContact O-N 2.84Å; I31-M35 WeakPolarHBondContact O-CB 3.34Å; I31-M35 PolarHBondContact O-N 2.95Å
32Q98.6Very high98.5Very high131 Ų131104.8 Ų104.861%0.61252%0.516SS*.Hα-helixtrans-62.9-42.7178.3-173.2176.459.400111.5L28 D29 Q30 M35 L36L28-Q32 PolarHBondContact O-N 3.3Å; D29-Q32 PolarHBondContact O-N 2.91Å; Q30-Q32 VanDerWaalsContact C-N 3.33Å; Q30-Q32 PolarHBondContact O-N 2.93Å; Q32-M35 WeakPolarHBondContact O-CB 3.35Å; Q32-M35 PolarHBondContact O-N 2.87Å; Q32-L36 PolarHBondContact O-N 3.33Å
33T98.7Very high98.5Very high75 Ų75105.1 Ų105.146%0.4652%0.517SS..Hα-helixtrans-62.6-45.9176.5-58.60000111.4D29 Q30 I31 M35 L36 Q37D29-T33 WeakPolarHBondContact O-CB 3.49Å; D29-T33 PolarHBondContact O-N 2.98Å; D29-T33 PolarHBondContact O-OG1 2.87Å; Q30-T33 PolarHBondContact O-N 3.45Å; I31-T33 VanDerWaalsContact C-N 3.34Å; I31-T33 PolarHBondContact O-N 3.24Å; T33-M35 VanDerWaalsContact C-N 3.33Å; T33-M35 PolarHBondContact O-N 2.98Å; T33-L36 PolarHBondContact O-N 3.47Å; T33-Q37 WeakPolarHBondContact O-CG 3.32Å; T33-Q37 PolarHBondContact O-N 2.86Å
34L98.8Very high98.5Very high94 Ų94105.4 Ų105.449%0.49252%0.518SS..Hα-helixtrans-63.6-38.1176.3-78.6168.8000112.3Q30 I31 L36 Q37 N38Q30-L34 WeakPolarHBondContact O-CB 3.41Å; Q30-L34 WeakPolarHBondContact O-CG 3.41Å; Q30-L34 PolarHBondContact O-N 3.26Å; I31-L34 PolarHBondContact O-N 2.84Å; L34-L36 VanDerWaalsContact C-N 3.34Å; L34-Q37 PolarHBondContact O-N 3.36Å; L34-N38 WeakPolarHBondContact O-CB 3.45Å; L34-N38 PolarHBondContact O-N 3.1Å; L34-N38 PolarHBondContact O-ND2 3.3Å
35M98.3Very high98.5Very high123 Ų123104.7 Ų104.761%0.60651%0.514SS*.Hα-helixtrans-62.6-43.9175.4-171.3-163.1-50.200110.8I31 Q32 T33 N38 R39I31-M35 WeakPolarHBondContact O-CB 3.34Å; I31-M35 PolarHBondContact O-N 2.95Å; Q32-M35 WeakPolarHBondContact O-CB 3.35Å; Q32-M35 PolarHBondContact O-N 2.87Å; T33-M35 VanDerWaalsContact C-N 3.33Å; T33-M35 PolarHBondContact O-N 2.98Å; M35-N38 PolarHBondContact O-N 3.4Å; M35-R39 PolarHBondContact O-N 3.26Å
36L98.7Very high98.4Very high109 Ų109100.8 Ų100.857%0.57150%0.503SS*.Hα-helixtrans-63.7-45.1176.4-17762.9000111.4Q32 T33 L34 N38 R39 T40Q32-L36 PolarHBondContact O-N 3.33Å; T33-L36 PolarHBondContact O-N 3.47Å; L34-L36 VanDerWaalsContact C-N 3.34Å; L36-N38 PolarHBondContact O-N 3.46Å; L36-R39 WeakPolarHBondContact O-CB 3.44Å; L36-R39 PolarHBondContact O-N 2.92Å; L36-T40 PolarHBondContact O-N 3.37Å; L36-T40 PolarHBondContact O-OG1 3.19Å; L36-T40 VanDerWaalsContact O-OG1 3.1Å
37Q98.6Very high98.4Very high106 Ų106102 Ų10250%0.49551%0.509SS..Hα-helixtrans-59.5-45.2176.1-73.6177.1-17.800112T33 L34 R39 T40 L41T33-Q37 WeakPolarHBondContact O-CG 3.32Å; T33-Q37 PolarHBondContact O-N 2.86Å; L34-Q37 PolarHBondContact O-N 3.36Å; Q37-R39 VanDerWaalsContact C-N 3.32Å; Q37-R39 PolarHBondContact O-N 2.91Å; Q37-T40 PolarHBondContact O-N 2.96Å; Q37-L41 WeakPolarHBondContact O-CB 3.27Å; Q37-L41 WeakPolarHBondContact O-CG 3.37Å; Q37-L41 PolarHBondContact O-N 3.48Å
38N98.2Very high98.3Very high105 Ų105101.1 Ų101.156%0.56151%0.51SS*.Hα-helixtrans-61.3-41.1176.6-85.9-66.9000112.1L34 M35 L36 L41 L42L34-N38 WeakPolarHBondContact O-CB 3.45Å; L34-N38 PolarHBondContact O-N 3.1Å; L34-N38 PolarHBondContact O-ND2 3.3Å; M35-N38 PolarHBondContact O-N 3.4Å; L36-N38 PolarHBondContact O-N 3.46Å; N38-L41 PolarHBondContact O-N 3.33Å; N38-L42 WeakPolarHBondContact O-CB 3.45Å; N38-L42 PolarHBondContact O-N 3.3Å
39R98.3Very high98.3Very high162 Ų162101.4 Ų101.461%0.61151%0.507SS*.Hα-helixtrans-60.4-50.8174.9177.5-178.9170.9173.4-0.4111.3M35 L36 Q37 L41 L42 E43M35-R39 PolarHBondContact O-N 3.26Å; L36-R39 WeakPolarHBondContact O-CB 3.44Å; L36-R39 PolarHBondContact O-N 2.92Å; Q37-R39 VanDerWaalsContact C-N 3.32Å; Q37-R39 PolarHBondContact O-N 2.91Å; R39-L41 VanDerWaalsContact C-N 3.33Å; R39-L41 PolarHBondContact O-N 3.41Å; R39-L42 WeakPolarHBondContact O-CB 3.45Å; R39-L42 PolarHBondContact O-N 2.93Å; R39-E43 WeakPolarHBondContact CG-OE1 3.36Å; R39-E43 IonicContact CZ-OE1 3.61Å; R39-E43 IonicContact NE-OE1 2.87Å; R39-E43 PolarHBondContact NE-OE1 2.9Å; R39-E43 IonicContact NH2-OE1 3.45Å; R39-E43 PolarHBondContact NH2-OE1 2.96Å; R39-E43 WeakPolarHBondContact O-CG 3.41Å; R39-E43 PolarHBondContact O-N 3.44Å
40T98.4Very high98.3Very high58 Ų58101.3 Ų101.336%0.35651%0.507SS..Hα-helixtrans-61.6-41.5-180-55.70000111.8L36 Q37 L42 E43 Q44L36-T40 PolarHBondContact O-N 3.37Å; L36-T40 PolarHBondContact O-OG1 3.19Å; L36-T40 VanDerWaalsContact O-OG1 3.1Å; Q37-T40 PolarHBondContact O-N 2.96Å; T40-L42 VanDerWaalsContact C-N 3.32Å; T40-L42 PolarHBondContact O-N 3.18Å; T40-E43 PolarHBondContact O-N 3.23Å; T40-Q44 WeakPolarHBondContact O-CG 3.39Å; T40-Q44 PolarHBondContact O-N 2.94Å
41L98.6Very high98.2Very high105 Ų105101 Ų10155%0.5551%0.509SS..Hα-helixtrans-62.8-39.8176.2-75.6171.7000112Q37 N38 R39 N45Q37-L41 WeakPolarHBondContact O-CB 3.27Å; Q37-L41 WeakPolarHBondContact O-CG 3.37Å; Q37-L41 PolarHBondContact O-N 3.48Å; N38-L41 PolarHBondContact O-N 3.33Å; R39-L41 VanDerWaalsContact C-N 3.33Å; R39-L41 PolarHBondContact O-N 3.41Å; L41-N45 WeakPolarHBondContact O-CB 3.27Å; L41-N45 PolarHBondContact O-N 2.95Å
42L98.4Very high98.2Very high106 Ų106101.3 Ų101.356%0.55551%0.507SS*.Hα-helixtrans-64.7-43.9175.9-176.164.3000111.2N38 R39 T40 N45 M46N38-L42 WeakPolarHBondContact O-CB 3.45Å; N38-L42 PolarHBondContact O-N 3.3Å; R39-L42 WeakPolarHBondContact O-CB 3.45Å; R39-L42 PolarHBondContact O-N 2.93Å; T40-L42 VanDerWaalsContact C-N 3.32Å; T40-L42 PolarHBondContact O-N 3.18Å; L42-N45 WeakPolarHBondContact O-CB 3.47Å; L42-N45 PolarHBondContact O-N 3.42Å; L42-M46 WeakPolarHBondContact O-CG 3.26Å; L42-M46 PolarHBondContact O-N 3.32Å
43E98.1Very high98.2Very high98 Ų9899 Ų9946%0.45850%0.495SS..Hα-helixtrans-58.9-49.5175.7-73172.5-172.700111R39 T40 N45 M46 E47R39-E43 WeakPolarHBondContact CG-OE1 3.36Å; R39-E43 IonicContact CZ-OE1 3.61Å; R39-E43 IonicContact NE-OE1 2.87Å; R39-E43 PolarHBondContact NE-OE1 2.9Å; R39-E43 IonicContact NH2-OE1 3.45Å; R39-E43 PolarHBondContact NH2-OE1 2.96Å; R39-E43 WeakPolarHBondContact O-CG 3.41Å; R39-E43 PolarHBondContact O-N 3.44Å; T40-E43 PolarHBondContact O-N 3.23Å; E43-N45 VanDerWaalsContact C-N 3.3Å; E43-N45 PolarHBondContact O-N 2.92Å; E43-M46 PolarHBondContact O-N 3.46Å; E43-E47 PolarHBondContact O-N 2.98Å
44Q98.4Very high98.2Very high110 Ų11098.5 Ų98.551%0.51449%0.492SS..Hα-helixtrans-59.3-38.3175.5-72.8179.8-15.700112.8T40 S48T40-Q44 WeakPolarHBondContact O-CG 3.39Å; T40-Q44 PolarHBondContact O-N 2.94Å; Q44-S48 VanDerWaalsContact O-CB 3.28Å; Q44-S48 WeakPolarHBondContact O-CB 3.12Å; Q44-S48 PolarHBondContact O-N 2.83Å
45N98.1Very high98.1Very high77 Ų7797.9 Ų97.941%0.41249%0.487SS..Hα-helixtrans-65.6-40178.4-170.6-100.1000112.1L41 L42 E43 K49L41-N45 WeakPolarHBondContact O-CB 3.27Å; L41-N45 PolarHBondContact O-N 2.95Å; L42-N45 WeakPolarHBondContact O-CB 3.47Å; L42-N45 PolarHBondContact O-N 3.42Å; E43-N45 VanDerWaalsContact C-N 3.3Å; E43-N45 PolarHBondContact O-N 2.92Å; N45-K49 WeakPolarHBondContact O-CG 3.28Å; N45-K49 PolarHBondContact O-N 2.99Å; N45-K49 VanDerWaalsContact O-N 3.13Å; N45-K49 VanDerWaalsContact OD1-CE 3.27Å; N45-K49 WeakPolarHBondContact OD1-CE 3.18Å; N45-K49 PolarHBondContact OD1-NZ 3.48Å
46M97Very high98.1Very high50 Ų5095.9 Ų95.925%0.24648%0.476CS..Hα-helixtrans-69.6-43.9177.8-68.3-57.2-5600111.3L42 E43 S48 K49 D50 M192L42-M46 WeakPolarHBondContact O-CG 3.26Å; L42-M46 PolarHBondContact O-N 3.32Å; E43-M46 PolarHBondContact O-N 3.46Å; M46-S48 PolarHBondContact O-N 2.88Å; M46-K49 PolarHBondContact O-N 2.94Å; M46-D50 PolarHBondContact O-N 3.29Å; M46-M192 HydrophobicContact CE-CE 3.4Å; M46-M192 HydrophobicContact CE-SD 3.88Å; M46-M192 HydrophobicContact CG-CE 3.7Å; M46-M192 HydrophobicContact CG-SD 4.08Å; M46-M192 HydrophobicContact SD-CE 3.5Å; M46-M192 VanDerWaalsContact SD-CE 3.5Å; M46-M192 HydrophobicContact SD-SD 4.44Å
47E97.6Very high98.1Very high128 Ų12897.3 Ų97.360%0.59847%0.474SS*.Hα-helixtrans-61.4-43.8176.2-174.3173.5-158.500111.7E43 K49 D50 L51E43-E47 PolarHBondContact O-N 2.98Å; E47-K49 VanDerWaalsContact C-N 3.33Å; E47-K49 PolarHBondContact O-N 3.36Å; E47-D50 PolarHBondContact O-N 2.92Å; E47-L51 HydrophobicContact CG-CD1 4.19Å; E47-L51 WeakPolarHBondContact O-CD1 3.32Å; E47-L51 PolarHBondContact O-N 3.24Å
48S97.6Very high98.1Very high80 Ų8098 Ų9856%0.55948%0.477SS*.Hα-helixtrans-60.3-41.3175.9179.90000112.3Q44 M46 L51 F52Q44-S48 VanDerWaalsContact O-CB 3.28Å; Q44-S48 WeakPolarHBondContact O-CB 3.12Å; Q44-S48 PolarHBondContact O-N 2.83Å; M46-S48 PolarHBondContact O-N 2.88Å; S48-L51 PolarHBondContact O-N 2.83Å; S48-F52 PolarHBondContact O-N 3.31Å
49K98.3Very high98.1Very high104 Ų10499 Ų9945%0.45247%0.474SS..Hα-helixtrans-65.4-41.6174.7-78170.7175.4158.60112.1N45 M46 E47 F52 H53N45-K49 WeakPolarHBondContact O-CG 3.28Å; N45-K49 PolarHBondContact O-N 2.99Å; N45-K49 VanDerWaalsContact O-N 3.13Å; N45-K49 VanDerWaalsContact OD1-CE 3.27Å; N45-K49 WeakPolarHBondContact OD1-CE 3.18Å; N45-K49 PolarHBondContact OD1-NZ 3.48Å; M46-K49 PolarHBondContact O-N 2.94Å; E47-K49 VanDerWaalsContact C-N 3.33Å; E47-K49 PolarHBondContact O-N 3.36Å; K49-F52 WeakPolarHBondContact O-CB 3.46Å; K49-F52 PolarHBondContact O-N 2.88Å; K49-H53 PolarHBondContact O-CD2 3.29Å; K49-H53 PolarHBondContact O-N 3.2Å
50D97.6Very high98.1Very high90 Ų9095.4 Ų95.448%0.48147%0.466SS..Hα-helixtrans-64-42.1178.3-76.7-16.9000111.4M46 E47 F52 H53 V54M46-D50 PolarHBondContact O-N 3.29Å; E47-D50 PolarHBondContact O-N 2.92Å; D50-F52 PolarHBondContact O-N 2.81Å; D50-H53 PolarHBondContact O-N 3.45Å; D50-V54 WeakPolarHBondContact O-CG2 3.45Å; D50-V54 PolarHBondContact O-N 3.49Å
51L98.1Very high98.1Very high114 Ų11497.5 Ų97.560%0.59748%0.475SS*.Hα-helixtrans-57.8-48.2172.1-101.569.9000111.6E47 S48 H53 V54 E55E47-L51 HydrophobicContact CG-CD1 4.19Å; E47-L51 WeakPolarHBondContact O-CD1 3.32Å; E47-L51 PolarHBondContact O-N 3.24Å; S48-L51 PolarHBondContact O-N 2.83Å; L51-H53 VanDerWaalsContact C-N 3.27Å; L51-H53 PolarHBondContact O-N 3.49Å; L51-V54 PolarHBondContact O-N 3.2Å; L51-V54 VanDerWaalsContact O-N 3.14Å; L51-E55 WeakPolarHBondContact O-CB 3.28Å; L51-E55 PolarHBondContact O-N 3.05Å
52F98.3Very high98.1Very high103 Ų10398.8 Ų98.845%0.45248%0.476SS..Hα-helixtrans-57.9-40.1176.9176.5-99.5000112S48 K49 D50 E55 Q56S48-F52 PolarHBondContact O-N 3.31Å; K49-F52 WeakPolarHBondContact O-CB 3.46Å; K49-F52 PolarHBondContact O-N 2.88Å; D50-F52 PolarHBondContact O-N 2.81Å; F52-E55 PolarHBondContact O-N 3.24Å; F52-Q56 HydrophobicContact CD1-CG 4.17Å; F52-Q56 HydrophobicContact CE1-CG 3.76Å; F52-Q56 HydrophobicContact CE2-CG 4.13Å; F52-Q56 HydrophobicContact CZ-CG 3.75Å; F52-Q56 VanDerWaalsContact CZ-NE2 3.32Å; F52-Q56 WeakPolarHBondContact O-CB 3.4Å; F52-Q56 VanDerWaalsContact O-CG 3.25Å; F52-Q56 WeakPolarHBondContact O-CG 3.37Å; F52-Q56 PolarHBondContact O-N 3.44Å
53H98Very high98.1Very high81 Ų8198.2 Ų98.238%0.37547%0.473SS..Hα-helixtrans-69.8-36177.1-72.3-51.6000113.4K49 D50 L51 R57K49-H53 PolarHBondContact O-CD2 3.29Å; K49-H53 PolarHBondContact O-N 3.2Å; D50-H53 PolarHBondContact O-N 3.45Å; L51-H53 VanDerWaalsContact C-N 3.27Å; L51-H53 PolarHBondContact O-N 3.49Å; H53-R57 WeakPolarHBondContact O-CG 3.5Å; H53-R57 PolarHBondContact O-N 2.92Å; H53-R57 VanDerWaalsContact O-N 3.15Å; H53-R57 PolarHBondContact O-NE 2.92Å; H53-R57 VanDerWaalsContact O-NE 3.11Å
54V98.3Very high98.1Very high65 Ų6596.9 Ų96.939%0.39447%0.469SS..Hα-helixtrans-63.2-47.2171.2172.10000110.3D50 L51 Q56 R57 Q58D50-V54 WeakPolarHBondContact O-CG2 3.45Å; D50-V54 PolarHBondContact O-N 3.49Å; L51-V54 PolarHBondContact O-N 3.2Å; L51-V54 VanDerWaalsContact O-N 3.14Å; V54-Q56 PolarHBondContact O-N 2.92Å; V54-R57 WeakPolarHBondContact O-CB 3.16Å; V54-R57 PolarHBondContact O-N 3.23Å; V54-R57 VanDerWaalsContact O-N 3.14Å; V54-Q58 WeakPolarHBondContact O-CG 3.44Å; V54-Q58 PolarHBondContact O-N 3.46Å
55E97.9Very high98.1Very high82 Ų8294.9 Ų94.938%0.38346%0.46SS..Hα-helixtrans-62.5-45.1-179.4-158-166-175.700111.9L51 F52 R57 Q58 Y59L51-E55 WeakPolarHBondContact O-CB 3.28Å; L51-E55 PolarHBondContact O-N 3.05Å; F52-E55 PolarHBondContact O-N 3.24Å; E55-R57 VanDerWaalsContact C-N 3.28Å; E55-R57 PolarHBondContact O-N 3.49Å; E55-Q58 WeakPolarHBondContact O-CB 3.4Å; E55-Q58 PolarHBondContact O-N 3.05Å; E55-Q58 VanDerWaalsContact O-N 3.07Å; E55-Y59 HydrophobicContact CB-CE2 4.45Å; E55-Y59 HydrophobicContact CG-CD2 4.19Å; E55-Y59 HydrophobicContact CG-CE2 3.49Å; E55-Y59 VanDerWaalsContact CG-CE2 3.49Å; E55-Y59 VanDerWaalsContact O-CD2 3.22Å; E55-Y59 WeakPolarHBondContact O-CD2 3.38Å; E55-Y59 PolarHBondContact O-N 3.4Å; E55-Y59 WeakPolarHBondContact OE1-CE2 3.27Å; E55-Y59 PolarHBondContact OE1-OH 3.43Å
56Q98.3Very high98.2Very high81 Ų8195.2 Ų95.238%0.37946%0.461SS..Hα-helixtrans-56.4-41.6173.2-77.3-70-17.200112.5F52 V54 Y59 I60F52-Q56 HydrophobicContact CD1-CG 4.17Å; F52-Q56 HydrophobicContact CE1-CG 3.76Å; F52-Q56 HydrophobicContact CE2-CG 4.13Å; F52-Q56 HydrophobicContact CZ-CG 3.75Å; F52-Q56 VanDerWaalsContact CZ-NE2 3.32Å; F52-Q56 WeakPolarHBondContact O-CB 3.4Å; F52-Q56 VanDerWaalsContact O-CG 3.25Å; F52-Q56 WeakPolarHBondContact O-CG 3.37Å; F52-Q56 PolarHBondContact O-N 3.44Å; V54-Q56 PolarHBondContact O-N 2.92Å; Q56-Y59 PolarHBondContact O-N 3.13Å; Q56-I60 WeakPolarHBondContact O-CD1 3.41Å; Q56-I60 VanDerWaalsContact O-CG1 3.28Å; Q56-I60 WeakPolarHBondContact O-CG1 3.36Å; Q56-I60 PolarHBondContact O-N 3.15Å
57R98.2Very high98.2Very high138 Ų138100.3 Ų100.352%0.52148%0.477SS..Hα-helixtrans-63.1-43.8174.8-78.9177.5-74.4-1450.5111.4H53 V54 E55 Y59 I60 D61H53-R57 WeakPolarHBondContact O-CG 3.5Å; H53-R57 PolarHBondContact O-N 2.92Å; H53-R57 VanDerWaalsContact O-N 3.15Å; H53-R57 PolarHBondContact O-NE 2.92Å; H53-R57 VanDerWaalsContact O-NE 3.11Å; V54-R57 WeakPolarHBondContact O-CB 3.16Å; V54-R57 PolarHBondContact O-N 3.23Å; V54-R57 VanDerWaalsContact O-N 3.14Å; E55-R57 VanDerWaalsContact C-N 3.28Å; E55-R57 PolarHBondContact O-N 3.49Å; R57-Y59 VanDerWaalsContact C-N 3.34Å; R57-Y59 PolarHBondContact O-N 2.93Å; R57-I60 WeakPolarHBondContact O-CB 3.36Å; R57-I60 PolarHBondContact O-N 2.93Å; R57-I60 VanDerWaalsContact O-N 3.15Å; R57-D61 PolarHBondContact O-N 3.11Å
58Q98.5Very high98.3Very high120 Ų120100.4 Ų100.456%0.56147%0.472SS*.Hα-helixtrans-59.6-42.6176.3-67.9179.613.900112.3V54 E55 I60 D61 K62V54-Q58 WeakPolarHBondContact O-CG 3.44Å; V54-Q58 PolarHBondContact O-N 3.46Å; E55-Q58 WeakPolarHBondContact O-CB 3.4Å; E55-Q58 PolarHBondContact O-N 3.05Å; E55-Q58 VanDerWaalsContact O-N 3.07Å; Q58-I60 VanDerWaalsContact C-N 3.33Å; Q58-I60 PolarHBondContact O-N 2.86Å; Q58-D61 PolarHBondContact O-N 3.14Å; Q58-K62 WeakPolarHBondContact O-CB 3.49Å; Q58-K62 PolarHBondContact O-N 3.2Å
59Y98.5Very high98.3Very high127 Ų127100.7 Ų100.750%0.49847%0.465SS..Hα-helixtrans-63.2-39.8175.7-69.6-52.7000112.4E55 Q56 R57 K62 L63E55-Y59 HydrophobicContact CB-CE2 4.45Å; E55-Y59 HydrophobicContact CG-CD2 4.19Å; E55-Y59 HydrophobicContact CG-CE2 3.49Å; E55-Y59 VanDerWaalsContact CG-CE2 3.49Å; E55-Y59 VanDerWaalsContact O-CD2 3.22Å; E55-Y59 WeakPolarHBondContact O-CD2 3.38Å; E55-Y59 PolarHBondContact O-N 3.4Å; E55-Y59 WeakPolarHBondContact OE1-CE2 3.27Å; E55-Y59 PolarHBondContact OE1-OH 3.43Å; Q56-Y59 PolarHBondContact O-N 3.13Å; R57-Y59 VanDerWaalsContact C-N 3.34Å; R57-Y59 PolarHBondContact O-N 2.93Å; Y59-K62 PolarHBondContact O-N 3.5Å; Y59-L63 WeakPolarHBondContact O-CB 3.42Å; Y59-L63 VanDerWaalsContact O-CG 3.28Å; Y59-L63 WeakPolarHBondContact O-CG 3.47Å; Y59-L63 PolarHBondContact O-N 2.78Å
60I98.3Very high98.3Very high86 Ų86101.5 Ų101.544%0.44147%0.468SS..Hα-helixtrans-62.9-45.3175.3-69.3164000110.7Q56 R57 Q58 K62 L63 N64Q56-I60 WeakPolarHBondContact O-CD1 3.41Å; Q56-I60 VanDerWaalsContact O-CG1 3.28Å; Q56-I60 WeakPolarHBondContact O-CG1 3.36Å; Q56-I60 PolarHBondContact O-N 3.15Å; R57-I60 WeakPolarHBondContact O-CB 3.36Å; R57-I60 PolarHBondContact O-N 2.93Å; R57-I60 VanDerWaalsContact O-N 3.15Å; Q58-I60 VanDerWaalsContact C-N 3.33Å; Q58-I60 PolarHBondContact O-N 2.86Å; I60-K62 VanDerWaalsContact C-N 3.35Å; I60-K62 PolarHBondContact O-N 3.41Å; I60-L63 PolarHBondContact O-N 2.87Å; I60-N64 WeakPolarHBondContact CG2-ND2 3.44Å; I60-N64 WeakPolarHBondContact O-CB 3.49Å; I60-N64 PolarHBondContact O-N 3.14Å; I60-N64 PolarHBondContact O-ND2 2.91Å
61D98.4Very high98.3Very high103 Ų103103.2 Ų103.255%0.55147%0.474SS*.Hα-helixtrans-63.9-41.4178.9-68.2-22.1000111.3R57 Q58 L63 N64 E65R57-D61 PolarHBondContact O-N 3.11Å; Q58-D61 PolarHBondContact O-N 3.14Å; D61-L63 PolarHBondContact O-N 2.93Å; D61-N64 PolarHBondContact O-N 3.15Å; D61-E65 PolarHBondContact O-N 3.06Å
62K98.6Very high98.3Very high132 Ų132101.9 Ų101.957%0.57446%0.463SS*.Hα-helixtrans-61.5-44.6174.2-17463.7177.3-1730112Q58 Y59 I60 N64 E65 L66Q58-K62 WeakPolarHBondContact O-CB 3.49Å; Q58-K62 PolarHBondContact O-N 3.2Å; Y59-K62 PolarHBondContact O-N 3.5Å; I60-K62 VanDerWaalsContact C-N 3.35Å; I60-K62 PolarHBondContact O-N 3.41Å; K62-N64 VanDerWaalsContact C-N 3.31Å; K62-N64 PolarHBondContact O-N 3.48Å; K62-E65 PolarHBondContact O-N 3Å; K62-L66 WeakPolarHBondContact O-CG 3.25Å; K62-L66 PolarHBondContact O-N 3.47Å
63L98.6Very high98.3Very high93 Ų93102 Ų10249%0.48747%0.467SS..Hα-helixtrans-62.1-39.5175.2-75.9170.3000111.8Y59 I60 D61 L66 R67Y59-L63 WeakPolarHBondContact O-CB 3.42Å; Y59-L63 VanDerWaalsContact O-CG 3.28Å; Y59-L63 WeakPolarHBondContact O-CG 3.47Å; Y59-L63 PolarHBondContact O-N 2.78Å; I60-L63 PolarHBondContact O-N 2.87Å; D61-L63 PolarHBondContact O-N 2.93Å; L63-L66 PolarHBondContact O-N 2.91Å; L63-R67 VanDerWaalsContact O-CG 3.32Å; L63-R67 WeakPolarHBondContact O-CG 3.38Å; L63-R67 PolarHBondContact O-N 2.86Å
64N98.4Very high98.2Very high70 Ų70102.1 Ų102.137%0.37447%0.468SS..Hα-helixtrans-68.2-39.9178-70.9-29000111.8I60 D61 K62 R67 R68I60-N64 WeakPolarHBondContact CG2-ND2 3.44Å; I60-N64 WeakPolarHBondContact O-CB 3.49Å; I60-N64 PolarHBondContact O-N 3.14Å; I60-N64 PolarHBondContact O-ND2 2.91Å; D61-N64 PolarHBondContact O-N 3.15Å; K62-N64 VanDerWaalsContact C-N 3.31Å; K62-N64 PolarHBondContact O-N 3.48Å; N64-R67 WeakPolarHBondContact O-CB 3.44Å; N64-R67 PolarHBondContact O-N 3.43Å; N64-R67 PolarHBondContact OD1-NH1 3.3Å; N64-R67 VanDerWaalsContact OD1-NH1 3.09Å; N64-R68 PolarHBondContact O-N 2.97Å
65E98.6Very high98Very high69 Ų69104.3 Ų104.332%0.32247%0.474SS..Hα-helixtrans-64.6-42.4174.2-178.254.9-154.500111.2D61 K62 R67 R68 Q69D61-E65 PolarHBondContact O-N 3.06Å; K62-E65 PolarHBondContact O-N 3Å; E65-R67 VanDerWaalsContact C-N 3.31Å; E65-R67 PolarHBondContact O-N 3.33Å; E65-R68 PolarHBondContact O-N 3.28Å; E65-R68 VanDerWaalsContact O-N 3.14Å; E65-R68 IonicContact OE2-CZ 3.43Å; E65-R68 IonicContact OE2-NE 3.24Å; E65-R68 PolarHBondContact OE2-NE 2.65Å; E65-R68 IonicContact OE2-NH2 3.76Å; E65-Q69 WeakPolarHBondContact O-CG 3.28Å; E65-Q69 PolarHBondContact O-N 3.5Å; E65-Q69 PolarHBondContact OE1-NE2 2.88Å
66L98.5Very high97.9Very high83 Ų83107.4 Ų107.444%0.43549%0.486SS..Hα-helixtrans-60.9-39.3173.9-72.9173.2000112.3K62 L63 R68 Q69 K70K62-L66 WeakPolarHBondContact O-CG 3.25Å; K62-L66 PolarHBondContact O-N 3.47Å; L63-L66 PolarHBondContact O-N 2.91Å; L66-R68 VanDerWaalsContact C-N 3.35Å; L66-Q69 PolarHBondContact O-N 3.44Å; L66-K70 WeakPolarHBondContact O-CB 3.49Å; L66-K70 PolarHBondContact O-N 3.27Å
67R98.3Very high97.7Very high157 Ų157107.5 Ų107.559%0.59249%0.489SS*.Hα-helixtrans-61.5-42.9173.2-75.8172.1-179.7149.13.1111.8L63 N64 E65 K70 E71L63-R67 VanDerWaalsContact O-CG 3.32Å; L63-R67 WeakPolarHBondContact O-CG 3.38Å; L63-R67 PolarHBondContact O-N 2.86Å; N64-R67 WeakPolarHBondContact O-CB 3.44Å; N64-R67 PolarHBondContact O-N 3.43Å; N64-R67 PolarHBondContact OD1-NH1 3.3Å; N64-R67 VanDerWaalsContact OD1-NH1 3.09Å; E65-R67 VanDerWaalsContact C-N 3.31Å; E65-R67 PolarHBondContact O-N 3.33Å; R67-K70 WeakPolarHBondContact O-CB 3.41Å; R67-K70 PolarHBondContact O-N 3.21Å; R67-E71 PolarHBondContact O-N 2.88Å
68R98.4Very high97.4Very high130 Ų130106.8 Ų106.849%0.49149%0.493SS..Hα-helixtrans-66.9-38.2177.1-163.6175.480.2144.62.1112N64 E65 L66 E71 K72N64-R68 PolarHBondContact O-N 2.97Å; E65-R68 PolarHBondContact O-N 3.28Å; E65-R68 VanDerWaalsContact O-N 3.14Å; E65-R68 IonicContact OE2-CZ 3.43Å; E65-R68 IonicContact OE2-NE 3.24Å; E65-R68 PolarHBondContact OE2-NE 2.65Å; E65-R68 IonicContact OE2-NH2 3.76Å; L66-R68 VanDerWaalsContact C-N 3.35Å; R68-E71 PolarHBondContact O-N 3.29Å; R68-K72 VanDerWaalsContact O-CG 3.28Å; R68-K72 WeakPolarHBondContact O-CG 3.28Å; R68-K72 PolarHBondContact O-N 3.15Å
69Q98.4Very high97.1Very high86 Ų86105 Ų10540%0.40249%0.487SS..Hα-helixtrans-64.1-43.6173.9-72.1177.70.200111.3E65 L66 K72 L73E65-Q69 WeakPolarHBondContact O-CG 3.28Å; E65-Q69 PolarHBondContact O-N 3.5Å; E65-Q69 PolarHBondContact OE1-NE2 2.88Å; L66-Q69 PolarHBondContact O-N 3.44Å; Q69-K72 PolarHBondContact O-N 3.06Å; Q69-L73 WeakPolarHBondContact O-CG 3.45Å; Q69-L73 PolarHBondContact O-N 3.39Å
70K98Very high96.8Very high121 Ų121104 Ų10453%0.52649%0.487SS..Hα-helixtrans-58.5-49.3173.8177178.2-178.8-72.60111.4L66 R67 K72 L73 E74L66-K70 WeakPolarHBondContact O-CB 3.49Å; L66-K70 PolarHBondContact O-N 3.27Å; R67-K70 WeakPolarHBondContact O-CB 3.41Å; R67-K70 PolarHBondContact O-N 3.21Å; K70-K72 VanDerWaalsContact C-N 3.35Å; K70-K72 PolarHBondContact O-N 2.93Å; K70-L73 PolarHBondContact O-N 2.94Å; K70-L73 VanDerWaalsContact O-N 3.13Å; K70-E74 WeakPolarHBondContact CE-OE1 3.41Å; K70-E74 HydrophobicContact CG-CG 4.49Å; K70-E74 IonicContact NZ-OE1 2.62Å; K70-E74 PolarHBondContact NZ-OE1 3.26Å; K70-E74 IonicContact NZ-OE2 3.63Å; K70-E74 WeakPolarHBondContact O-CG 3.43Å; K70-E74 PolarHBondContact O-N 3.49Å
71E97.7Very high96.3Very high127 Ų127107.8 Ų107.859%0.59350%0.497SS*.Hα-helixtrans-58.7-44.7177.7-178.1176-155.200111.9R67 R68 L73 E74 E75R67-E71 PolarHBondContact O-N 2.88Å; R68-E71 PolarHBondContact O-N 3.29Å; E71-L73 VanDerWaalsContact C-N 3.31Å; E71-L73 PolarHBondContact O-N 3.07Å; E71-E74 PolarHBondContact O-N 2.9Å; E71-E75 WeakPolarHBondContact O-CB 3.47Å; E71-E75 PolarHBondContact O-N 3.46Å
72K97.7Very high95.4Very high86 Ų86110.7 Ų110.737%0.37451%0.505SS..Hα-helixtrans-62.2-36.9175.4-73.6171.8-179.9177.60113R68 Q69 K70 K76R68-K72 VanDerWaalsContact O-CG 3.28Å; R68-K72 WeakPolarHBondContact O-CG 3.28Å; R68-K72 PolarHBondContact O-N 3.15Å; Q69-K72 PolarHBondContact O-N 3.06Å; K70-K72 VanDerWaalsContact C-N 3.35Å; K70-K72 PolarHBondContact O-N 2.93Å; K72-K76 VanDerWaalsContact O-CG 3.3Å; K72-K76 WeakPolarHBondContact O-CG 3.48Å; K72-K76 PolarHBondContact O-N 3.41Å; K72-K76 VanDerWaalsContact O-N 3.07Å
73L97.9Very high93.9Very high104 Ų104113.3 Ų113.355%0.54552%0.517SS..Hα-helixtrans-70.7-40.9176.1-71.4173.9000110.9Q69 K70 E71 K76 I77Q69-L73 WeakPolarHBondContact O-CG 3.45Å; Q69-L73 PolarHBondContact O-N 3.39Å; K70-L73 PolarHBondContact O-N 2.94Å; K70-L73 VanDerWaalsContact O-N 3.13Å; E71-L73 VanDerWaalsContact C-N 3.31Å; E71-L73 PolarHBondContact O-N 3.07Å; L73-K76 PolarHBondContact O-N 3.06Å; L73-I77 WeakPolarHBondContact O-CB 3.48Å; L73-I77 VanDerWaalsContact O-CG1 3.24Å; L73-I77 WeakPolarHBondContact O-CG1 3.47Å; L73-I77 PolarHBondContact O-N 3.47Å
74E95.9Very high91.8Very high84 Ų84116.8 Ų116.839%0.39352%0.524SS..Hα-helixtrans-61.3-44.3174.1-74.1173.5165.800111.3K70 E71 I77 M78K70-E74 WeakPolarHBondContact CE-OE1 3.41Å; K70-E74 HydrophobicContact CG-CG 4.49Å; K70-E74 IonicContact NZ-OE1 2.62Å; K70-E74 PolarHBondContact NZ-OE1 3.26Å; K70-E74 IonicContact NZ-OE2 3.63Å; K70-E74 WeakPolarHBondContact O-CG 3.43Å; K70-E74 PolarHBondContact O-N 3.49Å; E71-E74 PolarHBondContact O-N 2.9Å; E74-I77 PolarHBondContact O-N 3.31Å; E74-M78 WeakPolarHBondContact O-CB 3.22Å; E74-M78 VanDerWaalsContact O-CG 3.27Å; E74-M78 WeakPolarHBondContact O-CG 3.36Å; E74-M78 PolarHBondContact O-N 2.98Å
75E95.3Very high89.4Confident112 Ų112118.4 Ų118.452%0.52353%0.533SS..Hα-helixtrans-58.5-48.4173.7-174.3179.5-164.400111.1E71 I77 M78 D79E71-E75 WeakPolarHBondContact O-CB 3.47Å; E71-E75 PolarHBondContact O-N 3.46Å; E75-I77 VanDerWaalsContact C-N 3.33Å; E75-I77 PolarHBondContact O-N 3.16Å; E75-M78 PolarHBondContact O-N 3.39Å; E75-D79 VanDerWaalsContact O-CB 3.3Å; E75-D79 WeakPolarHBondContact O-CB 3.39Å; E75-D79 PolarHBondContact O-N 3.09Å
76K96.3Very high87.4Confident146 Ų146120.2 Ų120.264%0.63555%0.551SS**Hα-helixtrans-59.7-41.7176.8-76.3177.2177.8-172.50113K72 L73 Q80K72-K76 VanDerWaalsContact O-CG 3.3Å; K72-K76 WeakPolarHBondContact O-CG 3.48Å; K72-K76 PolarHBondContact O-N 3.41Å; K72-K76 VanDerWaalsContact O-N 3.07Å; L73-K76 PolarHBondContact O-N 3.06Å; K76-Q80 VanDerWaalsContact O-CB 3.32Å; K76-Q80 WeakPolarHBondContact O-CB 3.2Å; K76-Q80 PolarHBondContact O-N 3.35Å
77I92.9Very high84.8Confident84 Ų84118.6 Ų118.643%0.43155%0.546SS..Hα-helixtrans-67.9-45.7178.1-71.1167.6000109.9L73 E74 E75 Q80 Y81L73-I77 WeakPolarHBondContact O-CB 3.48Å; L73-I77 VanDerWaalsContact O-CG1 3.24Å; L73-I77 WeakPolarHBondContact O-CG1 3.47Å; L73-I77 PolarHBondContact O-N 3.47Å; E74-I77 PolarHBondContact O-N 3.31Å; E75-I77 VanDerWaalsContact C-N 3.33Å; E75-I77 PolarHBondContact O-N 3.16Å; I77-Q80 WeakPolarHBondContact O-CB 3.28Å; I77-Q80 PolarHBondContact O-N 2.83Å; I77-Y81 HydrophobicContact CG2-CD2 3.66Å; I77-Y81 HydrophobicContact CG2-CE2 3.37Å; I77-Y81 WeakPolarHBondContact O-CD2 3.46Å; I77-Y81 PolarHBondContact O-N 2.9Å
78M92.8Very high82.8Confident123 Ų123116.1 Ų116.161%0.60655%0.551SS**Hα-helixtrans-63.1-41.8176.8-73.9-170.3-6100112.2E74 E75 Q80 Y81 K82E74-M78 WeakPolarHBondContact O-CB 3.22Å; E74-M78 VanDerWaalsContact O-CG 3.27Å; E74-M78 WeakPolarHBondContact O-CG 3.36Å; E74-M78 PolarHBondContact O-N 2.98Å; E75-M78 PolarHBondContact O-N 3.39Å; M78-Q80 VanDerWaalsContact C-N 3.32Å; M78-Y81 CarbonylContact O-C 3.49Å; M78-Y81 PolarHBondContact O-N 2.85Å; M78-K82 WeakPolarHBondContact O-CB 3.33Å; M78-K82 PolarHBondContact O-N 2.94Å
79D91.6Very high80.8Confident83 Ų83115.7 Ų115.744%0.44456%0.564SS.*Hα-helixtrans-64.2-39.7176.1-81.7-19000111.5E75 K82 F83E75-D79 VanDerWaalsContact O-CB 3.3Å; E75-D79 WeakPolarHBondContact O-CB 3.39Å; E75-D79 PolarHBondContact O-N 3.09Å; D79-K82 PolarHBondContact O-N 3.19Å; D79-F83 PolarHBondContact O-N 3.12Å
80Q92.2Very high78.8Confident106 Ų106120 Ų12050%0.49558%0.577SS.*Hα-helixtrans-56.3-57.2168.7-166.8173.223.700108.7K76 I77 M78 K82 F83 Y84K76-Q80 VanDerWaalsContact O-CB 3.32Å; K76-Q80 WeakPolarHBondContact O-CB 3.2Å; K76-Q80 PolarHBondContact O-N 3.35Å; I77-Q80 WeakPolarHBondContact O-CB 3.28Å; I77-Q80 PolarHBondContact O-N 2.83Å; M78-Q80 VanDerWaalsContact C-N 3.32Å; Q80-K82 PolarHBondContact O-N 2.86Å; Q80-K82 VanDerWaalsContact O-N 3.15Å; Q80-F83 CarbonylContact O-C 3.17Å; Q80-F83 WeakPolarHBondContact O-CA 3.36Å; Q80-F83 WeakPolarHBondContact O-CB 3.46Å; Q80-F83 PolarHBondContact O-N 3.45Å; Q80-Y84 HydrophobicContact CB-CD2 4.46Å; Q80-Y84 HydrophobicContact CG-CD2 3.46Å; Q80-Y84 VanDerWaalsContact CG-CD2 3.46Å; Q80-Y84 HydrophobicContact CG-CE2 3.37Å; Q80-Y84 WeakPolarHBondContact O-CD2 3.32Å; Q80-Y84 PolarHBondContact O-N 2.98Å
81Y87.3Confident76.8Confident164 Ų164126.1 Ų126.164%0.64360%0.597SS**Hα-helixtrans-57.5-30.6177-75.4-64.5000114.7I77 M78 F83 Y84 D85I77-Y81 HydrophobicContact CG2-CD2 3.66Å; I77-Y81 HydrophobicContact CG2-CE2 3.37Å; I77-Y81 WeakPolarHBondContact O-CD2 3.46Å; I77-Y81 PolarHBondContact O-N 2.9Å; M78-Y81 CarbonylContact O-C 3.49Å; M78-Y81 PolarHBondContact O-N 2.85Å; Y81-F83 VanDerWaalsContact C-N 3.31Å; Y81-Y84 CarbonylContact O-C 3.6Å; Y81-Y84 PolarHBondContact O-N 3.4Å; Y81-D85 PolarHBondContact O-N 3.27Å
82K80.6Confident74.9Confident165 Ų165129.8 Ų129.872%0.71761%0.605SS**Hα-helixtrans-69.9-29.9175.8-168.6177.2-179-177.80112.3M78 D79 Q80M78-K82 WeakPolarHBondContact O-CB 3.33Å; M78-K82 PolarHBondContact O-N 2.94Å; D79-K82 PolarHBondContact O-N 3.19Å; Q80-K82 PolarHBondContact O-N 2.86Å; Q80-K82 VanDerWaalsContact O-N 3.15Å
83F66.8Low73Confident187 Ų187128.4 Ų128.482%0.8262%0.616SS**Hα-helixtrans-83.6-27.8171.2-135.2-87000112.4D79 Q80 Y81D79-F83 PolarHBondContact O-N 3.12Å; Q80-F83 CarbonylContact O-C 3.17Å; Q80-F83 WeakPolarHBondContact O-CA 3.36Å; Q80-F83 WeakPolarHBondContact O-CB 3.46Å; Q80-F83 PolarHBondContact O-N 3.45Å; Y81-F83 VanDerWaalsContact C-N 3.31Å
84Y54.4Low71.6Confident165 Ų165128.5 Ų128.565%0.64762%0.617SS**SBendtrans-92.615.7172.9-74.2-85000113.4Q80 Y81 P86Q80-Y84 HydrophobicContact CB-CD2 4.46Å; Q80-Y84 HydrophobicContact CG-CD2 3.46Å; Q80-Y84 VanDerWaalsContact CG-CD2 3.46Å; Q80-Y84 HydrophobicContact CG-CE2 3.37Å; Q80-Y84 WeakPolarHBondContact O-CD2 3.32Å; Q80-Y84 PolarHBondContact O-N 2.98Å; Y81-Y84 CarbonylContact O-C 3.6Å; Y81-Y84 PolarHBondContact O-N 3.4Å; Y84-P86 WeakPolarHBondContact O-CD 3.38Å
85D47.8Very low70.7Confident105 Ų105133 Ų13356%0.56163%0.63SS**  trans-82.191.5147.3-177.526.6000104.5Y81 S87Y81-D85 PolarHBondContact O-N 3.27Å; D85-S87 PolarHBondContact O-N 3.14Å; D85-S87 PolarHBondContact OD1-N 3.38Å
86P57.1Low69.7Low107 Ų107131.9 Ų131.970%0.69563%0.627SS**  trans-6583.3156.133.1-32.3000104.2Y84Y84-P86 WeakPolarHBondContact O-CD 3.38Å
87S42.5Very low68.7Low49 Ų49128.5 Ų128.534%0.34362%0.618SS.*  trans-40.6123.4165.1177.20000105.9D85 P89D85-S87 PolarHBondContact O-N 3.14Å; D85-S87 PolarHBondContact OD1-N 3.38Å; S87-P89 WeakPolarHBondContact O-CA 3.43Å
88P57Low67.9Low105 Ų105130.2 Ų130.268%0.68263%0.628SS**THydrogen-bonded Turntrans-43.6123.4-173.3-28.831.2000108R90P88-R90 WeakPolarHBondContact O-CA 3.17Å; P88-R90 PolarHBondContact O-N 2.97Å
89P56.1Low67.1Low120 Ų120130.3 Ų130.378%0.77963%0.625SS**THydrogen-bonded Turntrans-34.8101.9-150.813.3-30.6000108.4S87 R91S87-P89 WeakPolarHBondContact O-CA 3.43Å; P89-R91 VanDerWaalsContact C-N 3.33Å; P89-R91 PolarHBondContact O-N 3.48Å
90R56.2Low66.5Low176 Ų176131.9 Ų131.966%0.66463%0.631SS**  trans-44.9108.6-174.3-91.7-178.8142.1-140.4-1.8105.7P88 R92P88-R90 WeakPolarHBondContact O-CA 3.17Å; P88-R90 PolarHBondContact O-N 2.97Å; R90-R92 HydrophobicContact CB-CB 4.4Å; R90-R92 PolarHBondContact O-N 2.87Å
91R57.5Low65.8Low251 Ų251134 Ų13495%0.94763%0.634SS**  trans-64.928.5171.6-78.7-96.4-166117.11.2110.1P89 G93P89-R91 VanDerWaalsContact C-N 3.33Å; P89-R91 PolarHBondContact O-N 3.48Å; R91-G93 PolarHBondContact O-N 3.28Å
92R57.3Low65.3Low204 Ų204134.2 Ų134.277%0.7764%0.638SS**  trans-76.158.6158.4-159.4169.3-174156.8-1.6107.3R90 N94R90-R92 HydrophobicContact CB-CB 4.4Å; R90-R92 PolarHBondContact O-N 2.87Å; R92-N94 PolarHBondContact O-N 3.24Å
93G56.4Low64.9Low57 Ų57131.3 Ų131.359%0.58863%0.63SS**  trans-58.1136.2166.700000107.4R91 W95R91-G93 PolarHBondContact O-N 3.28Å; G93-W95 PolarHBondContact O-N 3.26Å
94N69.6Low65Low106 Ų106128.1 Ų128.157%0.56762%0.62SS**  trans-46.5106.4167.2-103.216.1000108.3R92 I96 T97 L98R92-N94 PolarHBondContact O-N 3.24Å; N94-I96 PolarHBondContact O-N 3.47Å; N94-I96 VanDerWaalsContact O-N 3.1Å; N94-T97 WeakPolarHBondContact CB-OG1 3.3Å; N94-T97 WeakPolarHBondContact O-CA 3.17Å; N94-T97 WeakPolarHBondContact O-CB 3.42Å; N94-T97 PolarHBondContact O-N 3.32Å; N94-L98 PolarHBondContact O-N 2.85Å; N94-L98 VanDerWaalsContact O-N 3.08Å
95W77.5Confident65.5Low178 Ų178126.4 Ų126.467%0.67462%0.617SS**Hα-helixtrans-59.1-25.517866.8-87.7000110.5G93 L98 K99G93-W95 PolarHBondContact O-N 3.26Å; W95-L98 PolarHBondContact O-N 3.12Å; W95-K99 HydrophobicContact CE3-CD 4.35Å; W95-K99 HydrophobicContact CZ3-CD 3.93Å; W95-K99 VanDerWaalsContact O-CB 3.29Å; W95-K99 WeakPolarHBondContact O-CB 3.41Å; W95-K99 PolarHBondContact O-N 3.24Å
96I73.2Confident66Low89 Ų89124.8 Ų124.846%0.45661%0.613SS.*Hα-helixtrans-59.6-49.5169.3-65.7156000111.1N94 L98 K99 M100N94-I96 PolarHBondContact O-N 3.47Å; N94-I96 VanDerWaalsContact O-N 3.1Å; I96-L98 VanDerWaalsContact C-N 3.29Å; I96-L98 PolarHBondContact O-N 3.14Å; I96-K99 PolarHBondContact O-N 3.19Å; I96-M100 VanDerWaalsContact O-CG 3.28Å; I96-M100 WeakPolarHBondContact O-CG 3.48Å; I96-M100 PolarHBondContact O-N 3.03Å
97T75.5Confident65.9Low74 Ų74127.5 Ų127.545%0.45461%0.614SS.*Hα-helixtrans-63.4-37.2176.3-48.70000111.3N94 R101N94-T97 WeakPolarHBondContact CB-OG1 3.3Å; N94-T97 WeakPolarHBondContact O-CA 3.17Å; N94-T97 WeakPolarHBondContact O-CB 3.42Å; N94-T97 PolarHBondContact O-N 3.32Å; T97-R101 VanDerWaalsContact O-CB 3.26Å; T97-R101 WeakPolarHBondContact O-CB 3.49Å; T97-R101 PolarHBondContact O-N 3.26Å
98L75.8Confident66.6Low120 Ų120131 Ų13163%0.62862%0.623SS**Hα-helixtrans-67.7-38.8176.3-160.368.2000111.7N94 W95 I96 R101 K102N94-L98 PolarHBondContact O-N 2.85Å; N94-L98 VanDerWaalsContact O-N 3.08Å; W95-L98 PolarHBondContact O-N 3.12Å; I96-L98 VanDerWaalsContact C-N 3.29Å; I96-L98 PolarHBondContact O-N 3.14Å; L98-R101 PolarHBondContact O-N 3.05Å; L98-K102 WeakPolarHBondContact O-CB 3.33Å; L98-K102 PolarHBondContact O-N 3.03Å
99K76.1Confident66.3Low126 Ų126130.9 Ų130.955%0.54862%0.617SS.*Hα-helixtrans-68.6-43.3176.6-158.9177.2172-175.30111.5W95 I96 K102 L103W95-K99 HydrophobicContact CE3-CD 4.35Å; W95-K99 HydrophobicContact CZ3-CD 3.93Å; W95-K99 VanDerWaalsContact O-CB 3.29Å; W95-K99 WeakPolarHBondContact O-CB 3.41Å; W95-K99 PolarHBondContact O-N 3.24Å; I96-K99 PolarHBondContact O-N 3.19Å; K99-K102 PolarHBondContact O-N 3.29Å; K99-L103 PolarHBondContact O-N 3.08Å
100M80.1Confident66.2Low115 Ų115131.1 Ų131.157%0.56761%0.61SS**Hα-helixtrans-63-42.2173.5-67.3-63-106.400111.9I96 K102 L103 I104I96-M100 VanDerWaalsContact O-CG 3.28Å; I96-M100 WeakPolarHBondContact O-CG 3.48Å; I96-M100 PolarHBondContact O-N 3.03Å; M100-K102 VanDerWaalsContact C-N 3.3Å; M100-K102 PolarHBondContact O-N 3.23Å; M100-L103 PolarHBondContact O-N 3.17Å; M100-I104 WeakPolarHBondContact O-CD1 3.29Å; M100-I104 VanDerWaalsContact O-CG1 3.28Å; M100-I104 WeakPolarHBondContact O-CG1 3.47Å; M100-I104 PolarHBondContact O-N 2.96Å
101R76.5Confident65.9Low152 Ų152129 Ų12957%0.57461%0.612SS**Hα-helixtrans-62.1-36.9174.5-172.7-176.9-67.6-171.3-2.3111.8T97 L98 K105T97-R101 VanDerWaalsContact O-CB 3.26Å; T97-R101 WeakPolarHBondContact O-CB 3.49Å; T97-R101 PolarHBondContact O-N 3.26Å; L98-R101 PolarHBondContact O-N 3.05Å; R101-K105 WeakPolarHBondContact O-CB 3.4Å; R101-K105 PolarHBondContact O-N 3.47Å
102K76.4Confident65.6Low167 Ų167124.5 Ų124.573%0.72660%0.595SS**Hα-helixtrans-67.8-39.9176.6-166.8168.6-178.7174.40112.1L98 K99 M100 S106L98-K102 WeakPolarHBondContact O-CB 3.33Å; L98-K102 PolarHBondContact O-N 3.03Å; K99-K102 PolarHBondContact O-N 3.29Å; M100-K102 VanDerWaalsContact C-N 3.3Å; M100-K102 PolarHBondContact O-N 3.23Å; K102-S106 PolarHBondContact O-N 3.49Å; K102-S106 PolarHBondContact O-OG 3.42Å
103L72.3Confident65Low104 Ų104121.9 Ų121.955%0.54559%0.592SS.*Hα-helixtrans-67.9-35174.9-91.2139.2000113.6K99 M100 S106 K107K99-L103 PolarHBondContact O-N 3.08Å; M100-L103 PolarHBondContact O-N 3.17Å; L103-S106 PolarHBondContact O-OG 3.39Å; L103-S106 VanDerWaalsContact O-OG 3.08Å; L103-K107 PolarHBondContact O-N 3.13Å
104I70.3Confident64.4Low120 Ų120129.9 Ų129.962%0.61560%0.604SS**Hα-helixtrans-77.3-34.7177.6-63.1163.5000110.8M100 K107 K108M100-I104 WeakPolarHBondContact O-CD1 3.29Å; M100-I104 VanDerWaalsContact O-CG1 3.28Å; M100-I104 WeakPolarHBondContact O-CG1 3.47Å; M100-I104 PolarHBondContact O-N 2.96Å; I104-K107 PolarHBondContact O-N 3.36Å; I104-K108 PolarHBondContact O-N 3.23Å; I104-K108 VanDerWaalsContact O-N 3.1Å
105K63.9Low63.2Low130 Ų130132.2 Ų132.257%0.56561%0.612SS**Hα-helixtrans-69.4-41.4175.1-108.3157.6166.6177.80112.7R101 K107 K108 D109R101-K105 WeakPolarHBondContact O-CB 3.4Å; R101-K105 PolarHBondContact O-N 3.47Å; K105-K107 PolarHBondContact O-N 2.99Å; K105-K108 WeakPolarHBondContact O-CA 3.42Å; K105-K108 PolarHBondContact O-N 2.82Å; K105-D109 PolarHBondContact O-N 3.07Å
106S58.3Low61.4Low71 Ų71133.2 Ų133.250%0.49762%0.621SS.*Hα-helixtrans-62.9-28.1174.963.10000113.2K102 L103K102-S106 PolarHBondContact O-N 3.49Å; K102-S106 PolarHBondContact O-OG 3.42Å; L103-S106 PolarHBondContact O-OG 3.39Å; L103-S106 VanDerWaalsContact O-OG 3.08Å
107K55.3Low59.4Low164 Ų164133.8 Ų133.871%0.71363%0.633SS**Hα-helixtrans-77.6-23.6169.2-91.5-164.5173.7-173.80114.2L103 I104 K105L103-K107 PolarHBondContact O-N 3.13Å; I104-K107 PolarHBondContact O-N 3.36Å; K105-K107 PolarHBondContact O-N 2.99Å
108K57.6Low57.5Low122 Ų122138.3 Ų138.353%0.5365%0.653SS.*Hα-helixtrans-81.2-28.2178.4-170.5164.8-179.51730112.4I104 K105 R112I104-K108 PolarHBondContact O-N 3.23Å; I104-K108 VanDerWaalsContact O-N 3.1Å; K105-K108 WeakPolarHBondContact O-CA 3.42Å; K105-K108 PolarHBondContact O-N 2.82Å; K108-R112 PolarHBondContact O-N 3.34Å
109D51.2Low55.4Low103 Ų103138.9 Ų138.955%0.55166%0.662SS**Hα-helixtrans-76.2-36.3175.7-61.5-35.7000111.4K105 N111 R112 E113K105-D109 PolarHBondContact O-N 3.07Å; D109-N111 PolarHBondContact O-N 2.85Å; D109-R112 PolarHBondContact O-N 3.46Å; D109-E113 PolarHBondContact O-N 2.92Å
110I54.3Low53.4Low124 Ų124140.6 Ų140.664%0.63668%0.676SS**Hα-helixtrans-66.1-21.4175.7-135.379.7000113.8
111N49.2Very low51.1Low133 Ų133141.4 Ų141.471%0.71169%0.688SS**Hα-helixtrans-96.6-20.6179.6-162.8-90000112.8D109D109-N111 PolarHBondContact O-N 2.85Å
112R51.1Low49.5Very low155 Ų155140 Ų14059%0.58570%0.699SS**Hα-helixtrans-79.1-28174.6-168.783.675.5-158.17.7112.2K108 D109 R114 Q115K108-R112 PolarHBondContact O-N 3.34Å; D109-R112 PolarHBondContact O-N 3.46Å; R112-R114 VanDerWaalsContact C-N 3.28Å; R112-R114 PolarHBondContact O-N 3.38Å; R112-Q115 PolarHBondContact O-N 2.68Å
113E44.2Very low47.3Very low150 Ų150138.7 Ų138.770%0.70171%0.705SS**THydrogen-bonded Turntrans-71.3-17.6-172.4-152.7172.7-162.100114.1D109 Q115D109-E113 PolarHBondContact O-N 2.92Å; E113-Q115 VanDerWaalsContact C-N 3.28Å; E113-Q115 PolarHBondContact O-N 2.81Å
114R44.3Very low45.3Very low224 Ų224144.1 Ų144.185%0.84572%0.718SS**THydrogen-bonded Turntrans-78.3-5.4173.2-76.3-17366.5154.7-0.5114.8R112R112-R114 VanDerWaalsContact C-N 3.28Å; R112-R114 PolarHBondContact O-N 3.38Å
115Q44.2Very low43.5Very low156 Ų156143 Ų14373%0.72972%0.72SS**SBendtrans-140.369.2-177.9-69-74.7-40.400109.3R112 E113R112-Q115 PolarHBondContact O-N 2.68Å; E113-Q115 VanDerWaalsContact C-N 3.28Å; E113-Q115 PolarHBondContact O-N 2.81Å
116K39.2Very low41.8Very low199 Ų199143.4 Ų143.487%0.86573%0.729SS**  trans158.169.7155-83.5152.4-170.4-167.70110.1
117S32.6Very low40.6Very low101 Ų101145.5 Ų145.571%0.70674%0.744SS**  trans-106.197.1162.153.70000107.9
118L34.7Very low39.3Very low168 Ų168142.6 Ų142.688%0.8874%0.744SS**  trans-166.3125.7156-105.3141000110.2
119T30.8Very low38Very low132 Ų132146 Ų14681%0.8176%0.762SS**  trans101.695164-29.40000116.6
120L35.4Very low37.1Very low163 Ų163144.8 Ų144.885%0.85377%0.773SS**  trans-79.2143.4159.7-64.1166.6000109.9
121T31.1Very low35.8Very low131 Ų131148.7 Ų148.780%0.80479%0.786SS**  trans-161125.2140.525.90000110.2
122P43.6Very low35.6Very low124 Ų124149.1 Ų149.181%0.80579%0.788SS**  trans-100.2130.2169.732.8-23000110.7
123T29.8Very low34.7Very low139 Ų139149.5 Ų149.585%0.85380%0.796SS**  trans-133131.2168.7-41.90000110.8
124R29.7Very low34.4Very low218 Ų218149 Ų14982%0.82380%0.797SS**  trans-64.7165.3179.3-75.2170.469.2175.42.9114.3
125S33.3Very low34.5Very low95 Ų95143.8 Ų143.866%0.66479%0.793SS**  trans120.9109.3140.6-72.20000112.9
126D29.2Very low34Very low139 Ų139143.6 Ų143.674%0.74379%0.791SS**  99.9113.470.4-78.7-39.7000109.3
127S31.4Very low33.9Very low116 Ų116140.9 Ų140.981%0.81178%0.782SS**  trans-179.8128.4139.4-1680000112.8
128S28.9Very low33.6Very low102 Ų102141.5 Ų141.571%0.71378%0.777SS**  trans66.995.2157.874.80000121.6
129E30.6Very low33.6Very low194 Ų194138 Ų13891%0.90777%0.767SS**  27.9122124.8-57-173.416100118.1
130G31.2Very low33.9Very low77 Ų77140.3 Ų140.379%0.79477%0.768SS**  88.8121.569.900000108
131F27.4Very low33.5Very low207 Ų207138.9 Ų138.991%0.90876%0.762SS**  cis-172.6137.846.3-179.4-107.3000107.9
132L44.7Very low33.4Very low142 Ų142137.3 Ų137.374%0.74376%0.756SS**  trans-69.4157.6171.3-68.1161.9000110.1
133Q31.7Very low33.2Very low162 Ų162136.8 Ų136.876%0.75776%0.755SS**  158.3118.7114.6-163.159.438.900112.1
134L39.1Very low33.5Very low139 Ų139135.1 Ų135.173%0.72875%0.749SS**  trans-79.3152159-140.186000109.4
135P45.2Very low33.7Very low116 Ų116131 Ų13175%0.75375%0.748SS**  -144.1138.6107.332.7-15.5000112
136H34.9Very low33.8Very low151 Ų151129.8 Ų129.870%0.69975%0.75SS**  68.3132.474.8-150.555000116.3
137Q35.7Very low34.1Very low143 Ų143128.4 Ų128.467%0.66875%0.752SS**  trans80.6140.6167.3-56.8-142.3123.400117.2
138D26.6Very low34.3Very low114 Ų114130.3 Ų130.361%0.6175%0.753SS**  cis-172.7151.30.1-110.2-19.4000110.1
139S34.6Very low34.6Very low94 Ų94131 Ų13166%0.65776%0.758SS**  trans62.1141.4132.883.30000125.1
140Q36.9Very low35.1Very low180 Ų180128.8 Ų128.884%0.84175%0.751SS**  trans77.7149.9147.5-54.2-143.7-4400118.7
141D26.9Very low35.4Very low134 Ų134133 Ų13372%0.71775%0.75SS**  cis-176.7163.7-24.7-169.73.9000103.8
142S30.8Very low35.7Very low97 Ų97130.9 Ų130.968%0.67875%0.748SS**  trans79.8118.5155-65.40000121.7
143S38.1Very low35.2Very low114 Ų114127.7 Ų127.780%0.79775%0.75SS**  trans-42.5155.615354.10000115.9
144S36.5Very low35.2Very low103 Ų103129.1 Ų129.172%0.7276%0.757SS**  trans-170.9127.5134-152.80000114
145V33.4Very low35Very low132 Ų132129.4 Ų129.480%0.876%0.764SS**  trans43.7128.2145.1-54.90000121.8
146G35.1Very low34.4Very low69 Ų69132.3 Ų132.371%0.71177%0.773SS**  trans-72.1159.1166.200000113
147S35.7Very low34.3Very low111 Ų111128.2 Ų128.278%0.77677%0.772SS**  trans-155.2118.4152.7-73.90000109.7
148N37.3Very low34.2Very low156 Ų156128.5 Ų128.583%0.83478%0.783SS**  trans-34.8131.5147.445.6-31.1000114.3
149S33.5Very low34.7Very low117 Ų117133.2 Ų133.282%0.81880%0.798SS**  trans-144.3118.4153.4-163.50000109.9
150L41.6Very low35Very low147 Ų147138.8 Ų138.877%0.7781%0.811SS**  trans-61.8155.7156.1-162.985.5000108.3
151E38.4Very low34.8Very low165 Ų165135.8 Ų135.877%0.77181%0.81SS**  trans156.2144.2141.1-78.4-56132.300111.3
152D33.5Very low35.2Very low162 Ų162133.9 Ų133.987%0.86681%0.807SS**  trans-64.6165.9-173.6-101.4-41.8000116.5
153G33.1Very low35.5Very low76 Ų76137.8 Ų137.878%0.78482%0.816SS**  trans122.8122.9141.700000118.5
154Q33.1Very low36Very low191 Ų191139.5 Ų139.589%0.89382%0.822SS**  trans-55.6150.5-177.6-66.9152.919.500116.8
155T34.3Very low36.5Very low145 Ų145138.9 Ų138.989%0.8982%0.823SS**  -170153.4123.742.20000112.2
156L32.8Very low37.2Very low178 Ų178140.3 Ų140.393%0.93283%0.825SS**  trans-61.9148.9-166.6-84.579.2000117
157G32.5Very low37.6Very low65 Ų65145.1 Ų145.167%0.6783%0.826SS**  111.796.1124.500000118.1
158T34.5Very low38.1Very low148 Ų148151.9 Ų151.991%0.90884%0.835SS**  162.9130118.841.30000110.2
159K35.9Very low38.3Very low213 Ų213151 Ų15193%0.92683%0.83SS**  trans-81.3123.7-175.4-64179.9176.4-179.80110.4
160K41Very low38.9Very low212 Ų212150.1 Ų150.192%0.92282%0.821SS**  trans-133.3115.7148.5-77.3-174.9161.7-170.30108.1
161S33.4Very low38.9Very low117 Ų117153 Ų15382%0.81883%0.828SS**  trans-86.7152.9-173.9-173.40000111.7
162S35.8Very low39.3Very low94 Ų94151.4 Ų151.466%0.65782%0.824SS**  trans86.581.9141-178.10000119
163M35.1Very low40.2Very low178 Ų178154.7 Ų154.788%0.87782%0.824SS**  169.761.2117-94.3-168.7-69.700111.4
164V49.8Very low40.5Very low150 Ų150158 Ų15891%0.90982%0.823SS**  trans-139.175.1166.9-177.20000108.4
165A47.6Very low41.6Very low91 Ų91156.9 Ų156.975%0.75281%0.811SS**  trans-167.656.1166.500000111.9
166L47.9Very low42.3Very low161 Ų161153.6 Ų153.684%0.84379%0.793SS**SBendtrans-127.394.3154.3-74.6178.7000109.2
167K43.2Very low43.5Very low170 Ų170152.7 Ų152.774%0.73978%0.781SS**  trans54.694.2139.5-65.8176.1173.5178.70115.9L169K167-L169 VanDerWaalsContact C-N 3.27Å; K167-L169 PolarHBondContact O-N 3.38Å
168R44.7Very low44.6Very low254 Ų254155 Ų15596%0.95878%0.778SS**  trans-50.5100.2135.3-100.9-179.5175.4145.8-1.7107.4
169L42.5Very low45.8Very low137 Ų137154.8 Ų154.872%0.71776%0.764SS**  trans-77.3127.2159.6-71.1168.3000106.6K167 F171K167-L169 VanDerWaalsContact C-N 3.27Å; K167-L169 PolarHBondContact O-N 3.38Å; L169-F171 PolarHBondContact O-N 2.99Å
170P47.2Very low47.3Very low99 Ų99147.1 Ų147.164%0.64373%0.734SS**  trans-62.5124.3157.727.8-28.1000105.8L172P170-L172 HydrophobicContact CB-CD1 4.48Å; P170-L172 HydrophobicContact CG-CD1 4.04Å; P170-L172 PolarHBondContact O-N 2.85Å
171F39.9Very low48.5Very low207 Ų207143.2 Ų143.291%0.90872%0.716SS**  trans-57.291.9165.5-101.5-95.7000107.5L169 R173L169-F171 PolarHBondContact O-N 2.99Å; F171-R173 PolarHBondContact O-N 2.97Å
172L46.9Very low50.1Low131 Ų131144.1 Ų144.169%0.68671%0.71SS**  trans-66.990159.4-96.882.4000105.7P170 N174P170-L172 HydrophobicContact CB-CD1 4.48Å; P170-L172 HydrophobicContact CG-CD1 4.04Å; P170-L172 PolarHBondContact O-N 2.85Å; L172-N174 VanDerWaalsContact C-N 3.25Å; L172-N174 PolarHBondContact O-N 3.32Å
173R52.9Low51.7Low232 Ų232146 Ų14688%0.87571%0.706SS**  trans-58.7101.5155.3-175.8168.6170.2170.4-3.5105.2F171 R175F171-R173 PolarHBondContact O-N 2.97Å; R173-R175 PolarHBondContact O-N 3.27Å
174N39.4Very low53.2Low144 Ų144139.3 Ų139.377%0.7768%0.679SS**  trans-58.586.2173.9-74.3-59.4000108.5L172 P176L172-N174 VanDerWaalsContact C-N 3.25Å; L172-N174 PolarHBondContact O-N 3.32Å; N174-P176 WeakPolarHBondContact O-CD 3.46Å
175R56.4Low53.7Low169 Ų169136.2 Ų136.264%0.63866%0.663SS**  trans-73.3117.9162-168.5168.7174.3171.6-4.9104.7R173 K177 D180R173-R175 PolarHBondContact O-N 3.27Å; R175-K177 PolarHBondContact O-N 3.07Å; R175-D180 VanDerWaalsContact CD-OD2 3.29Å; R175-D180 WeakPolarHBondContact CD-OD2 3.18Å; R175-D180 IonicContact CZ-OD1 2.81Å; R175-D180 IonicContact CZ-OD2 3.38Å; R175-D180 VanDerWaalsContact CZ-OD2 3.24Å; R175-D180 IonicContact NE-OD1 3.54Å; R175-D180 PolarHBondContact NE-OD1 3.29Å; R175-D180 IonicContact NE-OD2 3.47Å; R175-D180 PolarHBondContact NE-OD2 2.9Å; R175-D180 IonicContact NH2-OD1 3.38Å; R175-D180 PolarHBondContact NH2-OD1 2.89Å; R175-D180 IonicContact NH2-OD2 2.68Å; R175-D180 PolarHBondContact NH2-OD2 2.62Å
176P49.1Very low54.5Low76 Ų76140.5 Ų140.549%0.49466%0.661SS.*  trans-60.910617922.3-30.2000107.4N174 D178 K179N174-P176 WeakPolarHBondContact O-CD 3.46Å; P176-D178 PolarHBondContact O-N 2.77Å; P176-K179 HydrophobicContact CG-CB 4.49Å; P176-K179 HydrophobicContact CG-CG 4.47Å; P176-K179 PolarHBondContact O-N 3.37Å
177K58Low55.5Low159 Ų159143.8 Ų143.869%0.69166%0.662SS**Hα-helixtrans-59.4-17.7-175.1-67.7-146.8176.7-172.70112R175 K181R175-K177 PolarHBondContact O-N 3.07Å; K177-K181 WeakPolarHBondContact O-CB 3.3Å; K177-K181 WeakPolarHBondContact O-CD 3.27Å; K177-K181 WeakPolarHBondContact O-CG 3.32Å; K177-K181 PolarHBondContact O-N 2.71Å; K177-K181 VanDerWaalsContact O-N 3.08Å
178D54.5Low56.6Low113 Ų113145 Ų14560%0.60466%0.662SS**Hα-helixtrans-73.6-31.7178.6-56.2-33.3000112.7P176 D180 K181 M182P176-D178 PolarHBondContact O-N 2.77Å; D178-D180 VanDerWaalsContact C-N 3.34Å; D178-D180 PolarHBondContact O-N 3.26Å; D178-K181 PolarHBondContact O-N 2.79Å; D178-K181 IonicContact OD1-NZ 3.93Å; D178-M182 WeakPolarHBondContact O-CB 3.34Å; D178-M182 PolarHBondContact O-N 3.31Å
179K61.5Low57.8Low144 Ų144136.1 Ų136.163%0.62664%0.639SS**Hα-helixtrans-66-37.3174.3-89.4-162.4172.6-175.50112.3P176 K183P176-K179 HydrophobicContact CG-CB 4.49Å; P176-K179 HydrophobicContact CG-CG 4.47Å; P176-K179 PolarHBondContact O-N 3.37Å; K179-K183 WeakPolarHBondContact O-CB 3.35Å; K179-K183 WeakPolarHBondContact O-CD 3.24Å; K179-K183 WeakPolarHBondContact O-CG 3.07Å; K179-K183 PolarHBondContact O-N 2.94Å
180D67Low59.2Low52 Ų52135.6 Ų135.628%0.27864%0.635SS.*Hα-helixtrans-80.2-33.3179.9-67.6-34.8000111.9R175 D178 A184R175-D180 VanDerWaalsContact CD-OD2 3.29Å; R175-D180 WeakPolarHBondContact CD-OD2 3.18Å; R175-D180 IonicContact CZ-OD1 2.81Å; R175-D180 IonicContact CZ-OD2 3.38Å; R175-D180 VanDerWaalsContact CZ-OD2 3.24Å; R175-D180 IonicContact NE-OD1 3.54Å; R175-D180 PolarHBondContact NE-OD1 3.29Å; R175-D180 IonicContact NE-OD2 3.47Å; R175-D180 PolarHBondContact NE-OD2 2.9Å; R175-D180 IonicContact NH2-OD1 3.38Å; R175-D180 PolarHBondContact NH2-OD1 2.89Å; R175-D180 IonicContact NH2-OD2 2.68Å; R175-D180 PolarHBondContact NH2-OD2 2.62Å; D178-D180 VanDerWaalsContact C-N 3.34Å; D178-D180 PolarHBondContact O-N 3.26Å; D180-A184 WeakPolarHBondContact O-CB 3.44Å; D180-A184 PolarHBondContact O-N 2.76Å
181K65.8Low60.8Low129 Ų129133.6 Ų133.656%0.56162%0.623SS**Hα-helixtrans-64.4-44.6173.6-72.7168.6-173.4175.70112.1K177 D178 A184 C185K177-K181 WeakPolarHBondContact O-CB 3.3Å; K177-K181 WeakPolarHBondContact O-CD 3.27Å; K177-K181 WeakPolarHBondContact O-CG 3.32Å; K177-K181 PolarHBondContact O-N 2.71Å; K177-K181 VanDerWaalsContact O-N 3.08Å; D178-K181 PolarHBondContact O-N 2.79Å; D178-K181 IonicContact OD1-NZ 3.93Å; K181-A184 PolarHBondContact O-N 3.15Å; K181-C185 WeakPolarHBondContact O-CB 3.37Å; K181-C185 PolarHBondContact O-N 2.79Å
182M65.9Low62.2Low137 Ų137127.8 Ų127.868%0.67560%0.6SS**Hα-helixtrans-66-41.1178.3-168.3174.3-173.900111.6D178 C185 Y186D178-M182 WeakPolarHBondContact O-CB 3.34Å; D178-M182 PolarHBondContact O-N 3.31Å; M182-C185 PolarHBondContact O-N 3.29Å; M182-Y186 WeakPolarHBondContact O-CB 3.49Å; M182-Y186 PolarHBondContact O-N 3.17Å
183K70.6Confident63.6Low132 Ų132126.9 Ų126.957%0.57460%0.596SS**Hα-helixtrans-66.2-35.9173.7-72.6176.1-179.6-168.90112.9K179 R187K179-K183 WeakPolarHBondContact O-CB 3.35Å; K179-K183 WeakPolarHBondContact O-CD 3.24Å; K179-K183 WeakPolarHBondContact O-CG 3.07Å; K179-K183 PolarHBondContact O-N 2.94Å; K183-R187 WeakPolarHBondContact O-CB 3.46Å; K183-R187 PolarHBondContact O-N 2.82Å
184A65.3Low65.1Low38 Ų38119.2 Ų119.231%0.31457%0.572SS.*Hα-helixtrans-72.8-34176.100000112.4D180 K181 R188D180-A184 WeakPolarHBondContact O-CB 3.44Å; D180-A184 PolarHBondContact O-N 2.76Å; K181-A184 PolarHBondContact O-N 3.15Å; A184-R188 WeakPolarHBondContact O-CB 3.39Å; A184-R188 PolarHBondContact O-N 3.34Å
185C61.3Low67Low86 Ų86116.5 Ų116.558%0.58156%0.557SS**Hα-helixtrans-65.2-46.5171.9-171.80000110.4K181 M182 R187 R188 S189K181-C185 WeakPolarHBondContact O-CB 3.37Å; K181-C185 PolarHBondContact O-N 2.79Å; M182-C185 PolarHBondContact O-N 3.29Å; C185-R187 PolarHBondContact O-N 3.38Å; C185-R188 CarbonylContact O-C 3.55Å; C185-R188 PolarHBondContact O-N 2.9Å; C185-R188 VanDerWaalsContact O-N 3.16Å; C185-S189 WeakPolarHBondContact O-CB 3.17Å; C185-S189 PolarHBondContact O-N 2.87Å; C185-S189 PolarHBondContact O-OG 3.44Å
186Y65.2Low68.1Low181 Ų181112 Ų11271%0.7155%0.548SS*.Hα-helixtrans-65.5-35.5175.8-171.7-98.7000113.6M182 R188 S189M182-Y186 WeakPolarHBondContact O-CB 3.49Å; M182-Y186 PolarHBondContact O-N 3.17Å; Y186-R188 VanDerWaalsContact C-N 3.32Å; Y186-S189 WeakPolarHBondContact CA-OG 2.81Å; Y186-S189 PolarHBondContact O-OG 2.72Å
187R68.8Low69.3Low230 Ų230114.2 Ų114.287%0.86855%0.552SS**Hα-helixtrans-72.6-21.5173.3-93.3-154.9-175.1-83.23.9114K183 C185K183-R187 WeakPolarHBondContact O-CB 3.46Å; K183-R187 PolarHBondContact O-N 2.82Å; C185-R187 PolarHBondContact O-N 3.38Å
188R65.4Low70.1Confident194 Ų194109.4 Ų109.473%0.73254%0.538SS*.Hα-helixtrans-102.6-13.2-177.6-161.7-176.8-70113.1-6112.5A184 C185 Y186 M190A184-R188 WeakPolarHBondContact O-CB 3.39Å; A184-R188 PolarHBondContact O-N 3.34Å; C185-R188 CarbonylContact O-C 3.55Å; C185-R188 PolarHBondContact O-N 2.9Å; C185-R188 VanDerWaalsContact O-N 3.16Å; Y186-R188 VanDerWaalsContact C-N 3.32Å; R188-M190 PolarHBondContact O-N 3.22Å
189S69.2Low70.7Confident69 Ų69110 Ų11048%0.48354%0.539SS..SBendtrans-71.6124.2172.349.90000109.9C185 Y186C185-S189 WeakPolarHBondContact O-CB 3.17Å; C185-S189 PolarHBondContact O-N 2.87Å; C185-S189 PolarHBondContact O-OG 3.44Å; Y186-S189 WeakPolarHBondContact CA-OG 2.81Å; Y186-S189 PolarHBondContact O-OG 2.72Å
190M71.8Confident71.3Confident126 Ų126108.7 Ų108.762%0.62154%0.543SS*.PPolyproline II helixtrans-63.3142.2170.1-63.5-158.587.700109.8R188 D194R188-M190 PolarHBondContact O-N 3.22Å; M190-D194 HydrophobicContact CB-CB 4.16Å; M190-D194 HydrophobicContact CE-CB 3.73Å
191S80.9Confident71.5Confident57 Ų57113.9 Ų113.940%0.39957%0.57SS.*PPolyproline II helixtrans-63.3150.6170.9175.60000109.6N193 D194 L195S191-N193 PolarHBondContact O-N 3.4Å; S191-N193 PolarHBondContact OG-N 3.1Å; S191-D194 WeakPolarHBondContact CB-OD2 3.26Å; S191-D194 PolarHBondContact N-OD2 2.82Å; S191-D194 VanDerWaalsContact N-OD2 3.15Å; S191-D194 CarbonylContact O-C 3.58Å; S191-D194 WeakPolarHBondContact O-CA 3.28Å; S191-D194 WeakPolarHBondContact O-CB 3.29Å; S191-D194 PolarHBondContact O-N 3.32Å; S191-L195 PolarHBondContact O-N 2.83Å
192M70.4Confident71.4Confident84 Ų84111.1 Ų111.141%0.41457%0.571SS.*Hα-helixtrans-54.9-36.4173.8179.4144-76.600111.7M46 D194 L195 V196M46-M192 HydrophobicContact CE-CE 3.4Å; M46-M192 HydrophobicContact CE-SD 3.88Å; M46-M192 HydrophobicContact CG-CE 3.7Å; M46-M192 HydrophobicContact CG-SD 4.08Å; M46-M192 HydrophobicContact SD-CE 3.5Å; M46-M192 VanDerWaalsContact SD-CE 3.5Å; M46-M192 HydrophobicContact SD-SD 4.44Å; M192-D194 VanDerWaalsContact C-N 3.33Å; M192-D194 PolarHBondContact O-N 2.86Å; M192-L195 PolarHBondContact O-N 3.21Å; M192-V196 VanDerWaalsContact O-CG2 3.32Å; M192-V196 WeakPolarHBondContact O-CG2 3.21Å; M192-V196 PolarHBondContact O-N 2.92Å
193N76.3Confident70.8Confident113 Ų113107.2 Ų107.260%0.60457%0.566SS**Hα-helixtrans-65.2-36.5173.4-68.9-49000112S191 Q197S191-N193 PolarHBondContact O-N 3.4Å; S191-N193 PolarHBondContact OG-N 3.1Å; N193-Q197 VanDerWaalsContact O-CB 3.26Å; N193-Q197 WeakPolarHBondContact O-CB 3.37Å; N193-Q197 WeakPolarHBondContact O-CG 3.45Å; N193-Q197 PolarHBondContact O-N 3.08Å; N193-Q197 PolarHBondContact O-NE2 2.87Å
194D83.8Confident70.2Confident70 Ų70104 Ų10437%0.37457%0.57SS.*Hα-helixtrans-70.5-33.8176.1-57.5-25.6000111.5M190 S191 M192 S198M190-D194 HydrophobicContact CB-CB 4.16Å; M190-D194 HydrophobicContact CE-CB 3.73Å; S191-D194 WeakPolarHBondContact CB-OD2 3.26Å; S191-D194 PolarHBondContact N-OD2 2.82Å; S191-D194 VanDerWaalsContact N-OD2 3.15Å; S191-D194 CarbonylContact O-C 3.58Å; S191-D194 WeakPolarHBondContact O-CA 3.28Å; S191-D194 WeakPolarHBondContact O-CB 3.29Å; S191-D194 PolarHBondContact O-N 3.32Å; M192-D194 VanDerWaalsContact C-N 3.33Å; M192-D194 PolarHBondContact O-N 2.86Å; D194-S198 WeakPolarHBondContact O-CB 3.5Å; D194-S198 PolarHBondContact O-N 3.45Å
195L80.1Confident69.7Low88 Ų88110.4 Ų110.446%0.46159%0.593SS.*Hα-helixtrans-69.5-45.8175.9-178.164.9000111.5S191 M192 S198 M199S191-L195 PolarHBondContact O-N 2.83Å; M192-L195 PolarHBondContact O-N 3.21Å; L195-S198 WeakPolarHBondContact O-CB 3.44Å; L195-S198 PolarHBondContact O-N 2.9Å; L195-M199 WeakPolarHBondContact O-CG 3.28Å; L195-M199 PolarHBondContact O-N 3.23Å
196V78.6Confident69.1Low75 Ų75118.6 Ų118.646%0.45561%0.612SS.*Hα-helixtrans-63.6-44176.2172.90000110.2M192 S198 M199 V200M192-V196 VanDerWaalsContact O-CG2 3.32Å; M192-V196 WeakPolarHBondContact O-CG2 3.21Å; M192-V196 PolarHBondContact O-N 2.92Å; V196-S198 VanDerWaalsContact C-N 3.33Å; V196-S198 PolarHBondContact O-N 2.7Å; V196-M199 PolarHBondContact O-N 2.74Å; V196-V200 VanDerWaalsContact O-CG2 3.27Å; V196-V200 WeakPolarHBondContact O-CG2 3.4Å; V196-V200 PolarHBondContact O-N 2.81Å
197Q75.4Confident68.1Low122 Ų122116.3 Ų116.357%0.5762%0.617SS**Hα-helixtrans-61.9-39.8173.6-75.7171.598.100112N193 V200 L201N193-Q197 VanDerWaalsContact O-CB 3.26Å; N193-Q197 WeakPolarHBondContact O-CB 3.37Å; N193-Q197 WeakPolarHBondContact O-CG 3.45Å; N193-Q197 PolarHBondContact O-N 3.08Å; N193-Q197 PolarHBondContact O-NE2 2.87Å; Q197-V200 PolarHBondContact O-N 3.08Å; Q197-L201 VanDerWaalsContact O-CB 3.28Å; Q197-L201 WeakPolarHBondContact O-CB 3.48Å; Q197-L201 PolarHBondContact O-N 3.44Å
198S73.9Confident66.7Low57 Ų57109 Ų10940%0.39961%0.613SS.*Hα-helixtrans-62.4-42.3175.3179.90000112.1D194 L195 V196 L201 A202D194-S198 WeakPolarHBondContact O-CB 3.5Å; D194-S198 PolarHBondContact O-N 3.45Å; L195-S198 WeakPolarHBondContact O-CB 3.44Å; L195-S198 PolarHBondContact O-N 2.9Å; V196-S198 VanDerWaalsContact C-N 3.33Å; V196-S198 PolarHBondContact O-N 2.7Å; S198-L201 PolarHBondContact O-N 3.29Å; S198-A202 WeakPolarHBondContact O-CB 3.45Å; S198-A202 PolarHBondContact O-N 2.7Å
199M67.8Low65.2Low126 Ų126105.5 Ų105.562%0.62162%0.618SS**Hα-helixtrans-67.3-35.5175.4-68.4-155-55.700113L195 V196L195-M199 WeakPolarHBondContact O-CG 3.28Å; L195-M199 PolarHBondContact O-N 3.23Å; V196-M199 PolarHBondContact O-N 2.74Å
200V73.1Confident63.9Low116 Ų116108.4 Ų108.470%0.70363%0.633SS**Hα-helixtrans-68.5-40.9174.6171.90000110.8V196 Q197 G203V196-V200 VanDerWaalsContact O-CG2 3.27Å; V196-V200 WeakPolarHBondContact O-CG2 3.4Å; V196-V200 PolarHBondContact O-N 2.81Å; Q197-V200 PolarHBondContact O-N 3.08Å; V200-G203 PolarHBondContact O-N 3.2Å
201L72.8Confident62.2Low162 Ų162110.5 Ų110.585%0.84864%0.641SS**Hα-helixtrans-75.2-28.1179.3-150.976.9000112.8Q197 S198 G203Q197-L201 VanDerWaalsContact O-CB 3.28Å; Q197-L201 WeakPolarHBondContact O-CB 3.48Å; Q197-L201 PolarHBondContact O-N 3.44Å; S198-L201 PolarHBondContact O-N 3.29Å; L201-G203 PolarHBondContact O-N 3.03Å
202A61.9Low59.9Low70 Ų70115.4 Ų115.458%0.57966%0.663SS**THydrogen-bonded Turntrans-78.44.9176.300000113.8S198 G204S198-A202 WeakPolarHBondContact O-CB 3.45Å; S198-A202 PolarHBondContact O-N 2.7Å; A202-G204 PolarHBondContact O-N 2.98Å
203G54.4Low58.6Low56 Ų56120.1 Ų120.158%0.57769%0.689SS**THydrogen-bonded Turntrans49.662.5163.600000114.5V200 L201 Q205V200-G203 PolarHBondContact O-N 3.2Å; L201-G203 PolarHBondContact O-N 3.03Å; G203-Q205 VanDerWaalsContact C-N 3.28Å; G203-Q205 PolarHBondContact O-N 2.98Å
204G57.9Low56.7Low63 Ų63123.7 Ų123.765%0.64970%0.702SS**THydrogen-bonded Turntrans53.227.9151.600000118.6A202 W206A202-G204 PolarHBondContact O-N 2.98Å; G204-W206 PolarHBondContact O-N 3.4Å
205Q53.7Low54.5Low174 Ų174126.8 Ų126.881%0.81372%0.724SS**THydrogen-bonded Turntrans-84.460.8-178.9-158.1173.610.900112.3G203G203-Q205 VanDerWaalsContact C-N 3.28Å; G203-Q205 PolarHBondContact O-N 2.98Å
206W49Very low53.2Low258 Ų258127.2 Ų127.298%0.97773%0.732SS**THydrogen-bonded Turntrans-138.111.9165.1-75.3101.2000113.5G204G204-W206 PolarHBondContact O-N 3.4Å
207T45.3Very low51.1Low133 Ų133130.5 Ų130.582%0.81675%0.747SS**SBendtrans-118.9114.317279.40000109.3
208G39.6Very low49.3Very low75 Ų75131.6 Ų131.677%0.77376%0.756SS**  trans11191.7169.100000114.3
209S33.4Very low47.6Very low121 Ų121136.8 Ų136.885%0.84678%0.778SS**  trans-145.469.6149-143.30000108.1
210T40.8Very low46.3Very low130 Ų130135.8 Ų135.880%0.79878%0.783SS**  trans-12272.4164.952.20000107.1
211E36.2Very low44.6Very low170 Ų170136.6 Ų136.679%0.79479%0.789SS**  trans169.9141.1152.154.9-163.2177.600108.9
212N32.5Very low43.4Very low161 Ų161132.7 Ų132.786%0.86179%0.788SS**  trans131.565.3169.2-70.6-60000110.7
213L44.5Very low42.5Very low182 Ų182138.8 Ų138.895%0.95380%0.801SS**  trans-94.390.4154.5-102.3162.8000106.7
214E36.8Very low41.9Very low189 Ų189147.9 Ų147.988%0.88382%0.818SS**  trans-152.2118.6156.3-140.2168-177.300109.4
215V36Very low41.1Very low135 Ų135155.3 Ų155.382%0.81883%0.826SS**  trans-138.1145.5173.8165.30000102.9
216P53Low40.8Very low97 Ų97156.4 Ų156.463%0.6383%0.828SS**  cis-139.4168.318.226.5-1.8000116.1
217D34.5Very low40.2Very low144 Ų144152.3 Ų152.377%0.7782%0.82SS**  171.2139.5107.9-89-29000113.1
218D39.1Very low40.1Very low145 Ų145154 Ų15478%0.77582%0.824SS**  trans24125.6163.3-73.6-30.3000121.7
219I36.6Very low40Very low166 Ų166153.6 Ų153.685%0.85182%0.819SS**  -171.7131.1118.5-83.4142.5000109.7
220S41.9Very low40.4Very low105 Ų105152.8 Ų152.873%0.73482%0.82SS**  trans-52133.8168.9178.20000113.7
221T37.8Very low40.6Very low133 Ų133155.1 Ų155.182%0.81682%0.824SS**  trans-173.6123.1133.822.10000111K223T221-K223 PolarHBondContact O-N 3Å
222G46Very low41.1Very low80 Ų80151.8 Ų151.883%0.82583%0.825SS**  trans-62.6130.7-179.300000113.4
223K43.9Very low41.3Very low198 Ų198153.4 Ų153.486%0.86183%0.825SS**  trans-132.3122.6153-78.1-171.9177.61750109.3T221 R225T221-K223 PolarHBondContact O-N 3Å; K223-R225 PolarHBondContact O-N 2.93Å; K223-R225 VanDerWaalsContact O-N 3.14Å
224R40.4Very low41Very low246 Ų246150 Ų15093%0.92882%0.816SS**  trans-44.6114.5178.2-64.9-177.5-66.2166.8-1.6110.5K226R224-K226 PolarHBondContact O-N 3.48Å
225R42Very low41.7Very low219 Ų219147.3 Ų147.383%0.82681%0.813SS**  trans-61.3114.7165.7-63.2-176.975.8-122.74.5107.1K223 E227K223-R225 PolarHBondContact O-N 2.93Å; K223-R225 VanDerWaalsContact O-N 3.14Å; R225-E227 PolarHBondContact O-N 3.03Å
226K47Very low42.2Very low198 Ų198146.7 Ų146.786%0.86181%0.809SS**  trans-81.1101.6166.5-163.7169.6-176.7177.90105.3R224 L228R224-K226 PolarHBondContact O-N 3.48Å; K226-L228 PolarHBondContact O-N 3.32Å
227E36.6Very low41.7Very low171 Ų171146.4 Ų146.480%0.79982%0.815SS**  trans-54.5111.4173-69.6-177.5156.900108.5R225 G229R225-E227 PolarHBondContact O-N 3.03Å; E227-G229 PolarHBondContact O-N 2.9Å
228L43.3Very low42.2Very low170 Ų170146 Ų14689%0.8981%0.812SS**  trans-70.4110.2163.3-70.5170.5000105.6K226K226-L228 PolarHBondContact O-N 3.32Å
229G38.2Very low42.1Very low65 Ų65146 Ų14667%0.6781%0.811SS**  trans-51.6141.2176.700000111E227 M231E227-G229 PolarHBondContact O-N 2.9Å; G229-M231 PolarHBondContact O-N 3.25Å; G229-M231 VanDerWaalsContact O-N 3.12Å
230A42.2Very low42.2Very low105 Ų105146.9 Ų146.987%0.86881%0.809SS**  trans-44.2116.3179.700000111.5A232A230-A232 PolarHBondContact O-N 3.1Å
231M44.4Very low42.1Very low179 Ų179146.6 Ų146.688%0.88281%0.808SS**  trans-66.4112.4164.8-78.1-169.6174.300107.4G229 F233G229-M231 PolarHBondContact O-N 3.25Å; G229-M231 VanDerWaalsContact O-N 3.12Å; M231-F233 PolarHBondContact O-N 3.44Å
232A45.9Very low42.3Very low99 Ų99146.9 Ų146.982%0.81881%0.81SS**  trans-65.2119.2170.500000108.6A230 S234A230-A232 PolarHBondContact O-N 3.1Å; A232-S234 PolarHBondContact O-N 3.02Å
233F37.9Very low42Very low196 Ų196150 Ų15086%0.8681%0.812SS**  trans-60.6119.8171.3-64.7-83.1000109.2M231 T235M231-F233 PolarHBondContact O-N 3.44Å; F233-T235 PolarHBondContact O-N 3.21Å; F233-T235 VanDerWaalsContact O-N 3.12Å
234S37.5Very low41.6Very low109 Ų109147.3 Ų147.376%0.76281%0.807SS**  trans-69103.8171.5-173.50000108.9A232 T236A232-S234 PolarHBondContact O-N 3.02Å; S234-T236 PolarHBondContact O-N 3.29Å
235T51.9Low41.2Very low134 Ų134141.7 Ų141.782%0.82281%0.805SS**  trans-84.986.6173.542.10000110.5F233F233-T235 PolarHBondContact O-N 3.21Å; F233-T235 VanDerWaalsContact O-N 3.12Å
236T45.7Very low41Very low121 Ų121135.9 Ų135.974%0.74280%0.799SS**  trans-12379.8158.5350000108.3S234S234-T236 PolarHBondContact O-N 3.29Å
237A42.5Very low40.4Very low92 Ų92131.1 Ų131.176%0.7680%0.796SS**  trans-84.1118.9166.500000108.3
238I45.8Very low40.2Very low135 Ų135127.7 Ų127.769%0.69280%0.797SS**  trans-89.3112.7170-56.9175.2000106.4F240I238-F240 HydrophobicContact CB-CD2 4.35Å; I238-F240 HydrophobicContact CB-CE2 4.06Å; I238-F240 HydrophobicContact CG2-CD2 3.72Å; I238-F240 HydrophobicContact CG2-CE2 3.29Å; I238-F240 HydrophobicContact CG2-CZ 3.84Å
239N37Very low39.7Very low144 Ų144128.7 Ų128.777%0.7780%0.795SS**  trans-74.8119.4174.5-80.4-48.7000109.8
240F38.3Very low39.4Very low185 Ų185136.6 Ų136.681%0.81180%0.804SS**  trans-113.325.1174.2-83-75000113.3I238I238-F240 HydrophobicContact CB-CD2 4.35Å; I238-F240 HydrophobicContact CB-CE2 4.06Å; I238-F240 HydrophobicContact CG2-CD2 3.72Å; I238-F240 HydrophobicContact CG2-CE2 3.29Å; I238-F240 HydrophobicContact CG2-CZ 3.84Å
241S39.6Very low38.9Very low100 Ų100136.6 Ų136.670%0.69980%0.798SS**  trans-109.457.5-176.841.30000113.1
242T42.5Very low38.3Very low139 Ų139137.1 Ų137.185%0.85380%0.795SS**  trans-143.156.1159.558.60000111.5
243V40.3Very low37.5Very low144 Ų144140.7 Ų140.787%0.87380%0.795SS**SBendtrans-148.1128.9155-1310000108.5
244N35.3Very low37.3Very low142 Ų142139.2 Ų139.276%0.75980%0.795SS**  trans90.764.7174.6-141.855.9000118
245S31.9Very low37Very low128 Ų128140.3 Ų140.390%0.89580%0.797SS**  trans-92.291.9153.3-69.80000109.9
246S36.8Very low36Very low98 Ų98141 Ų14169%0.68580%0.796SS**  trans-175.977155.549.60000112.6
247A33.9Very low35.2Very low97 Ų97143.7 Ų143.780%0.80281%0.805SS**  trans-168.6134.9151.100000112.3
248A33.2Very low35Very low99 Ų99148 Ų14882%0.81881%0.807SS**  trans75.298.9149.500000120.1
249F32.6Very low34.4Very low192 Ų192147.5 Ų147.584%0.84281%0.806SS**  trans-12.4145.8142.7-78-81.3000121.2
250R33Very low34.2Very low230 Ų230146.3 Ų146.387%0.86880%0.804SS**  trans81.5113.5150.1-70.5173.1-167-91.52.1118.5
251S30.2Very low34Very low106 Ų106143.5 Ų143.574%0.74180%0.802SS**  151.5122.294.1-169.40000110.6
252K33Very low33.4Very low189 Ų189144.4 Ų144.482%0.82281%0.808SS**  166.3151.3121.3-88170.3-172.7-1760110.7
253Q28.5Very low32.9Very low174 Ų174146.7 Ų146.781%0.81381%0.807SS**  trans92.9104.1146.7-154168.4-2.200116.8
254L32.9Very low32.7Very low166 Ų166147.4 Ų147.487%0.86980%0.801SS**  -167.9114.6110.9-96.8155.7000109.7
255V32Very low32.6Very low131 Ų131147.5 Ų147.579%0.79480%0.801SS**  trans-90.4117165.2-78.70000107.8
256N31.4Very low32.6Very low150 Ų150148.5 Ų148.580%0.80280%0.795SS**  trans176.2119.9144-105.12.8000107.3
257N29.4Very low32.5Very low176 Ų176148.8 Ų148.894%0.94180%0.797SS**  trans-166.8143.3132.2-87.2-33.5000109.2
258K37Very low33.7Very low182 Ų182149.2 Ų149.279%0.79179%0.791SS**  trans-103.2148.5-170.9166.8149.9176.8165.40108.8
259D32.8Very low33.6Very low126 Ų126152.9 Ų152.967%0.67479%0.792SS**  trans106.6121.9160.3-61-32.2000119.8
260T33.4Very low33.5Very low118 Ų118146.7 Ų146.772%0.72478%0.782SS**  trans86108.113856.60000122.8
261T33.4Very low33.6Very low127 Ų127143.1 Ų143.178%0.77978%0.778SS**  79.1140.5127.960.50000123.9
262S28.7Very low33.9Very low119 Ų119142.3 Ų142.383%0.83277%0.773SS**  trans79.8122.3165.471.50000116.5
263F30.8Very low34.1Very low187 Ų187140.7 Ų140.782%0.8277%0.773SS**  cis103.913935.3-160.3-103.6000112.8
264E35.9Very low34.4Very low158 Ų158139.8 Ų139.874%0.73877%0.774SS**  trans77.7122.6-176.5-53.8-159.5161.100117
265D33Very low34.8Very low144 Ų144136.8 Ų136.877%0.7777%0.767SS**  cis108.3149.138.2-169.232.3000110.4
266I33Very low35Very low150 Ų150135.4 Ų135.477%0.76976%0.763SS**  trans104.891.7169.7-51.4157.7000115.4
267S34.6Very low35.2Very low104 Ų104135 Ų13573%0.72777%0.766SS**  trans-79.5-171.4141.8-79.40000109.7
268P59.6Low35.4Very low105 Ų105130.4 Ų130.468%0.68276%0.761SS**  -128.2171.3-52.834.3-18.6000110.1
269Q31Very low35.2Very low176 Ų176127.5 Ų127.582%0.82276%0.763SS**  trans-178121.7144.1-144.560.40.400109.8
270G30.8Very low35.3Very low62 Ų62131.8 Ų131.864%0.63977%0.77SS**  110.6144.898.700000108.1
271I34.3Very low35.5Very low155 Ų155131.5 Ų131.580%0.79577%0.768SS**  cis-17314617.838.5169.7000106.2
272S35.6Very low35.5Very low90 Ų90134 Ų13463%0.62977%0.77SS**  trans15.9154.9141.945.80000120.7
273D37.5Very low35.6Very low155 Ų155132.4 Ų132.483%0.82976%0.764SS**  cis-170.2158.42.5-89-28.1000102.7
274D35.1Very low35.9Very low155 Ų155128.9 Ų128.983%0.82976%0.763SS**  178.3149.276.3-174.818.9000109
275S40.9Very low36.3Very low102 Ų102132.9 Ų132.971%0.71377%0.771SS**  trans-83.1160.8-179.8-63.80000111.3
276S37.3Very low36.7Very low103 Ų103132 Ų13272%0.7277%0.773SS**  168.3132.4101.395.70000113.3
277T35.7Very low36.8Very low141 Ų141129.8 Ų129.887%0.86578%0.778SS**  trans58.3118136.7-4.90000121.9
278G32.3Very low36.7Very low80 Ų80130.3 Ų130.383%0.82578%0.781SS**  trans178.595.1157.600000113
279S34.8Very low36.2Very low121 Ų121133.6 Ų133.685%0.84679%0.792SS**  trans-73.6156.7-172.6-168.40000115
280R34.2Very low36.3Very low215 Ų215132.4 Ų132.481%0.81179%0.792SS**  trans106.4100140-149.6175.3-159-150.33119.5
281V37.3Very low36.6Very low113 Ų113135 Ų13569%0.68580%0.8SS**  21.9123.2128.8-168.80000118
282H33.6Very low36.6Very low179 Ų179130.8 Ų130.883%0.82980%0.795SS**  173.4162.8121.7-91.3-69.3000111.9
283A31.3Very low36.9Very low85 Ų85137.7 Ų137.770%0.70281%0.807SS**  trans-91.9162-151.500000116.8
284S36.3Very low36.7Very low113 Ų113137 Ų13779%0.7981%0.808SS**  trans42115.5137.5-51.70000122
285R44.1Very low36.8Very low242 Ų242135.4 Ų135.491%0.91381%0.809SS**  135.9141.4119.1-90.6-178.3165.4-137.5-2.6115.2
286P41.8Very low36.4Very low125 Ų125137.6 Ų137.681%0.81282%0.819SS**  trans-90.4162169.436.4-31.6000113
287A35.4Very low36.2Very low105 Ų105138 Ų13887%0.86882%0.822SS**  trans-61.6138.4-170.600000115.6
288S33Very low36.1Very low115 Ų115138.6 Ų138.680%0.80482%0.819SS**  trans-109121163.154.90000109.2
289L47.7Very low36.3Very low173 Ų173138.6 Ų138.691%0.90681%0.807SS**  trans-92.3119.9163.6-77.6167.7000108.7
290D33.9Very low36.5Very low152 Ų152140.1 Ų140.181%0.81381%0.806SS**  trans-73.8132.5169.2176.916.4000109.8
291S36.3Very low37Very low117 Ų117136.8 Ų136.882%0.81880%0.804SS**  trans-108.1103.7170.4-76.30000109.1
292G34.3Very low37.3Very low66 Ų66139.8 Ų139.868%0.6882%0.816SS**  trans-81.2117.4172.500000113.2
293R42.1Very low37.5Very low235 Ų235135.4 Ų135.489%0.88781%0.811SS**  trans34.9125.8139.2-60.8171.173.5-1484118.9
294T33.8Very low37.9Very low139 Ų139136.7 Ų136.785%0.85382%0.815SS**  -167.6142.197.8420000110.9
295S36.6Very low37.6Very low122 Ų122139.3 Ų139.385%0.85382%0.819SS**  trans-94.2134.9179.3-52.80000110.3
296T32.8Very low37.3Very low148 Ų148135.2 Ų135.291%0.90881%0.81SS**  trans-131.6102.3157.4220000108.5
297S33.1Very low36.7Very low113 Ų113137.4 Ų137.479%0.7981%0.809SS**  trans-84.9129.1167.5179.60000108.2
298N32.8Very low36.8Very low152 Ų152137.9 Ų137.981%0.81380%0.801SS**  trans-113.9100.5164.7-169.618.9000107.8
299S36.3Very low36.8Very low80 Ų80141.8 Ų141.856%0.55980%0.804SS**  trans-119114.2173.2-179.30000107.3
300N39.8Very low36.1Very low154 Ų154138 Ų13882%0.82480%0.798SS**  trans-109.698.6165.9-90.9-9.4000108.4
301N44.3Very low35.9Very low144 Ų144134.2 Ų134.277%0.7779%0.794SS**  trans-78.4140.4154.4-72.4-44.4000108
302N43.3Very low35.8Very low176 Ų176133 Ų13394%0.94179%0.791SS**  trans-125.2119.5158.2-136.95.1000108.4
303A38.4Very low35.9Very low88 Ų88136.2 Ų136.273%0.72780%0.797SS**  trans-121.9133.6175.700000109.3
304S39Very low35.4Very low112 Ų112132 Ų13278%0.78379%0.793SS**  trans54.9120.7148.3-168.80000120.7
305L30.6Very low35.5Very low168 Ų168131.2 Ų131.288%0.8878%0.782SS**  -172.1150.4109-123.1140.9000112.8
306H37Very low35.6Very low156 Ų156133.7 Ų133.772%0.72278%0.78SS**  trans-99.9128.4178.7171.1-79000110.2
307E31.2Very low35.7Very low170 Ų170132.7 Ų132.779%0.79478%0.779SS**  trans-171148134.2-112.8-169.3138.800114.4
308V36.3Very low35.9Very low115 Ų115135.8 Ų135.870%0.69777%0.773SS**  trans-36.1141175-93.30000119.1
309K32.8Very low36.3Very low198 Ų198134.7 Ų134.786%0.86178%0.775SS**  166.5131.4101.8-167.7135.3-178.31730113.7
310A32.7Very low36.1Very low94 Ų94136.2 Ų136.278%0.77777%0.773SS**  trans57.7129.4148.300000122.4
311G31.1Very low35.7Very low72 Ų72134.5 Ų134.574%0.74277%0.773SS**  107.9100.9125.800000118.8
312A33.4Very low35.2Very low91 Ų91135.8 Ų135.875%0.75277%0.774SS**  trans72.2129.5132.700000122
313V35.8Very low34.8Very low134 Ų134133 Ų13381%0.81277%0.768SS**  trans60.3107.8143.6-65.20000122.5
314N32.9Very low35Very low147 Ų147134.5 Ų134.579%0.78677%0.774SS**  52.9139.1112.4-150.816.9000122.2
315I36.2Very low34.8Very low122 Ų122132.1 Ų132.163%0.62677%0.766SS**  trans93.7119.9150.8-24.6178000121.1
316Q37.5Very low34.9Very low173 Ų173131.8 Ų131.881%0.80877%0.766SS**  trans66.1113.9144.2-104.5142.5-10.600121.3
317S34.4Very low34.8Very low127 Ų127134.6 Ų134.689%0.88878%0.776SS**  -160.4121.3121.5-76.60000110.8
318R38.9Very low34.9Very low178 Ų178132.3 Ų132.367%0.67278%0.779SS**  trans-91.4152174.2-177.5-179.3-170.7-144.44.4108.2Q320R318-Q320 VanDerWaalsContact NH1-CD 3.27Å
319P40.7Very low34.9Very low130 Ų130134.5 Ų134.584%0.84479%0.786SS**  -127.5137.9127.325.2-10.2000111.9
320Q32.4Very low34.9Very low111 Ų111132.5 Ų132.552%0.51978%0.784SS.*PPolyproline II helixtrans-89.4119.7-179.7-169.1176.81.200107.1R318R318-Q320 VanDerWaalsContact NH1-CD 3.27Å
321S31.3Very low35.2Very low119 Ų119135.2 Ų135.283%0.83278%0.78SS**PPolyproline II helixtrans-69.9127.6172.3290000110.1
322H33.8Very low35.2Very low170 Ų170139.3 Ų139.379%0.78779%0.785SS**PPolyproline II helixtrans-98.3136.2166.1-80.6-93.4000109.9
323S34.6Very low35.3Very low118 Ų118141.6 Ų141.683%0.82578%0.78SS**PPolyproline II helixtrans-99.5140.1-179.8166.30000110
324S43.1Very low35.2Very low120 Ų120144.2 Ų144.284%0.83978%0.783SS**  trans-174.8118.7153.1450000105.9
325G34.8Very low35.5Very low61 Ų61141.9 Ų141.963%0.62977%0.774SS**  cis100.2100.33700000107.3
326D32.5Very low35.7Very low162 Ų162148.5 Ų148.587%0.86679%0.791SS**  trans155.5103.4144.8-73.3-17.7000111.5
327F33.4Very low35.6Very low215 Ų215145.4 Ų145.494%0.94379%0.789SS**  trans-133.3119.3152.3-104.8-84000107.3
328S35Very low35.7Very low121 Ų121145 Ų14585%0.84679%0.787SS**  trans-57.2134.4-175.3-59.30000112.9L330S328-L330 PolarHBondContact O-N 3.32Å
329L35.4Very low35.5Very low161 Ų161142.8 Ų142.884%0.84380%0.798SS**  trans-60.9119.5163.9-83.2139.4000110.2
330L33.2Very low35.1Very low157 Ų157140.4 Ų140.482%0.82280%0.797SS**  trans-105.1115.4151.6-137.4167.7000107S328S328-L330 PolarHBondContact O-N 3.32Å
331H39.6Very low35.2Very low150 Ų150140.9 Ų140.969%0.69481%0.813SS**  trans-87.2109.3-176.2-147.185.9000107
332D30.3Very low35.5Very low158 Ų158140 Ų14085%0.84581%0.807SS**  trans-119.4116.6159.4-88.1-33.1000109
333H35.8Very low35.9Very low139 Ų139138 Ų13864%0.64481%0.809SS**  trans-99.6104.2-176.6168.2-85.6000107.4T335H333-T335 WeakPolarHBondContact CE1-CG2 3.47Å
334E32.8Very low36.1Very low190 Ų190138.8 Ų138.889%0.88880%0.802SS**  trans-117.1106162.3-76.6-163.2145.600110.5
335T40.5Very low35.9Very low98 Ų98142.2 Ų142.260%0.60181%0.805SS**  trans-49.3125.5169410000112H333 S337H333-T335 WeakPolarHBondContact CE1-CG2 3.47Å; T335-S337 PolarHBondContact O-N 3.33Å
336W40.5Very low35.9Very low260 Ų260149.4 Ų149.499%0.98581%0.814SS**  trans-56.9122.1156.8-68.4-33.8000109.7
337S34.2Very low36Very low109 Ų109149.3 Ų149.376%0.76281%0.813SS**  trans-138.2110.1161.9-79.70000109.9T335T335-S337 PolarHBondContact O-N 3.33Å
338S36.1Very low36.1Very low119 Ų119148 Ų14883%0.83281%0.807SS**  trans-54.9127.5159.6-59.70000110.7
339S35.8Very low36.2Very low131 Ų131152.7 Ų152.792%0.91681%0.806SS**  trans169.9128.4137.6-80.30000110.8
340G31.8Very low36.2Very low79 Ų79153.3 Ų153.381%0.81481%0.805SS**  trans-18063.1176.900000112.5
341S35.4Very low36.5Very low122 Ų122152.1 Ų152.185%0.85380%0.804SS**  trans-51.4139.6177.9-175.30000114
342S37.1Very low36.5Very low101 Ų101156.9 Ų156.971%0.70682%0.816SS**  trans-66.6147.2164.8-50.10000111.4
343P41Very low37.2Very low127 Ų127154.8 Ų154.883%0.82581%0.814SS**  trans-86.8115.5175.531-29.7000111.6
344I39Very low37.4Very low135 Ų135157.6 Ų157.669%0.69285%0.849SS**  trans-82.2119.4166.1-68.6178.1000108.3Y346I344-Y346 HydrophobicContact CG2-CD2 3.97Å; I344-Y346 HydrophobicContact CG2-CE2 3.81Å; I344-Y346 PolarHBondContact O-N 3.4Å
345Q38.8Very low37.7Very low192 Ų192156 Ų15690%0.89785%0.847SS**  trans-76.2112.6171.2-67.6-131.4-600110.4
346Y35.4Very low37.5Very low211 Ų211159.1 Ų159.183%0.82786%0.86SS**  trans-86.1115.2169.4-87-91.1000110.5I344 K348I344-Y346 HydrophobicContact CG2-CD2 3.97Å; I344-Y346 HydrophobicContact CG2-CE2 3.81Å; I344-Y346 PolarHBondContact O-N 3.4Å; Y346-K348 PolarHBondContact O-N 3.21Å
347L33.9Very low37.4Very low161 Ų161153.4 Ų153.484%0.84385%0.853SS**  trans-73.2107.9171.2-171.870.7000109.8R349L347-R349 PolarHBondContact O-N 3.29Å
348K36.2Very low37.5Very low186 Ų186156.1 Ų156.181%0.80986%0.859SS**  trans-74.6100.3175.3-172.7178.7-178.1178.40110.1Y346Y346-K348 PolarHBondContact O-N 3.21Å
349R36.5Very low37.6Very low221 Ų221158.4 Ų158.483%0.83486%0.861SS**  trans-85111.2167.4-169.4179.5-86.1-105.23.9108.4L347L347-R349 PolarHBondContact O-N 3.29Å
350Q37.2Very low37.8Very low174 Ų174160.2 Ų160.281%0.81386%0.857SS**  trans-70.3122.5169.7-82.9165.5-28.500109.7
351T38.3Very low38.2Very low132 Ų132166 Ų16681%0.8186%0.86SS**  trans-94.6114.9164.746.60000108.7
352R40.9Very low38.4Very low249 Ų249169.4 Ų169.494%0.9486%0.86SS**  trans-73.9128.2161.1-95.8165.480174.63.9108
353S44.2Very low38.5Very low115 Ų115175.1 Ų175.180%0.80487%0.873SS**  trans-74.6137.3162.647.60000110.4
354S40.5Very low38.3Very low198 Ų198179.5 Ų179.5100%1.38588%0.878SS**  trans-111.90145.7-76.10000107.7

Retrieved 354 of 354 residues in 160.2 ms (Link to these results)