A0A077ZDQ2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZDQ2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 520 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
1M40.8Very low62.1Low232 Ų232153.8 Ų153.8100%1.14376%0.758SS**  0108.20-82.8177.7170.700108
2T39.3Very low64.2Low132 Ų132150.2 Ų150.281%0.8174%0.737SS**  trans-113.597-178.2-42.20000107.5L4T2-L4 PolarHBondContact O-N 2.97Å
3F43.7Very low66.3Low190 Ų190145.3 Ų145.383%0.83371%0.712SS**  trans-7587.5-179.4-110.8-89.6000109.9L5F3-L5 PolarHBondContact O-N 3.22Å
4L47.4Very low68.2Low155 Ų155146.5 Ų146.581%0.81271%0.711SS**  trans-76.996.1166.1-85.3161.1000108.6T2 Q6T2-L4 PolarHBondContact O-N 2.97Å; L4-Q6 PolarHBondContact O-N 3.07Å
5L54.8Low69.8Low153 Ų153141.6 Ų141.680%0.80169%0.687SS**  trans-61.5113.5170.5-88.5153.1000109.8F3 I7F3-L5 PolarHBondContact O-N 3.22Å; L5-I7 PolarHBondContact O-N 3.2Å
6Q56.2Low71.3Confident191 Ų191139.8 Ų139.889%0.89367%0.674SS**  trans-71.297.7168-80179.2-50.600109.3L4 T8L4-Q6 PolarHBondContact O-N 3.07Å; Q6-T8 PolarHBondContact O-N 2.85Å
7I69.2Low72.7Confident120 Ų120138 Ų13862%0.61567%0.668SS**  trans-61130.1167.8-60173.5000108.1L5 E11 H12L5-I7 PolarHBondContact O-N 3.2Å; I7-E11 HydrophobicContact CG2-CB 3.69Å; I7-H12 HydrophobicContact CG2-CB 4.27Å
8T77.1Confident74Confident73 Ų73138.4 Ų138.445%0.44866%0.662SS.*  trans-69.5155.4177.463.10000111.1Q6 D10 E11 H12Q6-T8 PolarHBondContact O-N 2.85Å; T8-D10 PolarHBondContact O-N 3.13Å; T8-D10 VanDerWaalsContact O-N 3.16Å; T8-E11 WeakPolarHBondContact CB-OE2 3.36Å; T8-E11 PolarHBondContact N-OE2 2.92Å; T8-E11 PolarHBondContact O-N 3.16Å; T8-E11 WeakPolarHBondContact OG1-CG 3.45Å; T8-E11 PolarHBondContact OG1-N 2.92Å; T8-E11 PolarHBondContact OG1-OE2 3.25Å; T8-H12 PolarHBondContact O-N 2.87Å
9R82.4Confident75.2Confident210 Ų210138.4 Ų138.479%0.79265%0.654SS**Hα-helixtrans-57-34.7-179-162.5-179.1-163.7176.34.5112.1Q13R9-Q13 WeakPolarHBondContact O-CG 3.35Å; R9-Q13 PolarHBondContact O-N 3.36Å; R9-Q13 VanDerWaalsContact O-N 3.08Å
10D85.7Confident76.2Confident130 Ų130137 Ų13770%0.69565%0.647SS**Hα-helixtrans-76.8-39.1-177.4-60.2-23.9000112.1T8 H12 Q13 K14T8-D10 PolarHBondContact O-N 3.13Å; T8-D10 VanDerWaalsContact O-N 3.16Å; D10-H12 VanDerWaalsContact C-N 3.32Å; D10-H12 PolarHBondContact O-N 3.45Å; D10-Q13 PolarHBondContact O-N 3.2Å; D10-K14 WeakPolarHBondContact O-CB 3.35Å; D10-K14 PolarHBondContact O-N 2.94Å
11E87Confident77.2Confident106 Ų106138.6 Ų138.650%0.49565%0.648SS.*Hα-helixtrans-60.1-43.2170.3-73.5166.7134.800111.2I7 T8 Q13 K14 E15I7-E11 HydrophobicContact CG2-CB 3.69Å; T8-E11 WeakPolarHBondContact CB-OE2 3.36Å; T8-E11 PolarHBondContact N-OE2 2.92Å; T8-E11 PolarHBondContact O-N 3.16Å; T8-E11 WeakPolarHBondContact OG1-CG 3.45Å; T8-E11 PolarHBondContact OG1-N 2.92Å; T8-E11 PolarHBondContact OG1-OE2 3.25Å; E11-Q13 PolarHBondContact O-N 3.1Å; E11-K14 PolarHBondContact O-N 3.43Å; E11-E15 WeakPolarHBondContact O-CB 3.32Å; E11-E15 PolarHBondContact O-N 3.21Å
12H87.1Confident79.9Confident110 Ų110131.4 Ų131.451%0.50961%0.611SS.*Hα-helixtrans-62.6-40.9176.3-176.773.5000112.4I7 T8 D10 K16I7-H12 HydrophobicContact CG2-CB 4.27Å; T8-H12 PolarHBondContact O-N 2.87Å; D10-H12 VanDerWaalsContact C-N 3.32Å; D10-H12 PolarHBondContact O-N 3.45Å; H12-K16 VanDerWaalsContact O-CB 3.25Å; H12-K16 WeakPolarHBondContact O-CB 3.43Å; H12-K16 PolarHBondContact O-N 2.98Å
13Q91.8Very high82.6Confident87 Ų87129.3 Ų129.341%0.40759%0.594SS.*Hα-helixtrans-68.1-40.9175.1-70.2-64.9-14.200112.6R9 D10 E11 K16 L17R9-Q13 WeakPolarHBondContact O-CG 3.35Å; R9-Q13 PolarHBondContact O-N 3.36Å; R9-Q13 VanDerWaalsContact O-N 3.08Å; D10-Q13 PolarHBondContact O-N 3.2Å; E11-Q13 PolarHBondContact O-N 3.1Å; Q13-K16 PolarHBondContact O-N 3.01Å; Q13-L17 WeakPolarHBondContact O-CG 3.26Å; Q13-L17 PolarHBondContact O-N 3.3Å
14K92.9Very high85.1Confident162 Ų162122.9 Ų122.970%0.70457%0.572SS**Hα-helixtrans-61.9-44176.6-174.3179.1-179.2-178.80111.3D10 E11 L17 R18D10-K14 WeakPolarHBondContact O-CB 3.35Å; D10-K14 PolarHBondContact O-N 2.94Å; E11-K14 PolarHBondContact O-N 3.43Å; K14-L17 PolarHBondContact O-N 3.49Å; K14-R18 WeakPolarHBondContact O-CB 3.4Å; K14-R18 PolarHBondContact O-N 3.44Å
15E91.5Very high87.5Confident73 Ų73118.5 Ų118.534%0.34155%0.548SS..Hα-helixtrans-69.1-39.4177.4-16857.5-159.500111.3E11 L17 R18 W19E11-E15 WeakPolarHBondContact O-CB 3.32Å; E11-E15 PolarHBondContact O-N 3.21Å; E15-L17 PolarHBondContact O-N 2.86Å; E15-R18 WeakPolarHBondContact O-CB 3.48Å; E15-R18 PolarHBondContact O-N 3.25Å; E15-R18 IonicContact OE1-CZ 3.79Å; E15-R18 IonicContact OE1-NH1 2.69Å; E15-R18 PolarHBondContact OE1-NH1 2.72Å; E15-R18 WeakPolarHBondContact OE2-CD 3.46Å; E15-R18 IonicContact OE2-NH1 3.78Å; E15-W19 PolarHBondContact O-N 2.77Å; E15-W19 PolarHBondContact OE1-NE1 2.66Å
16K93.3Very high89.5Confident113 Ų113115.5 Ų115.549%0.49153%0.532SS..Hα-helixtrans-57.7-46.5171.7-178-175.1175.9-172.60112.2H12 Q13 W19 Q20H12-K16 VanDerWaalsContact O-CB 3.25Å; H12-K16 WeakPolarHBondContact O-CB 3.43Å; H12-K16 PolarHBondContact O-N 2.98Å; Q13-K16 PolarHBondContact O-N 3.01Å; K16-W19 PolarHBondContact O-N 3.46Å; K16-Q20 WeakPolarHBondContact O-CB 3.46Å; K16-Q20 PolarHBondContact O-N 3.12Å
17L95.2Very high91.4Very high109 Ų109110.8 Ų110.857%0.57151%0.51SS*.Hα-helixtrans-64.1-39.9176.5-75.3168.6000112Q13 K14 E15 Q20 Y21Q13-L17 WeakPolarHBondContact O-CG 3.26Å; Q13-L17 PolarHBondContact O-N 3.3Å; K14-L17 PolarHBondContact O-N 3.49Å; E15-L17 PolarHBondContact O-N 2.86Å; L17-Q20 PolarHBondContact O-N 2.85Å; L17-Y21 PolarHBondContact O-N 3.02Å
18R96.8Very high92.7Very high145 Ų145107.2 Ų107.255%0.54750%0.496SS..Hα-helixtrans-59.5-47.1173.7177.7-174.5173.1-101.1-6111.7K14 E15 K22K14-R18 WeakPolarHBondContact O-CB 3.4Å; K14-R18 PolarHBondContact O-N 3.44Å; E15-R18 WeakPolarHBondContact O-CB 3.48Å; E15-R18 PolarHBondContact O-N 3.25Å; E15-R18 IonicContact OE1-CZ 3.79Å; E15-R18 IonicContact OE1-NH1 2.69Å; E15-R18 PolarHBondContact OE1-NH1 2.72Å; E15-R18 WeakPolarHBondContact OE2-CD 3.46Å; E15-R18 IonicContact OE2-NH1 3.78Å; R18-K22 WeakPolarHBondContact O-CB 3.44Å; R18-K22 PolarHBondContact O-N 2.83Å
19W96.4Very high93.6Very high138 Ų138107.6 Ų107.652%0.52349%0.492SS..Hα-helixtrans-66.3-40.4176.2-76.1110000112.4E15 K16 Y21 K22 I23E15-W19 PolarHBondContact O-N 2.77Å; E15-W19 PolarHBondContact OE1-NE1 2.66Å; K16-W19 PolarHBondContact O-N 3.46Å; W19-Y21 PolarHBondContact O-N 3.22Å; W19-K22 PolarHBondContact O-N 3.45Å; W19-I23 WeakPolarHBondContact O-CB 3.39Å; W19-I23 VanDerWaalsContact O-CG1 3.27Å; W19-I23 WeakPolarHBondContact O-CG1 3.21Å; W19-I23 PolarHBondContact O-N 2.93Å
20Q96Very high94.3Very high111 Ų111102.2 Ų102.252%0.51948%0.479SS..Hα-helixtrans-60.6-46.4176.4-172.4173.51.400111.5K16 L17 K22 I23 S24K16-Q20 WeakPolarHBondContact O-CB 3.46Å; K16-Q20 PolarHBondContact O-N 3.12Å; L17-Q20 PolarHBondContact O-N 2.85Å; Q20-K22 VanDerWaalsContact C-N 3.34Å; Q20-K22 PolarHBondContact O-N 2.97Å; Q20-I23 PolarHBondContact O-N 3.02Å; Q20-S24 PolarHBondContact O-N 2.66Å; Q20-S24 PolarHBondContact O-OG 3.42Å
21Y96.5Very high94.8Very high170 Ų170103 Ų10367%0.66747%0.472SS*.Hα-helixtrans-59-44.6173-179.8-93.4000111.7L17 W19 I23 S24 E25L17-Y21 PolarHBondContact O-N 3.02Å; W19-Y21 PolarHBondContact O-N 3.22Å; Y21-I23 PolarHBondContact O-N 3.39Å; Y21-S24 PolarHBondContact O-N 3.3Å; Y21-E25 WeakPolarHBondContact O-CB 3.4Å; Y21-E25 PolarHBondContact O-N 3.06Å
22K97Very high95.3Very high82 Ų82104.6 Ų104.636%0.35747%0.474SS..Hα-helixtrans-66.4-36.6-179.5-168.566.5-165168.10112.9R18 W19 Q20 E25 L26R18-K22 WeakPolarHBondContact O-CB 3.44Å; R18-K22 PolarHBondContact O-N 2.83Å; W19-K22 PolarHBondContact O-N 3.45Å; Q20-K22 VanDerWaalsContact C-N 3.34Å; Q20-K22 PolarHBondContact O-N 2.97Å; K22-E25 WeakPolarHBondContact CD-OE2 3.47Å; K22-E25 WeakPolarHBondContact CE-OE2 3.36Å; K22-E25 IonicContact NZ-OE1 3.11Å; K22-E25 IonicContact NZ-OE2 2.77Å; K22-E25 PolarHBondContact NZ-OE2 3.02Å; K22-E25 PolarHBondContact O-N 3.48Å; K22-L26 HydrophobicContact CG-CD1 4.39Å; K22-L26 VanDerWaalsContact O-CG 3.3Å; K22-L26 WeakPolarHBondContact O-CG 3.42Å; K22-L26 PolarHBondContact O-N 3.03Å
23I96.4Very high95.7Very high87 Ų87102.8 Ų102.845%0.44647%0.473SS..Hα-helixtrans-63.2-51.3173.4-71.1163.9000109.6W19 Q20 Y21 E25 L26 E27W19-I23 WeakPolarHBondContact O-CB 3.39Å; W19-I23 VanDerWaalsContact O-CG1 3.27Å; W19-I23 WeakPolarHBondContact O-CG1 3.21Å; W19-I23 PolarHBondContact O-N 2.93Å; Q20-I23 PolarHBondContact O-N 3.02Å; Y21-I23 PolarHBondContact O-N 3.39Å; I23-E25 VanDerWaalsContact C-N 3.28Å; I23-E25 PolarHBondContact O-N 3.25Å; I23-L26 PolarHBondContact O-N 3.12Å; I23-L26 VanDerWaalsContact O-N 3.07Å; I23-E27 HydrophobicContact CG2-CG 4.24Å; I23-E27 WeakPolarHBondContact O-CG 3.48Å; I23-E27 PolarHBondContact O-N 3.47Å
24S96.4Very high95.8Very high55 Ų55103.9 Ų103.939%0.38548%0.478SS..Hα-helixtrans-63.2-31.4178.7-62.30000113.6Q20 Y21 S28Q20-S24 PolarHBondContact O-N 2.66Å; Q20-S24 PolarHBondContact O-OG 3.42Å; Y21-S24 PolarHBondContact O-N 3.3Å; S24-S28 VanDerWaalsContact O-CB 3.3Å; S24-S28 WeakPolarHBondContact O-CB 3.47Å; S24-S28 PolarHBondContact O-N 2.96Å; S24-S28 VanDerWaalsContact O-N 3.09Å; S24-S28 PolarHBondContact O-OG 3.27Å
25E97.6Very high96Very high64 Ų64101.8 Ų101.830%0.29947%0.471SS..Hα-helixtrans-64-48.6170.7-165.4-156.8157.700111.1Y21 K22 I23 S28 Q29Y21-E25 WeakPolarHBondContact O-CB 3.4Å; Y21-E25 PolarHBondContact O-N 3.06Å; K22-E25 WeakPolarHBondContact CD-OE2 3.47Å; K22-E25 WeakPolarHBondContact CE-OE2 3.36Å; K22-E25 IonicContact NZ-OE1 3.11Å; K22-E25 IonicContact NZ-OE2 2.77Å; K22-E25 PolarHBondContact NZ-OE2 3.02Å; K22-E25 PolarHBondContact O-N 3.48Å; I23-E25 VanDerWaalsContact C-N 3.28Å; I23-E25 PolarHBondContact O-N 3.25Å; E25-S28 WeakPolarHBondContact O-CB 3.27Å; E25-S28 PolarHBondContact O-N 3.16Å; E25-Q29 WeakPolarHBondContact O-CG 3.34Å; E25-Q29 PolarHBondContact O-N 3.08Å; E25-Q29 PolarHBondContact OE1-NE2 2.91Å
26L96.5Very high96.2Very high90 Ų90101.6 Ų101.647%0.47148%0.475SS..Hα-helixtrans-65.2-41.7179.1-71.2170.7000112.3K22 I23 S28 Q29 L30K22-L26 HydrophobicContact CG-CD1 4.39Å; K22-L26 VanDerWaalsContact O-CG 3.3Å; K22-L26 WeakPolarHBondContact O-CG 3.42Å; K22-L26 PolarHBondContact O-N 3.03Å; I23-L26 PolarHBondContact O-N 3.12Å; I23-L26 VanDerWaalsContact O-N 3.07Å; L26-S28 PolarHBondContact O-N 3.44Å; L26-Q29 PolarHBondContact O-N 3.12Å; L26-Q29 VanDerWaalsContact O-N 3.17Å; L26-L30 WeakPolarHBondContact O-CB 3.35Å; L26-L30 PolarHBondContact O-N 2.93Å
27E96.6Very high96.4Very high92 Ų92100.6 Ų100.643%0.4348%0.475SS..Hα-helixtrans-60.5-34.2172.4-71.117216400112.2I23 R31I23-E27 HydrophobicContact CG2-CG 4.24Å; I23-E27 WeakPolarHBondContact O-CG 3.48Å; I23-E27 PolarHBondContact O-N 3.47Å; E27-R31 WeakPolarHBondContact O-CB 3.34Å; E27-R31 WeakPolarHBondContact O-CG 3.49Å; E27-R31 PolarHBondContact O-N 2.84Å; E27-R31 VanDerWaalsContact O-N 3.1Å; E27-R31 PolarHBondContact O-NE 3.23Å
28S96.4Very high96.4Very high45 Ų4599 Ų9932%0.31547%0.473SS..Hα-helixtrans-77.6-29.7176.8-580000112.3S24 E25 L26 R32S24-S28 VanDerWaalsContact O-CB 3.3Å; S24-S28 WeakPolarHBondContact O-CB 3.47Å; S24-S28 PolarHBondContact O-N 2.96Å; S24-S28 VanDerWaalsContact O-N 3.09Å; S24-S28 PolarHBondContact O-OG 3.27Å; E25-S28 WeakPolarHBondContact O-CB 3.27Å; E25-S28 PolarHBondContact O-N 3.16Å; L26-S28 PolarHBondContact O-N 3.44Å; S28-R32 WeakPolarHBondContact O-CG 3.32Å; S28-R32 PolarHBondContact O-N 3.44Å; S28-R32 PolarHBondContact O-NE 3.12Å
29Q96.2Very high96.4Very high80 Ų8096.7 Ų96.737%0.37447%0.468SS..Hα-helixtrans-72.3-42.2170.5-69.9-178.419.900111.3E25 L26 R32 S33E25-Q29 WeakPolarHBondContact O-CG 3.34Å; E25-Q29 PolarHBondContact O-N 3.08Å; E25-Q29 PolarHBondContact OE1-NE2 2.91Å; L26-Q29 PolarHBondContact O-N 3.12Å; L26-Q29 VanDerWaalsContact O-N 3.17Å; Q29-R32 PolarHBondContact O-N 3.5Å; Q29-S33 PolarHBondContact O-N 3.3Å
30L96.5Very high96.4Very high97 Ų9795.2 Ų95.251%0.50847%0.47SS..Hα-helixtrans-59.9-51.2176.8-179.660.5000111L26 R32 S33 E34L26-L30 WeakPolarHBondContact O-CB 3.35Å; L26-L30 PolarHBondContact O-N 2.93Å; L30-R32 VanDerWaalsContact C-N 3.31Å; L30-R32 PolarHBondContact O-N 2.89Å; L30-S33 CarbonylContact O-C 3.6Å; L30-S33 WeakPolarHBondContact O-CA 3.34Å; L30-S33 WeakPolarHBondContact O-CB 3.35Å; L30-S33 PolarHBondContact O-N 2.91Å; L30-E34 HydrophobicContact CD1-CG 4.27Å; L30-E34 HydrophobicContact CG-CG 4.42Å; L30-E34 WeakPolarHBondContact O-CG 3.43Å; L30-E34 PolarHBondContact O-N 2.69Å
31R96.9Very high96.5Very high147 Ų14794.6 Ų94.656%0.55547%0.47SS*.Hα-helixtrans-56.4-41176.9-78.5-179.6-77.3-163.2-3.3113.2E27 E34 E35E27-R31 WeakPolarHBondContact O-CB 3.34Å; E27-R31 WeakPolarHBondContact O-CG 3.49Å; E27-R31 PolarHBondContact O-N 2.84Å; E27-R31 VanDerWaalsContact O-N 3.1Å; E27-R31 PolarHBondContact O-NE 3.23Å; R31-E34 PolarHBondContact O-N 2.75Å; R31-E35 WeakPolarHBondContact O-CB 3.48Å; R31-E35 PolarHBondContact O-N 3.33Å
32R96.6Very high96.5Very high140 Ų14092.2 Ų92.253%0.52847%0.465SS..Hα-helixtrans-65.3-36.8173.4-78.4179.4-81.9122-11112.5S28 Q29 L30 T36S28-R32 WeakPolarHBondContact O-CG 3.32Å; S28-R32 PolarHBondContact O-N 3.44Å; S28-R32 PolarHBondContact O-NE 3.12Å; Q29-R32 PolarHBondContact O-N 3.5Å; L30-R32 VanDerWaalsContact C-N 3.31Å; L30-R32 PolarHBondContact O-N 2.89Å; R32-T36 WeakPolarHBondContact O-CB 3.5Å; R32-T36 WeakPolarHBondContact O-CG2 3.46Å; R32-T36 PolarHBondContact O-N 2.88Å; R32-T36 VanDerWaalsContact O-N 3.09Å; R32-T36 PolarHBondContact O-OG1 3.29Å
33S95.2Very high96.4Very high72 Ų7293.6 Ų93.650%0.50347%0.473SS..Hα-helixtrans-68.9-35174.2-165.60000112.7Q29 L30 T36 N37Q29-S33 PolarHBondContact O-N 3.3Å; L30-S33 CarbonylContact O-C 3.6Å; L30-S33 WeakPolarHBondContact O-CA 3.34Å; L30-S33 WeakPolarHBondContact O-CB 3.35Å; L30-S33 PolarHBondContact O-N 2.91Å; S33-T36 WeakPolarHBondContact CA-OG1 3.35Å; S33-T36 PolarHBondContact O-OG1 2.85Å; S33-T36 VanDerWaalsContact O-OG1 3.12Å; S33-N37 WeakPolarHBondContact O-CB 3.42Å; S33-N37 PolarHBondContact O-N 3.5Å
34E96Very high96.4Very high109 Ų10995.9 Ų95.951%0.50948%0.48SS..Hα-helixtrans-70.5-43.5176.4-70.3170.2155.200111.4L30 R31 N37 S38L30-E34 HydrophobicContact CD1-CG 4.27Å; L30-E34 HydrophobicContact CG-CG 4.42Å; L30-E34 WeakPolarHBondContact O-CG 3.43Å; L30-E34 PolarHBondContact O-N 2.69Å; R31-E34 PolarHBondContact O-N 2.75Å; E34-N37 PolarHBondContact O-N 3.18Å; E34-S38 WeakPolarHBondContact O-CB 3.47Å; E34-S38 PolarHBondContact O-N 2.89Å
35E96Very high96.5Very high118 Ų11896.2 Ų96.255%0.55149%0.485SS*.Hα-helixtrans-62.3-49.1176.4-174.8177.9-172.900111.8R31 N37 S38 Q39R31-E35 WeakPolarHBondContact O-CB 3.48Å; R31-E35 PolarHBondContact O-N 3.33Å; E35-N37 VanDerWaalsContact C-N 3.34Å; E35-N37 PolarHBondContact O-N 3.39Å; E35-S38 WeakPolarHBondContact O-CB 3.25Å; E35-S38 PolarHBondContact O-N 2.87Å; E35-Q39 WeakPolarHBondContact O-CG 3.3Å; E35-Q39 PolarHBondContact O-N 2.91Å
36T95.8Very high96.4Very high70 Ų7097.4 Ų97.443%0.42949%0.491SS..Hα-helixtrans-62.8-38.2176.3500000112.4R32 S33 Q39 L40R32-T36 WeakPolarHBondContact O-CB 3.5Å; R32-T36 WeakPolarHBondContact O-CG2 3.46Å; R32-T36 PolarHBondContact O-N 2.88Å; R32-T36 VanDerWaalsContact O-N 3.09Å; R32-T36 PolarHBondContact O-OG1 3.29Å; S33-T36 WeakPolarHBondContact CA-OG1 3.35Å; S33-T36 PolarHBondContact O-OG1 2.85Å; S33-T36 VanDerWaalsContact O-OG1 3.12Å; T36-Q39 PolarHBondContact O-N 3.34Å; T36-L40 WeakPolarHBondContact O-CG 3.38Å; T36-L40 PolarHBondContact O-N 3.47Å
37N96.6Very high96.4Very high92 Ų9298.2 Ų98.249%0.49249%0.494SS..Hα-helixtrans-63.9-40.1173.4-172.537.7000112S33 E34 E35 L40 L41S33-N37 WeakPolarHBondContact O-CB 3.42Å; S33-N37 PolarHBondContact O-N 3.5Å; E34-N37 PolarHBondContact O-N 3.18Å; E35-N37 VanDerWaalsContact C-N 3.34Å; E35-N37 PolarHBondContact O-N 3.39Å; N37-L40 PolarHBondContact O-N 2.94Å; N37-L41 WeakPolarHBondContact O-CB 3.35Å; N37-L41 WeakPolarHBondContact O-CG 3.47Å; N37-L41 PolarHBondContact O-N 3.23Å
38S96.8Very high96.4Very high76 Ų7698 Ų9853%0.53150%0.495SS..Hα-helixtrans-60.6-46.4174.1-170.20000111.9E34 E35 L40 L41 Q42E34-S38 WeakPolarHBondContact O-CB 3.47Å; E34-S38 PolarHBondContact O-N 2.89Å; E35-S38 WeakPolarHBondContact O-CB 3.25Å; E35-S38 PolarHBondContact O-N 2.87Å; S38-L40 PolarHBondContact O-N 3.25Å; S38-L41 PolarHBondContact O-N 2.98Å; S38-Q42 PolarHBondContact O-N 3.05Å
39Q97.1Very high96.4Very high95 Ų95102.2 Ų102.244%0.44451%0.508SS..Hα-helixtrans-60.2-43.3175.4-67.4174.212.400112E35 T36 Q42 Q43E35-Q39 WeakPolarHBondContact O-CG 3.3Å; E35-Q39 PolarHBondContact O-N 2.91Å; T36-Q39 PolarHBondContact O-N 3.34Å; Q39-Q42 PolarHBondContact O-N 3.48Å; Q39-Q43 WeakPolarHBondContact O-CG 3.27Å; Q39-Q43 PolarHBondContact O-N 3.46Å
40L96.4Very high96.4Very high107 Ų107103.6 Ų103.656%0.5651%0.513SS*.Hα-helixtrans-65.2-37176.3-72.4171.6000112.6T36 N37 S38 K44T36-L40 WeakPolarHBondContact O-CG 3.38Å; T36-L40 PolarHBondContact O-N 3.47Å; N37-L40 PolarHBondContact O-N 2.94Å; S38-L40 PolarHBondContact O-N 3.25Å; L40-K44 VanDerWaalsContact O-CB 3.25Å; L40-K44 WeakPolarHBondContact O-CB 3.47Å; L40-K44 PolarHBondContact O-N 2.93Å
41L96.8Very high96.3Very high98 Ų98102.1 Ų102.151%0.51351%0.508SS..Hα-helixtrans-65.6-41.1174.2-74.4170.7000111.9N37 S38 K44 A45N37-L41 WeakPolarHBondContact O-CB 3.35Å; N37-L41 WeakPolarHBondContact O-CG 3.47Å; N37-L41 PolarHBondContact O-N 3.23Å; S38-L41 PolarHBondContact O-N 2.98Å; L41-K44 PolarHBondContact O-N 3.4Å; L41-A45 PolarHBondContact O-N 3.5Å
42Q95.8Very high96.3Very high121 Ų121101.5 Ų101.557%0.56551%0.509SS*.Hα-helixtrans-63.1-49.9173.5-177.1-179.1-22.800111.4S38 Q39 K44 A45 E46S38-Q42 PolarHBondContact O-N 3.05Å; Q39-Q42 PolarHBondContact O-N 3.48Å; Q42-K44 VanDerWaalsContact C-N 3.27Å; Q42-K44 PolarHBondContact O-N 3.48Å; Q42-A45 WeakPolarHBondContact O-CA 3.43Å; Q42-A45 WeakPolarHBondContact O-CB 3.35Å; Q42-A45 PolarHBondContact O-N 2.91Å; Q42-E46 WeakPolarHBondContact CG-OE1 3.38Å; Q42-E46 PolarHBondContact NE2-OE1 3.44Å; Q42-E46 PolarHBondContact O-N 2.91Å
43Q96.3Very high96.3Very high111 Ų11199.4 Ų99.452%0.51951%0.505SS..Hα-helixtrans-58.1-40.1177.1-72.6179.2400111.9Q39 A45 E46 M47Q39-Q43 WeakPolarHBondContact O-CG 3.27Å; Q39-Q43 PolarHBondContact O-N 3.46Å; Q43-A45 PolarHBondContact O-N 3.4Å; Q43-E46 PolarHBondContact O-N 2.94Å; Q43-M47 WeakPolarHBondContact O-CB 3.44Å; Q43-M47 WeakPolarHBondContact O-CG 3.48Å; Q43-M47 PolarHBondContact O-N 3.16Å
44K97Very high96.2Very high135 Ų135101.9 Ų101.959%0.58751%0.512SS*.Hα-helixtrans-62.3-39.9174-177.6178.2179.9179.20112.1L40 L41 Q42 N48L40-K44 VanDerWaalsContact O-CB 3.25Å; L40-K44 WeakPolarHBondContact O-CB 3.47Å; L40-K44 PolarHBondContact O-N 2.93Å; L41-K44 PolarHBondContact O-N 3.4Å; Q42-K44 VanDerWaalsContact C-N 3.27Å; Q42-K44 PolarHBondContact O-N 3.48Å; K44-N48 WeakPolarHBondContact O-CB 3.45Å; K44-N48 VanDerWaalsContact O-CG 3.28Å; K44-N48 PolarHBondContact O-N 3.01Å; K44-N48 PolarHBondContact O-ND2 3.5Å
45A96.7Very high96.1Very high61 Ų61101 Ų10150%0.50451%0.508SS..Hα-helixtrans-66.4-44.3175.800000112.1L41 Q42 Q43 N48 K49L41-A45 PolarHBondContact O-N 3.5Å; Q42-A45 WeakPolarHBondContact O-CA 3.43Å; Q42-A45 WeakPolarHBondContact O-CB 3.35Å; Q42-A45 PolarHBondContact O-N 2.91Å; Q43-A45 PolarHBondContact O-N 3.4Å; A45-N48 PolarHBondContact O-N 3.32Å; A45-K49 PolarHBondContact O-N 2.93Å
46E96.3Very high96.2Very high89 Ų89102.2 Ų102.242%0.41651%0.511SS..Hα-helixtrans-63.7-42.7176.6-70.6178.3-159.400112.5Q42 Q43 K49 K50Q42-E46 WeakPolarHBondContact CG-OE1 3.38Å; Q42-E46 PolarHBondContact NE2-OE1 3.44Å; Q42-E46 PolarHBondContact O-N 2.91Å; Q43-E46 PolarHBondContact O-N 2.94Å; E46-K49 WeakPolarHBondContact O-CB 3.37Å; E46-K49 PolarHBondContact O-N 2.76Å; E46-K50 WeakPolarHBondContact O-CG 3.28Å; E46-K50 PolarHBondContact O-N 2.97Å
47M96.4Very high96.1Very high108 Ų108101.2 Ų101.253%0.53251%0.51SS..Hα-helixtrans-65.8-40.8175.7-72.5-58-64.300111.9Q43 K49 K50 V51Q43-M47 WeakPolarHBondContact O-CB 3.44Å; Q43-M47 WeakPolarHBondContact O-CG 3.48Å; Q43-M47 PolarHBondContact O-N 3.16Å; M47-K49 VanDerWaalsContact C-N 3.28Å; M47-K49 PolarHBondContact O-N 2.93Å; M47-K50 PolarHBondContact O-N 3.06Å; M47-K50 HydrophobicContact SD-CD 4.04Å; M47-V51 WeakPolarHBondContact O-CG2 3.46Å; M47-V51 PolarHBondContact O-N 3.42Å
48N95.8Very high96Very high86 Ų86102.6 Ų102.646%0.4651%0.514SS..Hα-helixtrans-62.2-33.8173-80.4-39.4000112.8K44 A45 K52K44-N48 WeakPolarHBondContact O-CB 3.45Å; K44-N48 VanDerWaalsContact O-CG 3.28Å; K44-N48 PolarHBondContact O-N 3.01Å; K44-N48 PolarHBondContact O-ND2 3.5Å; A45-N48 PolarHBondContact O-N 3.32Å; N48-K52 WeakPolarHBondContact O-CG 3.27Å; N48-K52 PolarHBondContact O-N 3.27Å
49K97.4Very high95.9Very high134 Ų134104.6 Ų104.658%0.58351%0.513SS*.Hα-helixtrans-65.6-49.3172.5-174.4-177173.6-173.40110.9A45 E46 M47 V51 K52 E53A45-K49 PolarHBondContact O-N 2.93Å; E46-K49 WeakPolarHBondContact O-CB 3.37Å; E46-K49 PolarHBondContact O-N 2.76Å; M47-K49 VanDerWaalsContact C-N 3.28Å; M47-K49 PolarHBondContact O-N 2.93Å; K49-V51 PolarHBondContact O-N 3.27Å; K49-K52 PolarHBondContact O-N 2.88Å; K49-E53 WeakPolarHBondContact CE-OE1 3.47Å; K49-E53 WeakPolarHBondContact O-CG 3.46Å; K49-E53 PolarHBondContact O-N 3.15Å
50K96.1Very high95.8Very high110 Ų110104.4 Ų104.448%0.47852%0.518SS..Hα-helixtrans-58.6-41.9176.9-72171.8-179.5168.90112.6E46 M47 E53 L54E46-K50 WeakPolarHBondContact O-CG 3.28Å; E46-K50 PolarHBondContact O-N 2.97Å; M47-K50 PolarHBondContact O-N 3.06Å; M47-K50 HydrophobicContact SD-CD 4.04Å; K50-E53 PolarHBondContact O-N 3.24Å; K50-L54 WeakPolarHBondContact O-CG 3.49Å; K50-L54 PolarHBondContact O-N 3.47Å
51V95Very high95.6Very high66 Ų66105 Ų10540%0.452%0.521SS..Hα-helixtrans-59.7-48.9175.21700000111M47 K49 E53 L54 E55M47-V51 WeakPolarHBondContact O-CG2 3.46Å; M47-V51 PolarHBondContact O-N 3.42Å; K49-V51 PolarHBondContact O-N 3.27Å; V51-E53 VanDerWaalsContact C-N 3.26Å; V51-E53 PolarHBondContact O-N 2.97Å; V51-L54 PolarHBondContact O-N 2.93Å; V51-E55 HydrophobicContact CG1-CG 4.43Å; V51-E55 WeakPolarHBondContact O-CG 3.4Å; V51-E55 PolarHBondContact O-N 2.93Å
52K96.7Very high95.3Very high134 Ų134105.6 Ų105.658%0.58352%0.524SS*.Hα-helixtrans-62.4-30.9177.3-72.4176.3180-179.80113.3N48 K49 K56N48-K52 WeakPolarHBondContact O-CG 3.27Å; N48-K52 PolarHBondContact O-N 3.27Å; K49-K52 PolarHBondContact O-N 2.88Å; K52-K56 VanDerWaalsContact O-CG 3.27Å; K52-K56 WeakPolarHBondContact O-CG 3.34Å; K52-K56 PolarHBondContact O-N 2.83Å
53E95.5Very high95.2Very high95 Ų95108.2 Ų108.244%0.44453%0.529SS..Hα-helixtrans-72.7-43.9174.8-73.3166.9179.600111.6K49 K50 V51 K56 A57K49-E53 WeakPolarHBondContact CE-OE1 3.47Å; K49-E53 WeakPolarHBondContact O-CG 3.46Å; K49-E53 PolarHBondContact O-N 3.15Å; K50-E53 PolarHBondContact O-N 3.24Å; V51-E53 VanDerWaalsContact C-N 3.26Å; V51-E53 PolarHBondContact O-N 2.97Å; E53-K56 WeakPolarHBondContact O-CB 3.48Å; E53-K56 PolarHBondContact O-N 3.5Å; E53-A57 PolarHBondContact O-N 3Å
54L94.1Very high95Very high125 Ų125105.1 Ų105.165%0.65452%0.52SS*.Hα-helixtrans-63.7-41.2174.8-70.2171.8000112.4K50 V51 K56 A57 Q58K50-L54 WeakPolarHBondContact O-CG 3.49Å; K50-L54 PolarHBondContact O-N 3.47Å; V51-L54 PolarHBondContact O-N 2.93Å; L54-K56 VanDerWaalsContact C-N 3.32Å; L54-K56 PolarHBondContact O-N 3.36Å; L54-A57 PolarHBondContact O-N 3.18Å; L54-Q58 WeakPolarHBondContact O-CB 3.47Å; L54-Q58 PolarHBondContact O-N 3.36Å
55E94.5Very high94.6Very high89 Ų89102.8 Ų102.842%0.41651%0.514SS..Hα-helixtrans-60.5-39.2173.5-75178.5177.500112.5V51 K59V51-E55 HydrophobicContact CG1-CG 4.43Å; V51-E55 WeakPolarHBondContact O-CG 3.4Å; V51-E55 PolarHBondContact O-N 2.93Å; E55-K59 WeakPolarHBondContact O-CB 3.3Å; E55-K59 VanDerWaalsContact O-CG 3.29Å; E55-K59 WeakPolarHBondContact O-CG 3.5Å; E55-K59 PolarHBondContact O-N 2.93Å
56K96.5Very high94.5Very high145 Ų145105.9 Ų105.963%0.6352%0.516SS*.Hα-helixtrans-65.5-46.2174.6-75.4171.2-178-178.60110.8K52 E53 L54 K59 V60K52-K56 VanDerWaalsContact O-CG 3.27Å; K52-K56 WeakPolarHBondContact O-CG 3.34Å; K52-K56 PolarHBondContact O-N 2.83Å; E53-K56 WeakPolarHBondContact O-CB 3.48Å; E53-K56 PolarHBondContact O-N 3.5Å; L54-K56 VanDerWaalsContact C-N 3.32Å; L54-K56 PolarHBondContact O-N 3.36Å; K56-K59 PolarHBondContact O-N 3.43Å; K56-V60 WeakPolarHBondContact O-CG2 3.4Å; K56-V60 PolarHBondContact O-N 3.33Å; K56-V60 VanDerWaalsContact O-N 3.1Å
57A93.9Very high94.3Very high49 Ų49108.2 Ų108.241%0.40552%0.524SS..Hα-helixtrans-60.9-45.1177.100000111.9E53 L54 K59 V60 L61E53-A57 PolarHBondContact O-N 3Å; L54-A57 PolarHBondContact O-N 3.18Å; A57-K59 PolarHBondContact O-N 3.19Å; A57-V60 PolarHBondContact O-N 3.39Å; A57-V60 VanDerWaalsContact O-N 3.14Å; A57-L61 WeakPolarHBondContact O-CG 3.45Å; A57-L61 PolarHBondContact O-N 2.89Å
58Q94.2Very high94Very high120 Ų120109.8 Ų109.856%0.56153%0.525SS*.Hα-helixtrans-58.9-44.5175.7-170-171.630.900111.7L54 V60 L61 L62L54-Q58 WeakPolarHBondContact O-CB 3.47Å; L54-Q58 PolarHBondContact O-N 3.36Å; Q58-V60 VanDerWaalsContact C-N 3.3Å; Q58-V60 PolarHBondContact O-N 2.9Å; Q58-L61 PolarHBondContact O-N 2.89Å; Q58-L62 HydrophobicContact CG-CD1 4.18Å; Q58-L62 WeakPolarHBondContact O-CB 3.41Å; Q58-L62 WeakPolarHBondContact O-CG 3.35Å; Q58-L62 PolarHBondContact O-N 3.36Å
59K95.2Very high93.5Very high118 Ų118111.5 Ų111.551%0.51353%0.53SS..Hα-helixtrans-61.9-35.1175.9-75.7167.3-177.5166.30112.7E55 K56 A57 R63E55-K59 WeakPolarHBondContact O-CB 3.3Å; E55-K59 VanDerWaalsContact O-CG 3.29Å; E55-K59 WeakPolarHBondContact O-CG 3.5Å; E55-K59 PolarHBondContact O-N 2.93Å; K56-K59 PolarHBondContact O-N 3.43Å; A57-K59 PolarHBondContact O-N 3.19Å; K59-R63 VanDerWaalsContact O-CG 3.28Å; K59-R63 WeakPolarHBondContact O-CG 3.5Å; K59-R63 PolarHBondContact O-N 2.94Å
60V94.4Very high93.3Very high91 Ų91110 Ų11055%0.55253%0.526SS*.Hα-helixtrans-69.5-46.2173.9173.50000111.1K56 A57 Q58 L62 R63 S64K56-V60 WeakPolarHBondContact O-CG2 3.4Å; K56-V60 PolarHBondContact O-N 3.33Å; K56-V60 VanDerWaalsContact O-N 3.1Å; A57-V60 PolarHBondContact O-N 3.39Å; A57-V60 VanDerWaalsContact O-N 3.14Å; Q58-V60 VanDerWaalsContact C-N 3.3Å; Q58-V60 PolarHBondContact O-N 2.9Å; V60-L62 PolarHBondContact O-N 3.26Å; V60-R63 PolarHBondContact O-N 2.92Å; V60-S64 WeakPolarHBondContact O-CB 3.44Å; V60-S64 PolarHBondContact O-N 2.97Å
61L92.4Very high93.1Very high121 Ų121111.6 Ų111.663%0.63453%0.533SS*.Hα-helixtrans-61.3-42.4178.1-71.2173.7000112.4A57 Q58 R63 S64 N65A57-L61 WeakPolarHBondContact O-CG 3.45Å; A57-L61 PolarHBondContact O-N 2.89Å; Q58-L61 PolarHBondContact O-N 2.89Å; L61-R63 PolarHBondContact O-N 2.92Å; L61-S64 WeakPolarHBondContact O-CB 3.33Å; L61-S64 PolarHBondContact O-N 3.16Å; L61-N65 WeakPolarHBondContact O-CB 3.31Å; L61-N65 PolarHBondContact O-N 3.46Å
62L92.1Very high92.6Very high110 Ų110113.7 Ų113.758%0.57654%0.54SS*.Hα-helixtrans-61.5-42.8176.1-73.6170000112.3Q58 V60 N65 K66Q58-L62 HydrophobicContact CG-CD1 4.18Å; Q58-L62 WeakPolarHBondContact O-CB 3.41Å; Q58-L62 WeakPolarHBondContact O-CG 3.35Å; Q58-L62 PolarHBondContact O-N 3.36Å; V60-L62 PolarHBondContact O-N 3.26Å; L62-N65 PolarHBondContact O-N 2.67Å; L62-K66 PolarHBondContact O-N 3.38Å
63R93.8Very high92.1Very high176 Ų176114 Ų11466%0.66454%0.544SS*.Hα-helixtrans-64.4-39.8174.6-69.8170-173.1175.31.1112.1K59 V60 L61 K67K59-R63 VanDerWaalsContact O-CG 3.28Å; K59-R63 WeakPolarHBondContact O-CG 3.5Å; K59-R63 PolarHBondContact O-N 2.94Å; V60-R63 PolarHBondContact O-N 2.92Å; L61-R63 PolarHBondContact O-N 2.92Å; R63-K67 WeakPolarHBondContact O-CG 3.49Å; R63-K67 PolarHBondContact O-N 2.95Å
64S91.9Very high91.7Very high46 Ų46112.4 Ų112.432%0.32255%0.546SS..Hα-helixtrans-65.2-47.6177.4-165.30000111.1V60 L61 K66 K67 Y68V60-S64 WeakPolarHBondContact O-CB 3.44Å; V60-S64 PolarHBondContact O-N 2.97Å; L61-S64 WeakPolarHBondContact O-CB 3.33Å; L61-S64 PolarHBondContact O-N 3.16Å; S64-K66 PolarHBondContact O-N 2.97Å; S64-K67 WeakPolarHBondContact O-CB 3.47Å; S64-K67 PolarHBondContact O-N 3.47Å; S64-K67 VanDerWaalsContact O-N 3.16Å; S64-Y68 WeakPolarHBondContact O-CD2 3.39Å; S64-Y68 PolarHBondContact O-N 3.41Å; S64-Y68 WeakPolarHBondContact OG-CE2 3.49Å
65N88.3Confident91.4Very high86 Ų86110.1 Ų110.146%0.4654%0.537SS..Hα-helixtrans-58.8-45.6177-168-71.8000111.6L61 L62 K67 Y68 Q69L61-N65 WeakPolarHBondContact O-CB 3.31Å; L61-N65 PolarHBondContact O-N 3.46Å; L62-N65 PolarHBondContact O-N 2.67Å; N65-K67 PolarHBondContact O-N 2.9Å; N65-Y68 PolarHBondContact O-N 3.41Å; N65-Q69 WeakPolarHBondContact O-CG 3.4Å; N65-Q69 PolarHBondContact O-N 3.03Å; N65-Q69 PolarHBondContact OD1-NE2 3.41Å; N65-Q69 VanDerWaalsContact OD1-NE2 3.07Å
66K94.2Very high91Very high126 Ų126109.4 Ų109.455%0.54854%0.539SS..Hα-helixtrans-56.1-46.2174.4-172.7178-179.9-1680112.3L62 S64 Y68 Q69 E70L62-K66 PolarHBondContact O-N 3.38Å; S64-K66 PolarHBondContact O-N 2.97Å; K66-Y68 VanDerWaalsContact C-N 3.3Å; K66-Y68 PolarHBondContact O-N 3.24Å; K66-Q69 PolarHBondContact O-N 3.28Å; K66-E70 WeakPolarHBondContact CE-OE1 3.34Å; K66-E70 IonicContact NZ-OE1 3.08Å; K66-E70 WeakPolarHBondContact O-CG 3.46Å; K66-E70 PolarHBondContact O-N 3.28Å
67K92.8Very high90.6Very high137 Ų137105 Ų10560%0.59653%0.529SS*.Hα-helixtrans-61.7-34.8175.4-72.6-177.7176.9-169.80113.1R63 S64 N65 K71R63-K67 WeakPolarHBondContact O-CG 3.49Å; R63-K67 PolarHBondContact O-N 2.95Å; S64-K67 WeakPolarHBondContact O-CB 3.47Å; S64-K67 PolarHBondContact O-N 3.47Å; S64-K67 VanDerWaalsContact O-N 3.16Å; N65-K67 PolarHBondContact O-N 2.9Å; K67-K71 WeakPolarHBondContact O-CG 3.46Å; K67-K71 PolarHBondContact O-N 3.07Å; K67-K71 VanDerWaalsContact O-N 3.14Å
68Y88.8Confident90.5Very high142 Ų142109.6 Ų109.656%0.55754%0.541SS*.Hα-helixtrans-71-40.9174.1-74.2-64.5000112.1S64 N65 K66 K71 I72S64-Y68 WeakPolarHBondContact O-CD2 3.39Å; S64-Y68 PolarHBondContact O-N 3.41Å; S64-Y68 WeakPolarHBondContact OG-CE2 3.49Å; N65-Y68 PolarHBondContact O-N 3.41Å; K66-Y68 VanDerWaalsContact C-N 3.3Å; K66-Y68 PolarHBondContact O-N 3.24Å; Y68-K71 PolarHBondContact O-N 2.88Å; Y68-I72 VanDerWaalsContact O-CG1 3.26Å; Y68-I72 WeakPolarHBondContact O-CG1 3.38Å; Y68-I72 PolarHBondContact O-N 3.05Å
69Q86.7Confident89.9Confident121 Ų121108.6 Ų108.657%0.56554%0.536SS*.Hα-helixtrans-60.8-44.9174.3-70.2-179.4-7.600111.7N65 K66 K71 I72 H73N65-Q69 WeakPolarHBondContact O-CG 3.4Å; N65-Q69 PolarHBondContact O-N 3.03Å; N65-Q69 PolarHBondContact OD1-NE2 3.41Å; N65-Q69 VanDerWaalsContact OD1-NE2 3.07Å; K66-Q69 PolarHBondContact O-N 3.28Å; Q69-K71 VanDerWaalsContact C-N 3.35Å; Q69-K71 PolarHBondContact O-N 3.09Å; Q69-I72 PolarHBondContact O-N 3.49Å; Q69-H73 WeakPolarHBondContact O-CB 3.34Å; Q69-H73 PolarHBondContact O-N 3.34Å
70E92.2Very high89.4Confident104 Ų104106.2 Ų106.249%0.48653%0.531SS..Hα-helixtrans-58.5-44.2174.9-72.1165.5173.500111.7K66 A74K66-E70 WeakPolarHBondContact CE-OE1 3.34Å; K66-E70 IonicContact NZ-OE1 3.08Å; K66-E70 WeakPolarHBondContact O-CG 3.46Å; K66-E70 PolarHBondContact O-N 3.28Å; E70-A74 WeakPolarHBondContact O-CB 3.47Å; E70-A74 PolarHBondContact O-N 3.32Å
71K91Very high89.3Confident143 Ų143108 Ų10862%0.62253%0.532SS*.Hα-helixtrans-64-45.3175.2-76.7179.4175.7-169.20113K67 Y68 Q69 H73 A74 V75K67-K71 WeakPolarHBondContact O-CG 3.46Å; K67-K71 PolarHBondContact O-N 3.07Å; K67-K71 VanDerWaalsContact O-N 3.14Å; Y68-K71 PolarHBondContact O-N 2.88Å; Q69-K71 VanDerWaalsContact C-N 3.35Å; Q69-K71 PolarHBondContact O-N 3.09Å; K71-H73 VanDerWaalsContact C-N 3.34Å; K71-A74 PolarHBondContact O-N 3.02Å; K71-V75 WeakPolarHBondContact O-CG2 3.5Å; K71-V75 PolarHBondContact O-N 3.27Å
72I85.2Confident89.2Confident109 Ų109106.9 Ų106.956%0.55952%0.523SS*.Hα-helixtrans-61.3-46.2178.3-70.1163.4000109.7Y68 Q69 A74 V75 V76Y68-I72 VanDerWaalsContact O-CG1 3.26Å; Y68-I72 WeakPolarHBondContact O-CG1 3.38Å; Y68-I72 PolarHBondContact O-N 3.05Å; Q69-I72 PolarHBondContact O-N 3.49Å; I72-A74 VanDerWaalsContact C-N 3.32Å; I72-A74 PolarHBondContact O-N 2.91Å; I72-V75 PolarHBondContact O-N 3.29Å; I72-V76 HydrophobicContact CG2-CG2 4.28Å; I72-V76 WeakPolarHBondContact O-CB 3.4Å; I72-V76 VanDerWaalsContact O-CG2 3.31Å; I72-V76 WeakPolarHBondContact O-CG2 3.45Å; I72-V76 PolarHBondContact O-N 3.45Å
73H85.5Confident88.9Confident142 Ų142107.7 Ų107.766%0.65752%0.522SS*.Hα-helixtrans-61.6-39.4177.5-169.7-71000112.3Q69 K71 A77Q69-H73 WeakPolarHBondContact O-CB 3.34Å; Q69-H73 PolarHBondContact O-N 3.34Å; K71-H73 VanDerWaalsContact C-N 3.34Å; H73-A77 VanDerWaalsContact O-CB 3.27Å; H73-A77 WeakPolarHBondContact O-CB 3.33Å; H73-A77 PolarHBondContact O-N 3.46Å
74A89Confident88.6Confident60 Ų60104 Ų10450%0.49651%0.512SS..Hα-helixtrans-66.1-42.7176.300000112.7E70 K71 I72 F78E70-A74 WeakPolarHBondContact O-CB 3.47Å; E70-A74 PolarHBondContact O-N 3.32Å; K71-A74 PolarHBondContact O-N 3.02Å; I72-A74 VanDerWaalsContact C-N 3.32Å; I72-A74 PolarHBondContact O-N 2.91Å; A74-F78 WeakPolarHBondContact O-CB 3.5Å; A74-F78 PolarHBondContact O-N 3.33Å
75V85.9Confident88.4Confident77 Ų77105 Ų10547%0.46751%0.514SS..Hα-helixtrans-64.9-48.3176.1171.70000110.9K71 I72 A77 F78 E79K71-V75 WeakPolarHBondContact O-CG2 3.5Å; K71-V75 PolarHBondContact O-N 3.27Å; I72-V75 PolarHBondContact O-N 3.29Å; V75-A77 PolarHBondContact O-N 3.41Å; V75-F78 PolarHBondContact O-N 2.87Å; V75-F78 VanDerWaalsContact O-N 3.17Å; V75-E79 HydrophobicContact CG1-CG 4.28Å; V75-E79 WeakPolarHBondContact O-CG 3.42Å; V75-E79 PolarHBondContact O-N 3.41Å
76V86.7Confident88.4Confident74 Ų74106.2 Ų106.245%0.44852%0.515SS..Hα-helixtrans-59.7-45.3178.3170.90000110.9I72 F78 E79 T80I72-V76 HydrophobicContact CG2-CG2 4.28Å; I72-V76 WeakPolarHBondContact O-CB 3.4Å; I72-V76 VanDerWaalsContact O-CG2 3.31Å; I72-V76 WeakPolarHBondContact O-CG2 3.45Å; I72-V76 PolarHBondContact O-N 3.45Å; V76-F78 VanDerWaalsContact C-N 3.32Å; V76-F78 PolarHBondContact O-N 2.94Å; V76-E79 PolarHBondContact O-N 3.04Å; V76-T80 WeakPolarHBondContact O-CB 3.5Å; V76-T80 PolarHBondContact O-N 2.84Å; V76-T80 PolarHBondContact O-OG1 2.9Å
77A88.7Confident88.1Confident52 Ų52105.2 Ų105.243%0.4352%0.516SS..Hα-helixtrans-62.1-37.7177.200000112.9H73 V75 K81H73-A77 VanDerWaalsContact O-CB 3.27Å; H73-A77 WeakPolarHBondContact O-CB 3.33Å; H73-A77 PolarHBondContact O-N 3.46Å; V75-A77 PolarHBondContact O-N 3.41Å; A77-K81 WeakPolarHBondContact O-CB 3.49Å; A77-K81 PolarHBondContact O-N 3.13Å
78F90.5Very high88.1Confident146 Ų146104 Ų10464%0.6451%0.51SS*.Hα-helixtrans-67.4-47.7174.9175.5-93.9000112.1A74 V75 V76 K81 H82A74-F78 WeakPolarHBondContact O-CB 3.5Å; A74-F78 PolarHBondContact O-N 3.33Å; V75-F78 PolarHBondContact O-N 2.87Å; V75-F78 VanDerWaalsContact O-N 3.17Å; V76-F78 VanDerWaalsContact C-N 3.32Å; V76-F78 PolarHBondContact O-N 2.94Å; F78-K81 PolarHBondContact O-N 2.93Å; F78-H82 WeakPolarHBondContact O-CB 3.3Å; F78-H82 PolarHBondContact O-N 3.48Å
79E83.2Confident88.1Confident99 Ų99101.7 Ų101.746%0.46351%0.505SS..Hα-helixtrans-63.6-44.8178.9-72.5-179168.200111.7V75 V76 K81 H82 F83V75-E79 HydrophobicContact CG1-CG 4.28Å; V75-E79 WeakPolarHBondContact O-CG 3.42Å; V75-E79 PolarHBondContact O-N 3.41Å; V76-E79 PolarHBondContact O-N 3.04Å; E79-K81 PolarHBondContact O-N 3.36Å; E79-H82 PolarHBondContact O-N 3.38Å; E79-F83 HydrophobicContact CB-CE2 4.44Å; E79-F83 WeakPolarHBondContact O-CD2 3.39Å; E79-F83 PolarHBondContact O-N 3.06Å
80T84.9Confident88.1Confident68 Ų6898.5 Ų98.542%0.41750%0.499SS..Hα-helixtrans-55.7-51.4175.1-61.30000110.8V76 H82 F83 E84V76-T80 WeakPolarHBondContact O-CB 3.5Å; V76-T80 PolarHBondContact O-N 2.84Å; V76-T80 PolarHBondContact O-OG1 2.9Å; T80-H82 VanDerWaalsContact C-N 3.35Å; T80-H82 PolarHBondContact O-N 2.81Å; T80-F83 PolarHBondContact O-N 3.17Å; T80-E84 HydrophobicContact CG2-CG 4.48Å; T80-E84 WeakPolarHBondContact O-CG 3.37Å; T80-E84 PolarHBondContact O-N 3.35Å
81K90.7Very high87.9Confident128 Ų12899.1 Ų99.156%0.55750%0.502SS*.Hα-helixtrans-60.9-42.3177.8-172.1-175.9175.7-172.70112.2A77 F78 E79 F83 E84 D85A77-K81 WeakPolarHBondContact O-CB 3.49Å; A77-K81 PolarHBondContact O-N 3.13Å; F78-K81 PolarHBondContact O-N 2.93Å; E79-K81 PolarHBondContact O-N 3.36Å; K81-F83 VanDerWaalsContact C-N 3.32Å; K81-F83 PolarHBondContact O-N 3.45Å; K81-E84 PolarHBondContact O-N 3.1Å; K81-D85 WeakPolarHBondContact CE-OD2 3.21Å; K81-D85 PolarHBondContact O-N 2.89Å
82H90.5Very high88Confident99 Ų9997.7 Ų97.746%0.45850%0.497SS..Hα-helixtrans-60.9-39.4178.3179.168.9000112.5F78 E79 T80 K86F78-H82 WeakPolarHBondContact O-CB 3.3Å; F78-H82 PolarHBondContact O-N 3.48Å; E79-H82 PolarHBondContact O-N 3.38Å; T80-H82 VanDerWaalsContact C-N 3.35Å; T80-H82 PolarHBondContact O-N 2.81Å; H82-K86 WeakPolarHBondContact O-CG 3.41Å; H82-K86 PolarHBondContact O-N 3.41Å; H82-K86 VanDerWaalsContact O-N 3.17Å
83F85.5Confident88.1Confident126 Ų12695.7 Ų95.755%0.55349%0.487SS*.Hα-helixtrans-75.2-34.9175.2-72-61.7000112.9E79 T80 K81 K86 L87E79-F83 HydrophobicContact CB-CE2 4.44Å; E79-F83 WeakPolarHBondContact O-CD2 3.39Å; E79-F83 PolarHBondContact O-N 3.06Å; T80-F83 PolarHBondContact O-N 3.17Å; K81-F83 VanDerWaalsContact C-N 3.32Å; K81-F83 PolarHBondContact O-N 3.45Å; F83-K86 PolarHBondContact O-N 3.3Å; F83-L87 VanDerWaalsContact O-CB 3.3Å; F83-L87 WeakPolarHBondContact O-CB 3.41Å; F83-L87 PolarHBondContact O-N 3.35Å
84E88.1Confident88.3Confident99 Ų9993.1 Ų93.146%0.46348%0.478SS..Hα-helixtrans-61.4-44.7171.9-75.2174-179.800112.2T80 K81 L87 K88T80-E84 HydrophobicContact CG2-CG 4.48Å; T80-E84 WeakPolarHBondContact O-CG 3.37Å; T80-E84 PolarHBondContact O-N 3.35Å; K81-E84 PolarHBondContact O-N 3.1Å; E84-L87 WeakPolarHBondContact O-CB 3.17Å; E84-L87 PolarHBondContact O-N 3.01Å; E84-K88 WeakPolarHBondContact O-CG 3.46Å; E84-K88 PolarHBondContact O-N 3.47Å
85D88.1Confident88.2Confident66 Ų6693.1 Ų93.135%0.35348%0.478SS..Hα-helixtrans-69.2-37.8179.9-69-22.4000111.4K81 L87 K88 Q89K81-D85 WeakPolarHBondContact CE-OD2 3.21Å; K81-D85 PolarHBondContact O-N 2.89Å; D85-L87 VanDerWaalsContact C-N 3.35Å; D85-L87 PolarHBondContact O-N 2.9Å; D85-K88 PolarHBondContact O-N 2.91Å; D85-K88 IonicContact OD1-NZ 2.65Å; D85-K88 PolarHBondContact OD1-NZ 3.49Å; D85-Q89 PolarHBondContact O-N 3.5Å; D85-Q89 VanDerWaalsContact O-N 3.15Å
86K87.5Confident88.4Confident113 Ų11394.6 Ų94.649%0.49148%0.481SS..Hα-helixtrans-62-39.2168.6-81.3178.9166.7171.30113.1H82 F83 Q89 A90H82-K86 WeakPolarHBondContact O-CG 3.41Å; H82-K86 PolarHBondContact O-N 3.41Å; H82-K86 VanDerWaalsContact O-N 3.17Å; F83-K86 PolarHBondContact O-N 3.3Å; K86-Q89 PolarHBondContact O-N 3.43Å; K86-A90 PolarHBondContact O-N 3.42Å
87L88.4Confident88.4Confident105 Ų10595.4 Ų95.455%0.5549%0.486SS..Hα-helixtrans-66.3-39.1178.9-172.665.7000111.1F83 E84 D85 A90 H91F83-L87 VanDerWaalsContact O-CB 3.3Å; F83-L87 WeakPolarHBondContact O-CB 3.41Å; F83-L87 PolarHBondContact O-N 3.35Å; E84-L87 WeakPolarHBondContact O-CB 3.17Å; E84-L87 PolarHBondContact O-N 3.01Å; D85-L87 VanDerWaalsContact C-N 3.35Å; D85-L87 PolarHBondContact O-N 2.9Å; L87-A90 PolarHBondContact O-N 3.32Å; L87-H91 PolarHBondContact O-N 3.09Å; L87-H91 VanDerWaalsContact O-N 3.13Å; L87-H91 PolarHBondContact O-ND1 2.9Å
88K92.5Very high88.5Confident110 Ų11098.7 Ų98.748%0.47849%0.491SS..Hα-helixtrans-60.8-51173.7-68.1165.9-159.9156.80111.3E84 D85 A90 H91 E92E84-K88 WeakPolarHBondContact O-CG 3.46Å; E84-K88 PolarHBondContact O-N 3.47Å; D85-K88 PolarHBondContact O-N 2.91Å; D85-K88 IonicContact OD1-NZ 2.65Å; D85-K88 PolarHBondContact OD1-NZ 3.49Å; K88-A90 VanDerWaalsContact C-N 3.31Å; K88-A90 PolarHBondContact O-N 3.19Å; K88-H91 WeakPolarHBondContact O-CB 3.29Å; K88-H91 PolarHBondContact O-N 2.88Å; K88-E92 PolarHBondContact O-N 3.23Å
89Q89.4Confident88.4Confident95 Ų9596.6 Ų96.644%0.44448%0.483SS..Hα-helixtrans-54.5-46.9177.3-174.464.558.900111.7D85 K86 H91 E92 D93D85-Q89 PolarHBondContact O-N 3.5Å; D85-Q89 VanDerWaalsContact O-N 3.15Å; K86-Q89 PolarHBondContact O-N 3.43Å; Q89-H91 VanDerWaalsContact C-N 3.28Å; Q89-H91 PolarHBondContact O-N 3.36Å; Q89-E92 PolarHBondContact O-N 3.41Å; Q89-E92 VanDerWaalsContact O-N 3.12Å; Q89-D93 PolarHBondContact NE2-OD1 3.35Å; Q89-D93 PolarHBondContact O-N 2.95Å
90A87Confident88.7Confident54 Ų5495 Ų9545%0.44648%0.482SS..Hα-helixtrans-63.4-30.2178.600000113.6K86 L87 K88 L94K86-A90 PolarHBondContact O-N 3.42Å; L87-A90 PolarHBondContact O-N 3.32Å; K88-A90 VanDerWaalsContact C-N 3.31Å; K88-A90 PolarHBondContact O-N 3.19Å; A90-L94 VanDerWaalsContact O-CB 3.28Å; A90-L94 WeakPolarHBondContact O-CB 3.49Å; A90-L94 PolarHBondContact O-N 2.93Å; A90-L94 VanDerWaalsContact O-N 3.1Å
91H88.6Confident88.9Confident117 Ų11797 Ų9754%0.54249%0.489SS..Hα-helixtrans-73-38173-78.679000112.2L87 K88 Q89 L94 A95L87-H91 PolarHBondContact O-N 3.09Å; L87-H91 VanDerWaalsContact O-N 3.13Å; L87-H91 PolarHBondContact O-ND1 2.9Å; K88-H91 WeakPolarHBondContact O-CB 3.29Å; K88-H91 PolarHBondContact O-N 2.88Å; Q89-H91 VanDerWaalsContact C-N 3.28Å; Q89-H91 PolarHBondContact O-N 3.36Å; H91-L94 PolarHBondContact O-N 2.95Å; H91-A95 WeakPolarHBondContact O-CB 3.44Å; H91-A95 PolarHBondContact O-N 3.09Å
92E91.6Very high88.8Confident113 Ų11397.2 Ų97.253%0.52849%0.493SS..Hα-helixtrans-65.3-45.9174.9-69172.7-161.200111.1K88 Q89 L94 A95 M96K88-E92 PolarHBondContact O-N 3.23Å; Q89-E92 PolarHBondContact O-N 3.41Å; Q89-E92 VanDerWaalsContact O-N 3.12Å; E92-L94 VanDerWaalsContact C-N 3.34Å; E92-L94 PolarHBondContact O-N 2.94Å; E92-A95 WeakPolarHBondContact O-CB 3.27Å; E92-A95 PolarHBondContact O-N 3.1Å; E92-A95 VanDerWaalsContact O-N 3.14Å; E92-M96 WeakPolarHBondContact O-CG 3.42Å; E92-M96 PolarHBondContact O-N 2.69Å
93D87.3Confident88.9Confident66 Ų6698.5 Ų98.535%0.35350%0.497SS..Hα-helixtrans-61.4-40.6176.1-63-20.8000111.9Q89 M96 T97Q89-D93 PolarHBondContact NE2-OD1 3.35Å; Q89-D93 PolarHBondContact O-N 2.95Å; D93-M96 PolarHBondContact O-N 3.05Å; D93-M96 WeakPolarHBondContact OD1-CE 3.34Å; D93-T97 WeakPolarHBondContact O-CB 3.42Å; D93-T97 PolarHBondContact O-N 3.19Å; D93-T97 PolarHBondContact O-OG1 3.05Å
94L89.6Confident89Confident89 Ų8997.4 Ų97.447%0.46650%0.496SS..Hα-helixtrans-65.1-38.7174.3179.362.3000112.1A90 H91 E92 T97 K98A90-L94 VanDerWaalsContact O-CB 3.28Å; A90-L94 WeakPolarHBondContact O-CB 3.49Å; A90-L94 PolarHBondContact O-N 2.93Å; A90-L94 VanDerWaalsContact O-N 3.1Å; H91-L94 PolarHBondContact O-N 2.95Å; E92-L94 VanDerWaalsContact C-N 3.34Å; E92-L94 PolarHBondContact O-N 2.94Å; L94-T97 PolarHBondContact O-N 3.33Å; L94-K98 WeakPolarHBondContact O-CG 3.32Å; L94-K98 PolarHBondContact O-N 3.43Å
95A87.1Confident88.9Confident59 Ų5995.5 Ų95.549%0.48849%0.493SS..Hα-helixtrans-66.1-44.7176.500000111.5H91 E92 T97 K98 Q99H91-A95 WeakPolarHBondContact O-CB 3.44Å; H91-A95 PolarHBondContact O-N 3.09Å; E92-A95 WeakPolarHBondContact O-CB 3.27Å; E92-A95 PolarHBondContact O-N 3.1Å; E92-A95 VanDerWaalsContact O-N 3.14Å; A95-T97 VanDerWaalsContact C-N 3.34Å; A95-T97 PolarHBondContact O-N 3.18Å; A95-K98 PolarHBondContact O-N 2.83Å; A95-Q99 PolarHBondContact O-N 3.34Å
96M89.9Confident89.1Confident108 Ų10895.4 Ų95.453%0.53250%0.502SS..Hα-helixtrans-59.7-44.4173-69.2-168.5-7000111.6E92 D93 K98 Q99 C100E92-M96 WeakPolarHBondContact O-CG 3.42Å; E92-M96 PolarHBondContact O-N 2.69Å; D93-M96 PolarHBondContact O-N 3.05Å; D93-M96 WeakPolarHBondContact OD1-CE 3.34Å; M96-K98 PolarHBondContact O-N 3.33Å; M96-Q99 PolarHBondContact O-N 3.02Å; M96-C100 PolarHBondContact O-N 3.02Å; M96-C100 PolarHBondContact O-SG 3.13Å
97T86.5Confident89.3Confident91 Ų9193.8 Ų93.856%0.55850%0.496SS*.Hα-helixtrans-62.9-41.9179.7-57.70000112D93 L94 A95 C100 L101D93-T97 WeakPolarHBondContact O-CB 3.42Å; D93-T97 PolarHBondContact O-N 3.19Å; D93-T97 PolarHBondContact O-OG1 3.05Å; L94-T97 PolarHBondContact O-N 3.33Å; A95-T97 VanDerWaalsContact C-N 3.34Å; A95-T97 PolarHBondContact O-N 3.18Å; T97-C100 PolarHBondContact O-N 2.97Å; T97-L101 PolarHBondContact O-N 2.93Å
98K90.6Very high89.2Confident121 Ų12191.7 Ų91.753%0.52649%0.489SS..Hα-helixtrans-61.3-45.5173.6-75.8175.4177.4-179.40111.9L94 A95 M96 C100 L101 E102L94-K98 WeakPolarHBondContact O-CG 3.32Å; L94-K98 PolarHBondContact O-N 3.43Å; A95-K98 PolarHBondContact O-N 2.83Å; M96-K98 PolarHBondContact O-N 3.33Å; K98-C100 VanDerWaalsContact C-N 3.31Å; K98-C100 PolarHBondContact O-N 3.19Å; K98-L101 WeakPolarHBondContact O-CB 3.37Å; K98-L101 PolarHBondContact O-N 3.39Å; K98-E102 WeakPolarHBondContact O-CG 3.46Å; K98-E102 PolarHBondContact O-N 3.06Å
99Q90.4Very high89.1Confident103 Ų10390.4 Ų90.448%0.48149%0.493SS..Hα-helixtrans-62.6-37.6177.6-162.1-163.354.200112.2A95 M96 K103A95-Q99 PolarHBondContact O-N 3.34Å; M96-Q99 PolarHBondContact O-N 3.02Å; Q99-K103 WeakPolarHBondContact O-CG 3.48Å; Q99-K103 PolarHBondContact O-N 3.14Å; Q99-K103 VanDerWaalsContact O-N 3.11Å
100C89.3Confident89.1Confident65 Ų6589.6 Ų89.644%0.43949%0.486SS..Hα-helixtrans-66.2-42173.5-74.40000112.1M96 T97 K98 E102 K103 I104M96-C100 PolarHBondContact O-N 3.02Å; M96-C100 PolarHBondContact O-SG 3.13Å; T97-C100 PolarHBondContact O-N 2.97Å; K98-C100 VanDerWaalsContact C-N 3.31Å; K98-C100 PolarHBondContact O-N 3.19Å; C100-E102 PolarHBondContact O-N 3.17Å; C100-K103 PolarHBondContact O-N 3.37Å; C100-I104 VanDerWaalsContact O-CG1 3.3Å; C100-I104 WeakPolarHBondContact O-CG1 3.32Å; C100-I104 PolarHBondContact O-N 3.02Å
101L88.5Confident89.2Confident109 Ų10991.2 Ų91.257%0.57149%0.487SS*.Hα-helixtrans-62.2-40.4175.9-178.163.4000112.3T97 K98 I104 S105T97-L101 PolarHBondContact O-N 2.93Å; K98-L101 WeakPolarHBondContact O-CB 3.37Å; K98-L101 PolarHBondContact O-N 3.39Å; L101-I104 PolarHBondContact O-N 2.96Å; L101-S105 VanDerWaalsContact O-CB 3.31Å; L101-S105 WeakPolarHBondContact O-CB 3.5Å; L101-S105 PolarHBondContact O-N 2.59Å; L101-S105 PolarHBondContact O-OG 3.16Å
102E88.3Confident89.3Confident134 Ų13492.8 Ų92.863%0.62649%0.492SS*.Hα-helixtrans-62-47174.1-73.5171.1-176.100111.8K98 C100 I104 S105 A106K98-E102 WeakPolarHBondContact O-CG 3.46Å; K98-E102 PolarHBondContact O-N 3.06Å; C100-E102 PolarHBondContact O-N 3.17Å; E102-I104 PolarHBondContact O-N 3.34Å; E102-S105 PolarHBondContact O-N 2.9Å; E102-A106 WeakPolarHBondContact O-CB 3.4Å; E102-A106 PolarHBondContact O-N 2.9Å
103K91.6Very high89.2Confident125 Ų12593.4 Ų93.454%0.54350%0.495SS..Hα-helixtrans-58.6-46.6175.7-72.9167.5-179.41660111.8Q99 C100 A106 E107Q99-K103 WeakPolarHBondContact O-CG 3.48Å; Q99-K103 PolarHBondContact O-N 3.14Å; Q99-K103 VanDerWaalsContact O-N 3.11Å; C100-K103 PolarHBondContact O-N 3.37Å; K103-A106 PolarHBondContact O-N 2.86Å; K103-E107 WeakPolarHBondContact O-CB 3.39Å; K103-E107 PolarHBondContact O-N 2.82Å
104I88.7Confident89.4Confident103 Ų10397.8 Ų97.853%0.52851%0.506SS..Hα-helixtrans-63.3-42.5177.4-68.7165.6000110.7C100 L101 E102 A106 E107 C108C100-I104 VanDerWaalsContact O-CG1 3.3Å; C100-I104 WeakPolarHBondContact O-CG1 3.32Å; C100-I104 PolarHBondContact O-N 3.02Å; L101-I104 PolarHBondContact O-N 2.96Å; E102-I104 PolarHBondContact O-N 3.34Å; I104-A106 PolarHBondContact O-N 3.12Å; I104-E107 PolarHBondContact O-N 3.04Å; I104-C108 WeakPolarHBondContact O-CB 3.48Å; I104-C108 PolarHBondContact O-N 3.05Å; I104-C108 PolarHBondContact O-SG 3.35Å
105S86.3Confident89.4Confident59 Ų5999.9 Ų99.941%0.41351%0.512SS..Hα-helixtrans-63.5-43.3179.7-59.30000112L101 E102 C108 C109L101-S105 VanDerWaalsContact O-CB 3.31Å; L101-S105 WeakPolarHBondContact O-CB 3.5Å; L101-S105 PolarHBondContact O-N 2.59Å; L101-S105 PolarHBondContact O-OG 3.16Å; E102-S105 PolarHBondContact O-N 2.9Å; S105-C108 PolarHBondContact O-N 2.88Å; S105-C109 PolarHBondContact O-N 3.18Å; S105-C109 PolarHBondContact O-SG 3.17Å
106A92.3Very high89.3Confident64 Ų64102.5 Ų102.553%0.52952%0.515SS..Hα-helixtrans-61.7-44.2174.600000111.8E102 K103 I104 C109 R110E102-A106 WeakPolarHBondContact O-CB 3.4Å; E102-A106 PolarHBondContact O-N 2.9Å; K103-A106 PolarHBondContact O-N 2.86Å; I104-A106 PolarHBondContact O-N 3.12Å; A106-C109 PolarHBondContact O-N 3.44Å; A106-R110 WeakPolarHBondContact O-CB 3.29Å; A106-R110 PolarHBondContact O-N 2.95Å
107E90.8Very high89.2Confident80 Ų80101.4 Ų101.437%0.37452%0.515SS..Hα-helixtrans-64.8-40.8176.7-179.462.8-174.700112.1K103 I104 C109 R110 L111K103-E107 WeakPolarHBondContact O-CB 3.39Å; K103-E107 PolarHBondContact O-N 2.82Å; I104-E107 PolarHBondContact O-N 3.04Å; E107-C109 VanDerWaalsContact C-N 3.35Å; E107-C109 PolarHBondContact O-N 3.37Å; E107-R110 VanDerWaalsContact CD-NH2 3.26Å; E107-R110 WeakPolarHBondContact O-CB 3.46Å; E107-R110 PolarHBondContact O-N 2.9Å; E107-R110 IonicContact OE1-CZ 2.68Å; E107-R110 IonicContact OE1-NE 3.26Å; E107-R110 IonicContact OE1-NH2 2.82Å; E107-R110 PolarHBondContact OE1-NH2 3.22Å; E107-R110 IonicContact OE2-CZ 3.67Å; E107-R110 VanDerWaalsContact OE2-CZ 3.26Å; E107-R110 IonicContact OE2-NE 3.29Å; E107-R110 PolarHBondContact OE2-NE 3.09Å; E107-R110 IonicContact OE2-NH2 3.41Å; E107-R110 PolarHBondContact OE2-NH2 3.28Å; E107-R110 VanDerWaalsContact OE2-NH2 3.17Å; E107-L111 HydrophobicContact CG-CD1 4.17Å; E107-L111 WeakPolarHBondContact O-CB 3.43Å; E107-L111 WeakPolarHBondContact O-CG 3.46Å; E107-L111 PolarHBondContact O-N 2.91Å
108C87.9Confident89.4Confident60 Ų6099.8 Ų99.841%0.40551%0.511SS..Hα-helixtrans-60.5-41.2172.9-73.40000112.4I104 S105 L111 K112I104-C108 WeakPolarHBondContact O-CB 3.48Å; I104-C108 PolarHBondContact O-N 3.05Å; I104-C108 PolarHBondContact O-SG 3.35Å; S105-C108 PolarHBondContact O-N 2.88Å; C108-L111 PolarHBondContact O-N 2.92Å; C108-K112 WeakPolarHBondContact O-CG 3.49Å; C108-K112 PolarHBondContact O-N 3.26Å
109C90.2Very high89.2Confident83 Ų8397.8 Ų97.856%0.56151%0.506SS*.Hα-helixtrans-63.3-44.5173.6-72.40000111.5S105 A106 E107 L111 K112 Q113S105-C109 PolarHBondContact O-N 3.18Å; S105-C109 PolarHBondContact O-SG 3.17Å; A106-C109 PolarHBondContact O-N 3.44Å; E107-C109 VanDerWaalsContact C-N 3.35Å; E107-C109 PolarHBondContact O-N 3.37Å; C109-L111 VanDerWaalsContact C-N 3.32Å; C109-L111 PolarHBondContact O-N 2.97Å; C109-K112 PolarHBondContact O-N 3.37Å; C109-Q113 PolarHBondContact O-N 2.97Å
110R89.5Confident89.2Confident79 Ų7999.9 Ų99.930%0.29851%0.513SS..Hα-helixtrans-62.4-36.6177.5-158.3-162.856.756-13.2112.6A106 E107 R114A106-R110 WeakPolarHBondContact O-CB 3.29Å; A106-R110 PolarHBondContact O-N 2.95Å; E107-R110 VanDerWaalsContact CD-NH2 3.26Å; E107-R110 WeakPolarHBondContact O-CB 3.46Å; E107-R110 PolarHBondContact O-N 2.9Å; E107-R110 IonicContact OE1-CZ 2.68Å; E107-R110 IonicContact OE1-NE 3.26Å; E107-R110 IonicContact OE1-NH2 2.82Å; E107-R110 PolarHBondContact OE1-NH2 3.22Å; E107-R110 IonicContact OE2-CZ 3.67Å; E107-R110 VanDerWaalsContact OE2-CZ 3.26Å; E107-R110 IonicContact OE2-NE 3.29Å; E107-R110 PolarHBondContact OE2-NE 3.09Å; E107-R110 IonicContact OE2-NH2 3.41Å; E107-R110 PolarHBondContact OE2-NH2 3.28Å; E107-R110 VanDerWaalsContact OE2-NH2 3.17Å; R110-R114 VanDerWaalsContact NH1-NE 3.12Å; R110-R114 PolarHBondContact O-N 3.22Å; R110-R114 VanDerWaalsContact O-N 3.14Å
111L88.6Confident89.3Confident88 Ų88101 Ų10146%0.46151%0.512SS..Hα-helixtrans-73.1-41.2175.9-71.7171.6000112.2E107 C108 C109 Q113 R114 K115E107-L111 HydrophobicContact CG-CD1 4.17Å; E107-L111 WeakPolarHBondContact O-CB 3.43Å; E107-L111 WeakPolarHBondContact O-CG 3.46Å; E107-L111 PolarHBondContact O-N 2.91Å; C108-L111 PolarHBondContact O-N 2.92Å; C109-L111 VanDerWaalsContact C-N 3.32Å; C109-L111 PolarHBondContact O-N 2.97Å; L111-Q113 VanDerWaalsContact C-N 3.29Å; L111-Q113 PolarHBondContact O-N 3.4Å; L111-R114 PolarHBondContact O-N 3.39Å; L111-K115 PolarHBondContact O-N 3.08Å
112K90.8Very high89.3Confident150 Ų150100.8 Ų100.865%0.65251%0.508SS*.Hα-helixtrans-56.7-43.7171.8-76.9175.7178.7179.90111.6C108 C109 K115 M116C108-K112 WeakPolarHBondContact O-CG 3.49Å; C108-K112 PolarHBondContact O-N 3.26Å; C109-K112 PolarHBondContact O-N 3.37Å; K112-K115 PolarHBondContact O-N 2.91Å; K112-M116 PolarHBondContact O-N 3.27Å
113Q88.9Confident89.4Confident126 Ų12698.7 Ų98.759%0.58950%0.498SS*.Hα-helixtrans-64.3-44.6177-168.9176.37.200112.3C109 L111 K115 M116 T117C109-Q113 PolarHBondContact O-N 2.97Å; L111-Q113 VanDerWaalsContact C-N 3.29Å; L111-Q113 PolarHBondContact O-N 3.4Å; Q113-K115 VanDerWaalsContact C-N 3.31Å; Q113-K115 PolarHBondContact O-N 2.95Å; Q113-M116 PolarHBondContact O-N 3.38Å; Q113-T117 PolarHBondContact O-N 2.88Å; Q113-T117 VanDerWaalsContact O-N 3.1Å; Q113-T117 PolarHBondContact O-OG1 3.28Å
114R90.8Very high89.3Confident157 Ų15796.7 Ų96.759%0.59249%0.493SS*.Hα-helixtrans-61.3-37.1174.8-78.2-163.9-174.8158.55.6112.9R110 L111 T117 A118R110-R114 VanDerWaalsContact NH1-NE 3.12Å; R110-R114 PolarHBondContact O-N 3.22Å; R110-R114 VanDerWaalsContact O-N 3.14Å; L111-R114 PolarHBondContact O-N 3.39Å; R114-T117 WeakPolarHBondContact CA-OG1 3.45Å; R114-T117 PolarHBondContact O-N 3.43Å; R114-T117 PolarHBondContact O-OG1 3.23Å; R114-A118 PolarHBondContact O-N 2.85Å; R114-A118 VanDerWaalsContact O-N 3.08Å
115K89.8Confident89.5Confident134 Ų13495.7 Ų95.758%0.58349%0.486SS*.Hα-helixtrans-62.4-51.1174.2-174.7178.7174.9-178.60110.9L111 K112 Q113 T117 A118 D119L111-K115 PolarHBondContact O-N 3.08Å; K112-K115 PolarHBondContact O-N 2.91Å; Q113-K115 VanDerWaalsContact C-N 3.31Å; Q113-K115 PolarHBondContact O-N 2.95Å; K115-T117 PolarHBondContact O-N 2.87Å; K115-T117 VanDerWaalsContact O-N 3.15Å; K115-A118 WeakPolarHBondContact O-CB 3.39Å; K115-A118 PolarHBondContact O-N 3.02Å; K115-D119 WeakPolarHBondContact CE-OD2 3.47Å; K115-D119 VanDerWaalsContact O-CG 3.24Å; K115-D119 PolarHBondContact O-N 2.98Å
116M85.6Confident89.8Confident114 Ų11499.2 Ų99.256%0.56249%0.49SS*.Hα-helixtrans-58.8-29.1177.9-69-167.2-60.100113.8K112 Q113 K120K112-M116 PolarHBondContact O-N 3.27Å; Q113-M116 PolarHBondContact O-N 3.38Å; M116-K120 VanDerWaalsContact O-CG 3.27Å; M116-K120 WeakPolarHBondContact O-CG 3.47Å; M116-K120 PolarHBondContact O-N 3.27Å
117T88.7Confident89.8Confident85 Ų85100.6 Ų100.652%0.52149%0.488SS..Hα-helixtrans-75.5-35.6172.8490000113Q113 R114 K115 E121Q113-T117 PolarHBondContact O-N 2.88Å; Q113-T117 VanDerWaalsContact O-N 3.1Å; Q113-T117 PolarHBondContact O-OG1 3.28Å; R114-T117 WeakPolarHBondContact CA-OG1 3.45Å; R114-T117 PolarHBondContact O-N 3.43Å; R114-T117 PolarHBondContact O-OG1 3.23Å; K115-T117 PolarHBondContact O-N 2.87Å; K115-T117 VanDerWaalsContact O-N 3.15Å; T117-E121 PolarHBondContact O-N 2.92Å; T117-E121 VanDerWaalsContact O-N 3.14Å
118A89.1Confident90Very high57 Ų57102.2 Ų102.247%0.47149%0.491SS..Hα-helixtrans-68.1-47.4175.800000111.4R114 K115 K120 E121 E122R114-A118 PolarHBondContact O-N 2.85Å; R114-A118 VanDerWaalsContact O-N 3.08Å; K115-A118 WeakPolarHBondContact O-CB 3.39Å; K115-A118 PolarHBondContact O-N 3.02Å; A118-K120 PolarHBondContact O-N 3.45Å; A118-E121 PolarHBondContact O-N 2.89Å; A118-E121 VanDerWaalsContact O-N 3.08Å; A118-E122 PolarHBondContact O-N 2.65Å
119D87.7Confident90.3Very high78 Ų78103.8 Ų103.842%0.41750%0.495SS..Hα-helixtrans-56.5-36.1177.1-58.7-13000111.1K115 E123K115-D119 WeakPolarHBondContact CE-OD2 3.47Å; K115-D119 VanDerWaalsContact O-CG 3.24Å; K115-D119 PolarHBondContact O-N 2.98Å; D119-E123 PolarHBondContact O-N 3.24Å
120K90.6Very high90.4Very high148 Ų148103.8 Ų103.864%0.64349%0.489SS*.Hα-helixtrans-72.3-37.5175.5-77.4179.1-179.1-171.10114.2M116 A118 E123 L124M116-K120 VanDerWaalsContact O-CG 3.27Å; M116-K120 WeakPolarHBondContact O-CG 3.47Å; M116-K120 PolarHBondContact O-N 3.27Å; A118-K120 PolarHBondContact O-N 3.45Å; K120-E123 PolarHBondContact O-N 2.87Å; K120-L124 WeakPolarHBondContact O-CG 3.32Å; K120-L124 PolarHBondContact O-N 3.49Å
121E89.7Confident90.6Very high89 Ų89104.7 Ų104.742%0.41650%0.5SS..Hα-helixtrans-72-34.5177.4-169.761.3-148.800111.2T117 A118 E123 L124 Q125 R128T117-E121 PolarHBondContact O-N 2.92Å; T117-E121 VanDerWaalsContact O-N 3.14Å; A118-E121 PolarHBondContact O-N 2.89Å; A118-E121 VanDerWaalsContact O-N 3.08Å; E121-E123 VanDerWaalsContact C-N 3.33Å; E121-E123 PolarHBondContact O-N 3.44Å; E121-L124 PolarHBondContact O-N 3.31Å; E121-Q125 WeakPolarHBondContact O-CB 3.28Å; E121-Q125 PolarHBondContact O-N 2.9Å; E121-R128 IonicContact OE1-CZ 2.77Å; E121-R128 VanDerWaalsContact OE1-CZ 3.29Å; E121-R128 IonicContact OE1-NH1 3.45Å; E121-R128 PolarHBondContact OE1-NH1 2.77Å; E121-R128 IonicContact OE1-NH2 2.75Å; E121-R128 PolarHBondContact OE1-NH2 3.13Å
122E90Very high90.9Very high103 Ų103104.1 Ų104.148%0.48150%0.5SS..Hα-helixtrans-60.2-43.3172.2-164.3-170.2130.200111.3A118 Q125 R126A118-E122 PolarHBondContact O-N 2.65Å; E122-Q125 PolarHBondContact O-N 2.77Å; E122-R126 PolarHBondContact O-N 3.04Å; E122-R126 IonicContact OE1-CZ 3.73Å; E122-R126 IonicContact OE1-NH1 3Å; E122-R126 PolarHBondContact OE1-NH1 3.33Å; E122-R126 IonicContact OE1-NH2 3.74Å; E122-R126 PolarHBondContact OE1-NH2 2.98Å
123E89.2Confident90.9Very high91 Ų91102.1 Ų102.143%0.42549%0.493SS..Hα-helixtrans-69.2-40.6176.7-170.755.4-154.200112.7D119 K120 E121 Q125 R126 L127D119-E123 PolarHBondContact O-N 3.24Å; K120-E123 PolarHBondContact O-N 2.87Å; E121-E123 VanDerWaalsContact C-N 3.33Å; E121-E123 PolarHBondContact O-N 3.44Å; E123-Q125 PolarHBondContact O-N 3.34Å; E123-R126 WeakPolarHBondContact O-CB 3.25Å; E123-R126 PolarHBondContact O-N 2.89Å; E123-R126 IonicContact OE2-NH1 3.17Å; E123-L127 WeakPolarHBondContact O-CG 3.42Å; E123-L127 PolarHBondContact O-N 3.38Å
124L90.7Very high91Very high82 Ų82103 Ų10343%0.42949%0.492SS..Hα-helixtrans-58-37.9170.3-77.1170.2000111.6K120 E121 L127 R128K120-L124 WeakPolarHBondContact O-CG 3.32Å; K120-L124 PolarHBondContact O-N 3.49Å; E121-L124 PolarHBondContact O-N 3.31Å; L124-L127 PolarHBondContact O-N 3Å; L124-R128 VanDerWaalsContact O-CG 3.29Å; L124-R128 WeakPolarHBondContact O-CG 3.34Å; L124-R128 PolarHBondContact O-N 3.43Å
125Q92.7Very high91Very high82 Ų8298.9 Ų98.938%0.38349%0.486SS..Hα-helixtrans-70.9-36.5176.9-166.260.824.500112.6E121 E122 E123 R128 N129E121-Q125 WeakPolarHBondContact O-CB 3.28Å; E121-Q125 PolarHBondContact O-N 2.9Å; E122-Q125 PolarHBondContact O-N 2.77Å; E123-Q125 PolarHBondContact O-N 3.34Å; Q125-R128 PolarHBondContact O-N 3.01Å; Q125-N129 WeakPolarHBondContact O-CB 3.4Å; Q125-N129 VanDerWaalsContact O-CG 3.24Å; Q125-N129 PolarHBondContact O-N 2.67Å; Q125-N129 PolarHBondContact O-ND2 2.94Å
126R92.3Very high91.2Very high134 Ų13498.6 Ų98.651%0.50649%0.485SS..Hα-helixtrans-58.1-47.9168.6-74.7-167.3177.981.713.2111.5E122 E123 R128 N129 L130E122-R126 PolarHBondContact O-N 3.04Å; E122-R126 IonicContact OE1-CZ 3.73Å; E122-R126 IonicContact OE1-NH1 3Å; E122-R126 PolarHBondContact OE1-NH1 3.33Å; E122-R126 IonicContact OE1-NH2 3.74Å; E122-R126 PolarHBondContact OE1-NH2 2.98Å; E123-R126 WeakPolarHBondContact O-CB 3.25Å; E123-R126 PolarHBondContact O-N 2.89Å; E123-R126 IonicContact OE2-NH1 3.17Å; R126-R128 PolarHBondContact O-N 2.93Å; R126-N129 PolarHBondContact O-N 3.02Å; R126-L130 WeakPolarHBondContact O-CB 3.49Å; R126-L130 PolarHBondContact O-N 3.03Å
127L92.9Very high91.5Very high93 Ų9396.3 Ų96.349%0.48748%0.478SS..Hα-helixtrans-64-39.9179.3-68.8172.1000112.6E123 L124 L130 N131E123-L127 WeakPolarHBondContact O-CG 3.42Å; E123-L127 PolarHBondContact O-N 3.38Å; L124-L127 PolarHBondContact O-N 3Å; L127-L130 PolarHBondContact O-N 3.39Å; L127-N131 WeakPolarHBondContact O-CB 3.46Å; L127-N131 PolarHBondContact O-N 3.32Å
128R94.3Very high91.6Very high114 Ų11496.8 Ų96.843%0.4348%0.476SS..Hα-helixtrans-60.2-46.8172.3-72.7170.4-167.71435.4111.4E121 L124 Q125 R126 L130 N131 V132E121-R128 IonicContact OE1-CZ 2.77Å; E121-R128 VanDerWaalsContact OE1-CZ 3.29Å; E121-R128 IonicContact OE1-NH1 3.45Å; E121-R128 PolarHBondContact OE1-NH1 2.77Å; E121-R128 IonicContact OE1-NH2 2.75Å; E121-R128 PolarHBondContact OE1-NH2 3.13Å; L124-R128 VanDerWaalsContact O-CG 3.29Å; L124-R128 WeakPolarHBondContact O-CG 3.34Å; L124-R128 PolarHBondContact O-N 3.43Å; Q125-R128 PolarHBondContact O-N 3.01Å; R126-R128 PolarHBondContact O-N 2.93Å; R128-L130 PolarHBondContact O-N 3.34Å; R128-N131 PolarHBondContact O-N 2.96Å; R128-V132 WeakPolarHBondContact O-CG2 3.5Å; R128-V132 PolarHBondContact O-N 3.01Å
129N93.5Very high91.7Very high93 Ų9396.7 Ų96.750%0.49748%0.476SS..Hα-helixtrans-63-42178.2-71-13.7000112Q125 R126 V132 Q133Q125-N129 WeakPolarHBondContact O-CB 3.4Å; Q125-N129 VanDerWaalsContact O-CG 3.24Å; Q125-N129 PolarHBondContact O-N 2.67Å; Q125-N129 PolarHBondContact O-ND2 2.94Å; R126-N129 PolarHBondContact O-N 3.02Å; N129-V132 PolarHBondContact O-N 3.48Å; N129-Q133 PolarHBondContact O-N 2.98Å
130L93.6Very high91.9Very high82 Ų8296 Ų9643%0.42948%0.481SS..Hα-helixtrans-63.9-40.9176.6-177.862.2000111.9R126 L127 R128 Q133 Y134R126-L130 WeakPolarHBondContact O-CB 3.49Å; R126-L130 PolarHBondContact O-N 3.03Å; L127-L130 PolarHBondContact O-N 3.39Å; R128-L130 PolarHBondContact O-N 3.34Å; L130-Q133 PolarHBondContact O-N 3.41Å; L130-Y134 HydrophobicContact CD1-CD2 4.36Å; L130-Y134 HydrophobicContact CD1-CE2 3.84Å; L130-Y134 HydrophobicContact CD2-CE2 3.97Å; L130-Y134 HydrophobicContact CG-CD2 4.02Å; L130-Y134 HydrophobicContact CG-CE2 3.57Å; L130-Y134 WeakPolarHBondContact O-CD2 3.44Å; L130-Y134 PolarHBondContact O-N 3.3Å
131N93.1Very high91.8Very high99 Ų9995.7 Ų95.753%0.52948%0.476SS..Hα-helixtrans-61.7-42.9174.4-169.1-21.5000111.5L127 R128 Q133 Y134 C135L127-N131 WeakPolarHBondContact O-CB 3.46Å; L127-N131 PolarHBondContact O-N 3.32Å; R128-N131 PolarHBondContact O-N 2.96Å; N131-Q133 VanDerWaalsContact C-N 3.31Å; N131-Q133 PolarHBondContact O-N 3.46Å; N131-Y134 PolarHBondContact O-N 3.23Å; N131-C135 WeakPolarHBondContact O-CB 3.38Å; N131-C135 PolarHBondContact O-N 2.88Å; N131-C135 PolarHBondContact O-SG 3.41Å; N131-C135 PolarHBondContact OD1-SG 3.04Å; N131-C135 VanDerWaalsContact OD1-SG 3.39Å
132V94.4Very high91.9Very high76 Ų7697.7 Ų97.746%0.46148%0.484SS..Hα-helixtrans-59.8-39.1173.4170.90000111.9R128 N129 C135 K136R128-V132 WeakPolarHBondContact O-CG2 3.5Å; R128-V132 PolarHBondContact O-N 3.01Å; N129-V132 PolarHBondContact O-N 3.48Å; V132-C135 PolarHBondContact O-N 2.86Å; V132-K136 WeakPolarHBondContact O-CG 3.39Å; V132-K136 PolarHBondContact O-N 2.96Å
133Q91.4Very high91.8Very high107 Ų10797.6 Ų97.650%0.548%0.483SS..Hα-helixtrans-65.4-47.3174.6-65.9-70.129.400111.8N129 L130 N131 C135 K136 T137N129-Q133 PolarHBondContact O-N 2.98Å; L130-Q133 PolarHBondContact O-N 3.41Å; N131-Q133 VanDerWaalsContact C-N 3.31Å; N131-Q133 PolarHBondContact O-N 3.46Å; Q133-C135 VanDerWaalsContact C-N 3.29Å; Q133-C135 PolarHBondContact O-N 3.31Å; Q133-K136 WeakPolarHBondContact O-CB 3.32Å; Q133-K136 PolarHBondContact O-N 3.07Å; Q133-K136 VanDerWaalsContact O-N 3.09Å; Q133-T137 PolarHBondContact O-N 3.32Å; Q133-T137 PolarHBondContact O-OG1 3.48Å; Q133-T137 VanDerWaalsContact O-OG1 3.14Å
134Y90.5Very high91.8Very high144 Ų14497.4 Ų97.457%0.56549%0.485SS*.Hα-helixtrans-57.8-41174.6-73.3-51.1000112.3L130 N131 K136 T137 I138L130-Y134 HydrophobicContact CD1-CD2 4.36Å; L130-Y134 HydrophobicContact CD1-CE2 3.84Å; L130-Y134 HydrophobicContact CD2-CE2 3.97Å; L130-Y134 HydrophobicContact CG-CD2 4.02Å; L130-Y134 HydrophobicContact CG-CE2 3.57Å; L130-Y134 WeakPolarHBondContact O-CD2 3.44Å; L130-Y134 PolarHBondContact O-N 3.3Å; N131-Y134 PolarHBondContact O-N 3.23Å; Y134-K136 PolarHBondContact O-N 2.88Å; Y134-T137 PolarHBondContact O-N 2.86Å; Y134-I138 WeakPolarHBondContact O-CB 3.37Å; Y134-I138 WeakPolarHBondContact O-CD1 3.38Å; Y134-I138 WeakPolarHBondContact O-CG1 3.38Å; Y134-I138 PolarHBondContact O-N 2.93Å
135C92.4Very high91.7Very high71 Ų7197.1 Ų97.148%0.4849%0.486SS..Hα-helixtrans-59.5-43.6174.6-69.20000112.3N131 V132 Q133 I138 A139N131-C135 WeakPolarHBondContact O-CB 3.38Å; N131-C135 PolarHBondContact O-N 2.88Å; N131-C135 PolarHBondContact O-SG 3.41Å; N131-C135 PolarHBondContact OD1-SG 3.04Å; N131-C135 VanDerWaalsContact OD1-SG 3.39Å; V132-C135 PolarHBondContact O-N 2.86Å; Q133-C135 VanDerWaalsContact C-N 3.29Å; Q133-C135 PolarHBondContact O-N 3.31Å; C135-I138 PolarHBondContact O-N 3.14Å; C135-A139 WeakPolarHBondContact O-CB 3.42Å; C135-A139 PolarHBondContact O-N 3.22Å
136K93.4Very high91.4Very high128 Ų12894 Ų9456%0.55747%0.474SS*.Hα-helixtrans-64-44.9175-71.9174.3-179.4-179.70112.1V132 Q133 Y134 I138 A139 A140V132-K136 WeakPolarHBondContact O-CG 3.39Å; V132-K136 PolarHBondContact O-N 2.96Å; Q133-K136 WeakPolarHBondContact O-CB 3.32Å; Q133-K136 PolarHBondContact O-N 3.07Å; Q133-K136 VanDerWaalsContact O-N 3.09Å; Y134-K136 PolarHBondContact O-N 2.88Å; K136-I138 PolarHBondContact O-N 2.88Å; K136-A139 PolarHBondContact O-N 3.29Å; K136-A140 PolarHBondContact O-N 3.2Å
137T91.5Very high91.1Very high66 Ų6690.1 Ų90.141%0.40546%0.463SS..Hα-helixtrans-62.2-42.6177.6-58.20000111.5Q133 Y134 A140 Y141Q133-T137 PolarHBondContact O-N 3.32Å; Q133-T137 PolarHBondContact O-OG1 3.48Å; Q133-T137 VanDerWaalsContact O-OG1 3.14Å; Y134-T137 PolarHBondContact O-N 2.86Å; T137-A140 PolarHBondContact O-N 3.21Å; T137-Y141 HydrophobicContact CG2-CD2 3.78Å; T137-Y141 HydrophobicContact CG2-CE2 3.54Å; T137-Y141 VanDerWaalsContact O-CD2 3.23Å; T137-Y141 WeakPolarHBondContact O-CD2 3.37Å; T137-Y141 PolarHBondContact O-N 3.41Å
138I90.7Very high90.8Very high95 Ų9591.8 Ų91.849%0.48747%0.466SS..Hα-helixtrans-63-41.3174.9-69.5163.8000111Y134 C135 K136 Y141 K142Y134-I138 WeakPolarHBondContact O-CB 3.37Å; Y134-I138 WeakPolarHBondContact O-CD1 3.38Å; Y134-I138 WeakPolarHBondContact O-CG1 3.38Å; Y134-I138 PolarHBondContact O-N 2.93Å; C135-I138 PolarHBondContact O-N 3.14Å; K136-I138 PolarHBondContact O-N 2.88Å; I138-Y141 PolarHBondContact O-N 2.9Å; I138-K142 HydrophobicContact CG2-CD 4.43Å; I138-K142 WeakPolarHBondContact O-CG 3.49Å; I138-K142 PolarHBondContact O-N 3.24Å
139A91.5Very high90.5Very high56 Ų5691.3 Ų91.346%0.46347%0.469SS..Hα-helixtrans-63.1-43.3175.700000112.1C135 K136 K142 Q143C135-A139 WeakPolarHBondContact O-CB 3.42Å; C135-A139 PolarHBondContact O-N 3.22Å; K136-A139 PolarHBondContact O-N 3.29Å; A139-K142 PolarHBondContact O-N 3.38Å; A139-Q143 PolarHBondContact O-N 2.98Å
140A91.1Very high90.1Very high63 Ų6392.1 Ų92.152%0.52147%0.465SS..Hα-helixtrans-62.9-42.1175.600000112.4K136 T137 Q143 L144K136-A140 PolarHBondContact O-N 3.2Å; T137-A140 PolarHBondContact O-N 3.21Å; A140-Q143 PolarHBondContact O-N 3.37Å; A140-L144 WeakPolarHBondContact O-CB 3.46Å; A140-L144 PolarHBondContact O-N 3.26Å
141Y89.8Confident89.7Confident141 Ų14195.2 Ų95.255%0.55348%0.475SS*.Hα-helixtrans-63.1-41.1174-82.6-59.3000112.5T137 I138 L144 V145T137-Y141 HydrophobicContact CG2-CD2 3.78Å; T137-Y141 HydrophobicContact CG2-CE2 3.54Å; T137-Y141 VanDerWaalsContact O-CD2 3.23Å; T137-Y141 WeakPolarHBondContact O-CD2 3.37Å; T137-Y141 PolarHBondContact O-N 3.41Å; I138-Y141 PolarHBondContact O-N 2.9Å; Y141-L144 PolarHBondContact O-N 3.02Å; Y141-V145 WeakPolarHBondContact O-CG2 3.4Å; Y141-V145 PolarHBondContact O-N 2.77Å
142K91.2Very high89.4Confident131 Ų13194.5 Ų94.557%0.5747%0.474SS*.Hα-helixtrans-60.6-46.4174.7-76.3179.8175.4-172.40111.7I138 A139 L144 V145 S146I138-K142 HydrophobicContact CG2-CD 4.43Å; I138-K142 WeakPolarHBondContact O-CG 3.49Å; I138-K142 PolarHBondContact O-N 3.24Å; A139-K142 PolarHBondContact O-N 3.38Å; K142-L144 PolarHBondContact O-N 2.99Å; K142-V145 PolarHBondContact O-N 2.91Å; K142-S146 PolarHBondContact O-N 3.24Å; K142-S146 PolarHBondContact O-OG 3.46Å
143Q88.4Confident88.9Confident101 Ų10194.7 Ų94.747%0.47247%0.47SS..Hα-helixtrans-59.6-46.1176.4-174.762.134.900111.6A139 A140 V145 S146 D147A139-Q143 PolarHBondContact O-N 2.98Å; A140-Q143 PolarHBondContact O-N 3.37Å; Q143-V145 VanDerWaalsContact C-N 3.3Å; Q143-V145 PolarHBondContact O-N 3.46Å; Q143-S146 PolarHBondContact O-N 3.35Å; Q143-D147 PolarHBondContact NE2-OD1 2.96Å; Q143-D147 PolarHBondContact NE2-OD2 3.38Å; Q143-D147 WeakPolarHBondContact O-CB 3.39Å; Q143-D147 VanDerWaalsContact O-CG 3.29Å; Q143-D147 PolarHBondContact O-N 3.24Å
144L88.2Confident88.6Confident87 Ų8793 Ų9346%0.45547%0.467SS..Hα-helixtrans-60.8-36.7177.5-175.869.4000112.7A140 Y141 K142 K148A140-L144 WeakPolarHBondContact O-CB 3.46Å; A140-L144 PolarHBondContact O-N 3.26Å; Y141-L144 PolarHBondContact O-N 3.02Å; K142-L144 PolarHBondContact O-N 2.99Å; L144-K148 WeakPolarHBondContact O-CG 2.92Å; L144-K148 PolarHBondContact O-N 3.33Å; L144-K148 VanDerWaalsContact O-N 3.17Å
145V88.9Confident88.3Confident76 Ų7691.2 Ų91.246%0.46147%0.467SS..Hα-helixtrans-66.9-51173.9169.80000110.2Y141 K142 Q143 D147 K148 E149Y141-V145 WeakPolarHBondContact O-CG2 3.4Å; Y141-V145 PolarHBondContact O-N 2.77Å; K142-V145 PolarHBondContact O-N 2.91Å; Q143-V145 VanDerWaalsContact C-N 3.3Å; Q143-V145 PolarHBondContact O-N 3.46Å; V145-D147 VanDerWaalsContact C-N 3.31Å; V145-D147 PolarHBondContact O-N 3.44Å; V145-K148 CarbonylContact O-C 3.59Å; V145-K148 WeakPolarHBondContact O-CA 3.43Å; V145-K148 WeakPolarHBondContact O-CB 3.27Å; V145-K148 PolarHBondContact O-N 2.91Å; V145-E149 HydrophobicContact CG1-CG 4.34Å; V145-E149 WeakPolarHBondContact O-CG 3.3Å; V145-E149 PolarHBondContact O-N 2.91Å
146S86.9Confident88Confident18 Ų1892.2 Ų92.213%0.12647%0.466CS..Hα-helixtrans-64.7-31.3180-61.40000113.7K142 Q143 E149 R150K142-S146 PolarHBondContact O-N 3.24Å; K142-S146 PolarHBondContact O-OG 3.46Å; Q143-S146 PolarHBondContact O-N 3.35Å; S146-E149 WeakPolarHBondContact CA-OE2 3.47Å; S146-E149 PolarHBondContact O-N 3.43Å; S146-R150 PolarHBondContact O-N 2.98Å
147D85.3Confident87.5Confident51 Ų5192.2 Ų92.227%0.27346%0.463SS..Hα-helixtrans-68.8-35171.6-70.6-25.7000112.1Q143 V145 R150 K151Q143-D147 PolarHBondContact NE2-OD1 2.96Å; Q143-D147 PolarHBondContact NE2-OD2 3.38Å; Q143-D147 WeakPolarHBondContact O-CB 3.39Å; Q143-D147 VanDerWaalsContact O-CG 3.29Å; Q143-D147 PolarHBondContact O-N 3.24Å; V145-D147 VanDerWaalsContact C-N 3.31Å; V145-D147 PolarHBondContact O-N 3.44Å; D147-R150 IonicContact OD1-CZ 2.74Å; D147-R150 IonicContact OD1-NH1 3.91Å; D147-R150 PolarHBondContact OD1-NH1 3.28Å; D147-R150 IonicContact OD1-NH2 2.9Å; D147-R150 PolarHBondContact OD1-NH2 2.91Å; D147-K151 VanDerWaalsContact O-CG 3.29Å; D147-K151 WeakPolarHBondContact O-CG 3.4Å; D147-K151 PolarHBondContact O-N 3.34Å; D147-K151 VanDerWaalsContact O-N 3.13Å
148K87.1Confident87Confident128 Ų12892.7 Ų92.756%0.55747%0.466SS*.Hα-helixtrans-69.5-41171.5-75.6175.6178.1-177.30111.7L144 V145 K151 V152L144-K148 WeakPolarHBondContact O-CG 2.92Å; L144-K148 PolarHBondContact O-N 3.33Å; L144-K148 VanDerWaalsContact O-N 3.17Å; V145-K148 CarbonylContact O-C 3.59Å; V145-K148 WeakPolarHBondContact O-CA 3.43Å; V145-K148 WeakPolarHBondContact O-CB 3.27Å; V145-K148 PolarHBondContact O-N 2.91Å; K148-K151 WeakPolarHBondContact O-CB 3.45Å; K148-K151 PolarHBondContact O-N 3.4Å; K148-V152 WeakPolarHBondContact O-CG2 3.36Å; K148-V152 PolarHBondContact O-N 2.92Å
149E88Confident86.4Confident104 Ų10491.7 Ų91.749%0.48646%0.461SS..Hα-helixtrans-62.1-47175.8-70.2172.914300111.5V145 S146 K151 V152 E153V145-E149 HydrophobicContact CG1-CG 4.34Å; V145-E149 WeakPolarHBondContact O-CG 3.3Å; V145-E149 PolarHBondContact O-N 2.91Å; S146-E149 WeakPolarHBondContact CA-OE2 3.47Å; S146-E149 PolarHBondContact O-N 3.43Å; E149-K151 VanDerWaalsContact C-N 3.31Å; E149-K151 PolarHBondContact O-N 3.49Å; E149-V152 PolarHBondContact O-N 3.25Å; E149-V152 VanDerWaalsContact O-N 3.15Å; E149-E153 PolarHBondContact O-N 3.06Å
150R85.3Confident85.8Confident110 Ų11093.2 Ų93.242%0.41546%0.461SS..Hα-helixtrans-57.9-41.2172.8-95.6-174.9-86.297.97.4112.3S146 D147 E153 V154S146-R150 PolarHBondContact O-N 2.98Å; D147-R150 IonicContact OD1-CZ 2.74Å; D147-R150 IonicContact OD1-NH1 3.91Å; D147-R150 PolarHBondContact OD1-NH1 3.28Å; D147-R150 IonicContact OD1-NH2 2.9Å; D147-R150 PolarHBondContact OD1-NH2 2.91Å; R150-E153 PolarHBondContact O-N 3.14Å; R150-V154 WeakPolarHBondContact O-CG2 3.48Å; R150-V154 PolarHBondContact O-N 3.3Å
151K85.2Confident85.1Confident147 Ų14799.1 Ų99.164%0.63947%0.47SS*.Hα-helixtrans-62.8-43.9174.5-75.8173-179.6-1770112.2D147 K148 E149 E153 V154 L155D147-K151 VanDerWaalsContact O-CG 3.29Å; D147-K151 WeakPolarHBondContact O-CG 3.4Å; D147-K151 PolarHBondContact O-N 3.34Å; D147-K151 VanDerWaalsContact O-N 3.13Å; K148-K151 WeakPolarHBondContact O-CB 3.45Å; K148-K151 PolarHBondContact O-N 3.4Å; E149-K151 VanDerWaalsContact C-N 3.31Å; E149-K151 PolarHBondContact O-N 3.49Å; K151-E153 VanDerWaalsContact C-N 3.35Å; K151-E153 PolarHBondContact O-N 2.83Å; K151-V154 PolarHBondContact O-N 3.25Å; K151-L155 WeakPolarHBondContact O-CB 3.27Å; K151-L155 VanDerWaalsContact O-CG 3.28Å; K151-L155 WeakPolarHBondContact O-CG 3.44Å; K151-L155 PolarHBondContact O-N 3.42Å
152V85.9Confident84.1Confident84 Ų8493.3 Ų93.351%0.50945%0.449SS..Hα-helixtrans-61.3-42.7175.4169.70000111.1K148 E149 L155 L156K148-V152 WeakPolarHBondContact O-CG2 3.36Å; K148-V152 PolarHBondContact O-N 2.92Å; E149-V152 PolarHBondContact O-N 3.25Å; E149-V152 VanDerWaalsContact O-N 3.15Å; V152-L155 WeakPolarHBondContact O-CB 3.48Å; V152-L155 PolarHBondContact O-N 3.39Å; V152-L156 HydrophobicContact CG1-CD1 4.05Å; V152-L156 HydrophobicContact CG1-CG 4.47Å; V152-L156 WeakPolarHBondContact O-CG 3.34Å; V152-L156 PolarHBondContact O-N 3.05Å
153E85Confident83Confident80 Ų8096 Ų9637%0.37446%0.456SS..Hα-helixtrans-70.2-36.5179.5-167-177.7-127.100113.3E149 R150 K151 L156 R157E149-E153 PolarHBondContact O-N 3.06Å; R150-E153 PolarHBondContact O-N 3.14Å; K151-E153 VanDerWaalsContact C-N 3.35Å; K151-E153 PolarHBondContact O-N 2.83Å; E153-L156 PolarHBondContact O-N 3.26Å; E153-R157 PolarHBondContact O-N 3.1Å; E153-R157 IonicContact OE2-CZ 3.65Å; E153-R157 IonicContact OE2-NH2 3.6Å; E153-R157 PolarHBondContact OE2-NH2 3.25Å
154V84.6Confident81.7Confident73 Ų7399.7 Ų99.744%0.44247%0.47SS..Hα-helixtrans-61.8-45.2170.7169.20000110.5R150 K151 L156 R157 V158R150-V154 WeakPolarHBondContact O-CG2 3.48Å; R150-V154 PolarHBondContact O-N 3.3Å; K151-V154 PolarHBondContact O-N 3.25Å; V154-L156 PolarHBondContact O-N 2.89Å; V154-R157 PolarHBondContact O-N 2.97Å; V154-V158 WeakPolarHBondContact O-CG2 3.29Å; V154-V158 PolarHBondContact O-N 3.1Å
155L84Confident79.8Confident106 Ų106100.2 Ų100.256%0.55547%0.473SS*.Hα-helixtrans-59.6-43.9174.7-72.3167000111.7K151 V152 R157 V158 I159K151-L155 WeakPolarHBondContact O-CB 3.27Å; K151-L155 VanDerWaalsContact O-CG 3.28Å; K151-L155 WeakPolarHBondContact O-CG 3.44Å; K151-L155 PolarHBondContact O-N 3.42Å; V152-L155 WeakPolarHBondContact O-CB 3.48Å; V152-L155 PolarHBondContact O-N 3.39Å; L155-R157 PolarHBondContact O-N 3.43Å; L155-V158 PolarHBondContact O-N 3.31Å; L155-I159 WeakPolarHBondContact O-CD1 3.47Å; L155-I159 VanDerWaalsContact O-CG1 3.27Å; L155-I159 WeakPolarHBondContact O-CG1 3.28Å; L155-I159 PolarHBondContact O-N 3.37Å
156L85.6Confident78Confident91 Ų91103.3 Ų103.348%0.47650%0.495SS..Hα-helixtrans-62.6-38.6175-72.2170.2000112.4V152 E153 V154 I159 N160V152-L156 HydrophobicContact CG1-CD1 4.05Å; V152-L156 HydrophobicContact CG1-CG 4.47Å; V152-L156 WeakPolarHBondContact O-CG 3.34Å; V152-L156 PolarHBondContact O-N 3.05Å; E153-L156 PolarHBondContact O-N 3.26Å; V154-L156 PolarHBondContact O-N 2.89Å; L156-I159 PolarHBondContact O-N 2.96Å; L156-N160 VanDerWaalsContact O-CB 3.31Å; L156-N160 WeakPolarHBondContact O-CB 3.36Å; L156-N160 VanDerWaalsContact O-CG 3.3Å; L156-N160 PolarHBondContact O-N 3.27Å; L156-N160 PolarHBondContact O-ND2 3Å
157R82.7Confident76.3Confident128 Ų128107.3 Ų107.348%0.48352%0.523SS..Hα-helixtrans-65-40.1173.6-87-178.5-91.9161.3-14.5112.4E153 V154 L155 N160 R161E153-R157 PolarHBondContact O-N 3.1Å; E153-R157 IonicContact OE2-CZ 3.65Å; E153-R157 IonicContact OE2-NH2 3.6Å; E153-R157 PolarHBondContact OE2-NH2 3.25Å; V154-R157 PolarHBondContact O-N 2.97Å; L155-R157 PolarHBondContact O-N 3.43Å; R157-N160 PolarHBondContact O-N 2.85Å; R157-R161 WeakPolarHBondContact O-CG 3.48Å; R157-R161 PolarHBondContact O-N 2.88Å
158V81Confident74.4Confident77 Ų77108.3 Ų108.347%0.46753%0.525SS..Hα-helixtrans-61.8-52.6173.5171.80000110.3V154 L155 N160 R161 T162V154-V158 WeakPolarHBondContact O-CG2 3.29Å; V154-V158 PolarHBondContact O-N 3.1Å; L155-V158 PolarHBondContact O-N 3.31Å; V158-N160 VanDerWaalsContact C-N 3.27Å; V158-N160 PolarHBondContact O-N 3.07Å; V158-R161 PolarHBondContact O-N 3.25Å; V158-R161 VanDerWaalsContact O-N 3.08Å; V158-T162 PolarHBondContact O-N 3.5Å; V158-T162 PolarHBondContact O-OG1 3.4Å
159I78.2Confident72.5Confident74 Ų74105.4 Ų105.438%0.37952%0.516SS..Hα-helixtrans-57.2-38.5178.2-68163.3000112.1L155 L156 T162 R163L155-I159 WeakPolarHBondContact O-CD1 3.47Å; L155-I159 VanDerWaalsContact O-CG1 3.27Å; L155-I159 WeakPolarHBondContact O-CG1 3.28Å; L155-I159 PolarHBondContact O-N 3.37Å; L156-I159 PolarHBondContact O-N 2.96Å; I159-T162 PolarHBondContact O-OG1 2.97Å; I159-T162 VanDerWaalsContact O-OG1 3.08Å; I159-R163 WeakPolarHBondContact O-CB 3.48Å; I159-R163 WeakPolarHBondContact O-CG 3.09Å; I159-R163 PolarHBondContact O-N 3.4Å; I159-R163 VanDerWaalsContact O-N 3.13Å
160N79.2Confident70.9Confident87 Ų87108 Ų10847%0.46552%0.521SS..Hα-helixtrans-74.4-29178.6-77.6-30.1000113.4L156 R157 V158 K164L156-N160 VanDerWaalsContact O-CB 3.31Å; L156-N160 WeakPolarHBondContact O-CB 3.36Å; L156-N160 VanDerWaalsContact O-CG 3.3Å; L156-N160 PolarHBondContact O-N 3.27Å; L156-N160 PolarHBondContact O-ND2 3Å; R157-N160 PolarHBondContact O-N 2.85Å; V158-N160 VanDerWaalsContact C-N 3.27Å; V158-N160 PolarHBondContact O-N 3.07Å; N160-K164 WeakPolarHBondContact O-CG 3.48Å; N160-K164 PolarHBondContact O-N 3.43Å
161R75.9Confident69.4Low187 Ų187110.7 Ų110.771%0.70654%0.538SS*.Hα-helixtrans-71.4-45.8172.8-76.9176.2176.6174.6-1.6111.3R157 V158 R163 K164 N165R157-R161 WeakPolarHBondContact O-CG 3.48Å; R157-R161 PolarHBondContact O-N 2.88Å; V158-R161 PolarHBondContact O-N 3.25Å; V158-R161 VanDerWaalsContact O-N 3.08Å; R161-R163 VanDerWaalsContact C-N 3.26Å; R161-R163 PolarHBondContact O-N 3.06Å; R161-K164 PolarHBondContact O-N 3.38Å; R161-N165 PolarHBondContact O-N 3.49Å
162T69Low67.8Low19 Ų19110.3 Ų110.312%0.11754%0.539CS..Hα-helixtrans-66.5-27.2178.857.70000112.7V158 I159 F168 W170V158-T162 PolarHBondContact O-N 3.5Å; V158-T162 PolarHBondContact O-OG1 3.4Å; I159-T162 PolarHBondContact O-OG1 2.97Å; I159-T162 VanDerWaalsContact O-OG1 3.08Å; T162-F168 HydrophobicContact CG2-CD1 4.03Å; T162-F168 HydrophobicContact CG2-CD2 4.11Å; T162-F168 HydrophobicContact CG2-CE1 3.55Å; T162-F168 HydrophobicContact CG2-CE2 3.66Å; T162-F168 HydrophobicContact CG2-CG 4.29Å; T162-F168 HydrophobicContact CG2-CZ 3.36Å; T162-W170 VanDerWaalsContact CB-CZ2 3.5Å; T162-W170 WeakPolarHBondContact OG1-CH2 3.37Å; T162-W170 VanDerWaalsContact OG1-CZ2 3.25Å; T162-W170 WeakPolarHBondContact OG1-CZ2 3.48Å
163R68.5Low65.9Low189 Ų189114.8 Ų114.871%0.71355%0.552SS**THydrogen-bonded Turntrans-74.5-20.9169.6-79.6-179.1170.1-176.2-2.7115.5I159 R161I159-R163 WeakPolarHBondContact O-CB 3.48Å; I159-R163 WeakPolarHBondContact O-CG 3.09Å; I159-R163 PolarHBondContact O-N 3.4Å; I159-R163 VanDerWaalsContact O-N 3.13Å; R161-R163 VanDerWaalsContact C-N 3.26Å; R161-R163 PolarHBondContact O-N 3.06Å
164K61.8Low64.2Low178 Ų178117.1 Ų117.177%0.77457%0.567SS**THydrogen-bonded Turntrans-100.9-9.1-174.1-80.5-171.4176.1-173.60115.1N160 R161 P166N160-K164 WeakPolarHBondContact O-CG 3.48Å; N160-K164 PolarHBondContact O-N 3.43Å; R161-K164 PolarHBondContact O-N 3.38Å; K164-P166 WeakPolarHBondContact O-CD 3.45Å
165N48.5Very low62.6Low98 Ų98123.6 Ų123.652%0.52459%0.585SS.*  trans-94.7113.1174.2-103.7-21000110.3R161 S167 F168R161-N165 PolarHBondContact O-N 3.49Å; N165-S167 PolarHBondContact O-N 2.82Å; N165-F168 HydrophobicContact CB-CB 3.9Å; N165-F168 WeakPolarHBondContact O-CB 3.12Å; N165-F168 PolarHBondContact O-N 3.23Å
166P51.1Low60.6Low140 Ų140127 Ų12791%0.90960%0.598SS**THydrogen-bonded Turntrans-66.8-14.1176.8-19.233.2000113.7K164K164-P166 WeakPolarHBondContact O-CD 3.45Å
167S49.9Very low58.6Low102 Ų102127.7 Ų127.771%0.71361%0.61SS**THydrogen-bonded Turntrans-98.59.9172.662.60000113.6N165 N169N165-S167 PolarHBondContact O-N 2.82Å; S167-N169 PolarHBondContact O-N 2.95Å
168F46.3Very low56.5Low72 Ų72127.7 Ų127.732%0.31662%0.624SS.*  trans-7496.9177.3-166-97000110.2T162 N165 W170T162-F168 HydrophobicContact CG2-CD1 4.03Å; T162-F168 HydrophobicContact CG2-CD2 4.11Å; T162-F168 HydrophobicContact CG2-CE1 3.55Å; T162-F168 HydrophobicContact CG2-CE2 3.66Å; T162-F168 HydrophobicContact CG2-CG 4.29Å; T162-F168 HydrophobicContact CG2-CZ 3.36Å; N165-F168 HydrophobicContact CB-CB 3.9Å; N165-F168 WeakPolarHBondContact O-CB 3.12Å; N165-F168 PolarHBondContact O-N 3.23Å; F168-W170 AromaticContact CD1-CD1 3.8Å; F168-W170 AromaticContact CD1-CD2 3.82Å; F168-W170 HydrophobicContact CD1-CD2 3.82Å; F168-W170 AromaticContact CD1-CE2 3.71Å; F168-W170 HydrophobicContact CD1-CE3 4.45Å; F168-W170 AromaticContact CD1-CG 3.91Å; F168-W170 HydrophobicContact CD1-CG 3.91Å; F168-W170 HydrophobicContact CD1-CZ2 4.3Å; F168-W170 AromaticContact CD1-NE1 3.66Å; F168-W170 AromaticContact CE1-CD2 3.81Å; F168-W170 HydrophobicContact CE1-CD2 3.81Å; F168-W170 AromaticContact CE1-CE3 3.99Å; F168-W170 HydrophobicContact CE1-CE3 3.99Å; F168-W170 HydrophobicContact CE1-CG 4.18Å; F168-W170 HydrophobicContact CE1-CZ2 4.43Å; F168-W170 HydrophobicContact CE1-CZ3 4.39Å; F168-W170 PolarHBondContact O-N 3.46Å
169N47.1Very low54.3Low68 Ų68129.2 Ų129.236%0.36464%0.638SS.*  trans-67.992.3173.6-174.37.6000109.8S167 Q171 E172S167-N169 PolarHBondContact O-N 2.95Å; N169-Q171 PolarHBondContact O-N 2.93Å; N169-Q171 WeakPolarHBondContact OD1-CA 3.48Å; N169-Q171 WeakPolarHBondContact OD1-CB 3.36Å; N169-Q171 PolarHBondContact OD1-N 3.18Å; N169-E172 HydrophobicContact CB-CB 4.47Å; N169-E172 WeakPolarHBondContact ND2-CG 3.47Å; N169-E172 PolarHBondContact ND2-OE1 3.29Å; N169-E172 VanDerWaalsContact ND2-OE1 3.09Å; N169-E172 PolarHBondContact O-N 3.48Å
170W53.8Low52.4Low159 Ų159132.9 Ų132.960%0.60266%0.658SS**THydrogen-bonded Turntrans-59-13.4173.8-74.792.9000113.5T162 F168T162-W170 VanDerWaalsContact CB-CZ2 3.5Å; T162-W170 WeakPolarHBondContact OG1-CH2 3.37Å; T162-W170 VanDerWaalsContact OG1-CZ2 3.25Å; T162-W170 WeakPolarHBondContact OG1-CZ2 3.48Å; F168-W170 AromaticContact CD1-CD1 3.8Å; F168-W170 AromaticContact CD1-CD2 3.82Å; F168-W170 HydrophobicContact CD1-CD2 3.82Å; F168-W170 AromaticContact CD1-CE2 3.71Å; F168-W170 HydrophobicContact CD1-CE3 4.45Å; F168-W170 AromaticContact CD1-CG 3.91Å; F168-W170 HydrophobicContact CD1-CG 3.91Å; F168-W170 HydrophobicContact CD1-CZ2 4.3Å; F168-W170 AromaticContact CD1-NE1 3.66Å; F168-W170 AromaticContact CE1-CD2 3.81Å; F168-W170 HydrophobicContact CE1-CD2 3.81Å; F168-W170 AromaticContact CE1-CE3 3.99Å; F168-W170 HydrophobicContact CE1-CE3 3.99Å; F168-W170 HydrophobicContact CE1-CG 4.18Å; F168-W170 HydrophobicContact CE1-CZ2 4.43Å; F168-W170 HydrophobicContact CE1-CZ3 4.39Å; F168-W170 PolarHBondContact O-N 3.46Å
171Q53.2Low50.3Low166 Ų166133.7 Ų133.778%0.77667%0.671SS**THydrogen-bonded Turntrans-88.3-4.8-178.5-124.1164.60.200114N169N169-Q171 PolarHBondContact O-N 2.93Å; N169-Q171 WeakPolarHBondContact OD1-CA 3.48Å; N169-Q171 WeakPolarHBondContact OD1-CB 3.36Å; N169-Q171 PolarHBondContact OD1-N 3.18Å
172E51.8Low48.8Very low139 Ų139130.9 Ų130.965%0.6567%0.674SS**SBendtrans-93.9-10.5179.7-102.6163-154.200114.5N169N169-E172 HydrophobicContact CB-CB 4.47Å; N169-E172 WeakPolarHBondContact ND2-CG 3.47Å; N169-E172 PolarHBondContact ND2-OE1 3.29Å; N169-E172 VanDerWaalsContact ND2-OE1 3.09Å; N169-E172 PolarHBondContact O-N 3.48Å
173F47Very low47.3Very low178 Ų178138.9 Ų138.978%0.78171%0.708SS**SBendtrans-88.3-9.2-177.5-142.6-93.1000114.6
174D49.5Very low45.8Very low129 Ų129134.9 Ų134.969%0.6971%0.709SS**SBendtrans-85.3-8.4-174.9-83-26.9000114.8
175Y50.7Low44.5Very low208 Ų208133.9 Ų133.982%0.81671%0.711SS**SBendtrans-1360.2-171-75.1-74.7000118.2S177Y175-S177 PolarHBondContact O-N 2.93Å
176Q42.8Very low43.9Very low178 Ų178133.6 Ų133.683%0.83272%0.717SS**  trans-91.886172.8-123.971.729.700112
177S42.3Very low43.1Very low106 Ų106132.9 Ų132.974%0.74172%0.715SS**  trans-81163.5173.6-167.90000112.4Y175Y175-S177 PolarHBondContact O-N 2.93Å
178V38.1Very low42.4Very low128 Ų128136.6 Ų136.678%0.77672%0.721SS**  trans74.987.2165.6-1610000117.7
179S35.9Very low41.8Very low108 Ų108137.9 Ų137.976%0.75574%0.739SS**SBend-178.6155.6113.9-73.80000111.1
180D37.3Very low41.1Very low151 Ų151144 Ų14481%0.80776%0.763SS**  trans64.474.7177.1-61.9-8.6000117.4V182D180-V182 PolarHBondContact O-N 3.44Å
181S35.8Very low40.1Very low104 Ų104143.5 Ų143.573%0.72777%0.772SS**  trans-57.3106.8168.3160.10000113.5
182V44.6Very low39.2Very low128 Ų128142.2 Ų142.278%0.77678%0.775SS**  trans-119.811.7165.9-142.70000113.3D180D180-V182 PolarHBondContact O-N 3.44Å
183F37.5Very low38.1Very low188 Ų188139.6 Ų139.683%0.82578%0.778SS**  trans-126.554-177.6-76-78.8000113.3L185F183-L185 PolarHBondContact O-N 2.95Å
184S37.6Very low37.8Very low105 Ų105137.8 Ų137.873%0.73478%0.784SS**  trans-84.486.9159.6-72.30000110S186S184-S186 PolarHBondContact O-N 3.14Å
185L33.1Very low37.1Very low156 Ų156140.4 Ų140.482%0.81779%0.792SS**  trans-73.495.2163.3-84156000109.5F183F183-L185 PolarHBondContact O-N 2.95Å
186S36Very low36.3Very low93 Ų93137.5 Ų137.565%0.6579%0.791SS**  trans-110.1125.9144.158.80000107.1S184S184-S186 PolarHBondContact O-N 3.14Å
187S34.8Very low36Very low124 Ų124137.2 Ų137.287%0.86779%0.789SS**  cis56.952.349.5-51.30000111.5
188Q36.2Very low35.6Very low181 Ų181136.8 Ų136.885%0.84679%0.786SS**  trans-124.8137.3159.5-149.2165.921.700109.2
189S33.7Very low35.5Very low98 Ų98139.1 Ų139.169%0.68579%0.788SS**  trans-73.1150.6-161.642.90000114.4D191S189-D191 PolarHBondContact O-N 2.97Å
190F32.5Very low35.2Very low198 Ų198141.1 Ų141.187%0.86879%0.79SS**SBendtrans-6298.1150.3-83.3-104.3000108.3
191D32.4Very low35.2Very low148 Ų148139.7 Ų139.779%0.79179%0.789SS**  trans-178.689.6151.8-102.9-25.3000110.5S189S189-D191 PolarHBondContact O-N 2.97Å
192T34.6Very low35.2Very low138 Ų138144.4 Ų144.485%0.84780%0.796SS**  trans-158.9109152.6-25.10000110.2
193A28.4Very low34.9Very low85 Ų85143.8 Ų143.870%0.70280%0.797SS**  trans-76.7139.9158.600000108.7E195A193-E195 PolarHBondContact O-N 3.49Å; A193-E195 VanDerWaalsContact O-N 3.07Å
194P39.6Very low34.9Very low139 Ų139142.4 Ų142.490%0.90379%0.794SS**  trans-81.186.617232.5-31.7000109.5
195E34.3Very low35Very low185 Ų185144.4 Ų144.486%0.86480%0.796SS**  trans-99.6145.9157.2-147.9171-160.500108.9A193A193-E195 PolarHBondContact O-N 3.49Å; A193-E195 VanDerWaalsContact O-N 3.07Å
196D35.7Very low35.3Very low147 Ų147140.8 Ų140.879%0.78680%0.796SS**  trans85.7151.7170.3-151.716.9000120.2
197Q35.8Very low35.4Very low172 Ų172146.4 Ų146.480%0.80481%0.809SS**  trans70.6128.5176.7-51178.253.300116.4
198S34.2Very low35.6Very low96 Ų96144.5 Ų144.567%0.67180%0.801SS**  cis-159.3179.1-11.967.70000107.7
199Q34.9Very low35.8Very low177 Ų177143.2 Ų143.283%0.82780%0.8SS**  cis-156.7171.313.6-145161.5118.400110.6
200L30.1Very low35.9Very low151 Ų151143.9 Ų143.979%0.79180%0.804SS**  trans-116.7133.7173.1-101.6160.3000110.4
201P38.3Very low36.2Very low120 Ų120146 Ų14678%0.77981%0.806SS**  trans-88.8126158.424.7-14.3000110.9
202K34.2Very low36.3Very low204 Ų204149.1 Ų149.189%0.88781%0.807SS**  trans-96.6120.2171.3-78.6176.7176.4170.80111.1
203S38.9Very low36.5Very low114 Ų114148 Ų14880%0.79780%0.795SS**  trans-175.7150.6150.1520000108.7
204Q38.7Very low36.9Very low160 Ų160151.4 Ų151.475%0.74880%0.797SS**  cis-165.9156.9-22-177.6-179.1-48.400107
205D38.5Very low36.7Very low147 Ų147153.5 Ų153.579%0.78679%0.794SS**  trans68.5135.2167.3-66.3-40.9000120.6
206G38.5Very low36.7Very low79 Ų79149.8 Ų149.881%0.81480%0.795SS**  trans151.434.7171.300000119.9
207K39.3Very low36.7Very low211 Ų211146.4 Ų146.492%0.91780%0.795SS**  trans-22.2131.3174.3-69.4167.6173.5167.80117.9
208A39.3Very low36.6Very low85 Ų85143.9 Ų143.970%0.70280%0.796SS**  165.6141.1102.600000115.2
209N40.7Very low36.8Very low154 Ų154144.6 Ų144.682%0.82480%0.801SS**  trans54.2109.5160.2-58.8-14.1000118.5
210S35Very low37Very low111 Ų111147.5 Ų147.578%0.77681%0.805SS**  cis69.799.135.5-60.90000117.8
211R38.8Very low37.3Very low243 Ų243149.4 Ų149.492%0.91781%0.806SS**  trans156.1119.8132.9-82.9167.2-158.7-141.56.3108.3
212R34.7Very low37.3Very low213 Ų213149.4 Ų149.480%0.80481%0.805SS**  cis86.5141.443.5-159.5-159.5177.9-137.5-4.6112.6
213L38.7Very low37.5Very low115 Ų115145.2 Ų145.260%0.60279%0.792SS**  trans77.4141.8173.3-95.156.3000116.2
214E36.8Very low37.6Very low157 Ų157147.5 Ų147.573%0.73479%0.79SS**  cis-163.7-173-19.5-132.7166.1-133.300112.2
215H36Very low37.9Very low182 Ų182147.3 Ų147.384%0.84379%0.789SS**  trans-75.4159-173.4-75.6-91.9000116.9
216A32.7Very low37.9Very low108 Ų108147.1 Ų147.189%0.89379%0.788SS**  trans72.6144.5143.900000121.4
217G36.5Very low37.9Very low75 Ų75146.2 Ų146.277%0.77378%0.778SS**  trans120.676.8172.900000113.7
218S34.8Very low38Very low119 Ų119143.9 Ų143.983%0.83278%0.775SS**  739980.8-169.40000116
219S37.2Very low38Very low111 Ų111145.6 Ų145.678%0.77678%0.776SS**  trans163.3105.4134.7-76.50000110.2
220R38.6Very low37.8Very low239 Ų239145.2 Ų145.290%0.90277%0.774SS**  84.2102.668.2-171.2-173.7-156.8-171.47.9113.5
221K37.1Very low38Very low190 Ų190147.5 Ų147.583%0.82677%0.773SS**  trans179.6134.1133.2-101.5169.6-177.5-175.80113.5
222T39Very low37.8Very low121 Ų121142.5 Ų142.574%0.74277%0.769SS**  trans57.1135.6148.759.90000120
223N38.2Very low38Very low115 Ų115135.7 Ų135.762%0.61577%0.766SS**  cis-155.4155.21-108.726.2000110.3
224E41.3Very low38.1Very low163 Ų163136.8 Ų136.876%0.76278%0.777SS**  trans37.7140.5134.7-64.8152.9-174.700120.3
225E43.2Very low37.8Very low155 Ų155139 Ų13972%0.72479%0.785SS**  cis-166.7154.233.7-134.4-172.3137.700112.5
226N40.2Very low37.9Very low143 Ų143135.4 Ų135.477%0.76578%0.78SS**  trans56.3144.8154.5-53.1-31.1000122
227G38Very low38.1Very low60 Ų60134.5 Ų134.562%0.61977%0.768SS**  cis175.7126.2-800000110
228I42Very low38.1Very low163 Ų163137.6 Ų137.684%0.83677%0.766SS**  56.5122.4106-50.4165.3000113
229T39.6Very low38.2Very low121 Ų121137.8 Ų137.874%0.74276%0.762SS**  -168.9159.161.7-28.50000112.6
230D35.8Very low38.5Very low146 Ų146137 Ų13778%0.78176%0.757SS**  trans-120147.7170.2-157.5-0.4000109.8
231Q38.6Very low38.6Very low159 Ų159135 Ų13574%0.74376%0.758SS**  trans173.3120.9167.6-103.8153.8109.600109.9
232T34.9Very low38.7Very low137 Ų137129.1 Ų129.184%0.8475%0.751SS**  64126.65861.80000117.5
233G39.1Very low38.7Very low71 Ų71127.6 Ų127.673%0.73275%0.745SS**  trans144.6141.2171.500000113.2
234T39.5Very low39.2Very low137 Ų137126.7 Ų126.784%0.8475%0.753SS**  cis-159.5135.7-2.1-53.10000110.6
235F31.9Very low39.6Very low203 Ų203126.4 Ų126.489%0.8975%0.752SS**  trans-88.7133.9161.8-100.3-96000109.7
236S36.9Very low40.3Very low108 Ų108123 Ų12376%0.75575%0.745SS**  trans163.2157.9156.9-90.10000111.7
237S38.2Very low41.6Very low89 Ų89118.3 Ų118.362%0.62273%0.731SS**  cis-168.9149.6-17.3-97.80000108.4
238N36Very low43.5Very low140 Ų140125.7 Ų125.775%0.74974%0.74SS**  trans35.6137.9143.1-46.7-23000121.1
239T36Very low45.3Very low122 Ų122122.3 Ų122.375%0.74872%0.721SS**  157.9152.598.4-55.60000112.1
240S44.7Very low47.3Very low94 Ų94122.5 Ų122.566%0.65771%0.714SS**  trans62.6102.2162.846.80000117.6
241Q41.2Very low49.5Very low199 Ų199120.2 Ų120.293%0.9370%0.698SS**  72.894.687.7-79-174.9-4000114.2
242G38Very low51.8Low65 Ų65119.7 Ų119.767%0.6769%0.689SS**  trans169.695.3168.900000114.2
243S40.3Very low54.3Low89 Ų89118.4 Ų118.462%0.62267%0.674SS**  trans57.4127.8170.9-151.30000118.6E245 S246S243-E245 PolarHBondContact O-N 3.43Å; S243-S246 PolarHBondContact O-OG 3.4Å
244A46.8Very low56.7Low96 Ų96119.8 Ų119.879%0.79366%0.659SS**THydrogen-bonded Turntrans-73.65-175.200000115.4
245E50.3Low59.1Low158 Ų158118.1 Ų118.174%0.73865%0.645SS**THydrogen-bonded Turntrans-88.5-17.7-179.9-71.3173.5125.900113.7S243 G247S243-E245 PolarHBondContact O-N 3.43Å; E245-G247 PolarHBondContact O-N 2.91Å
246S57.4Low61.9Low82 Ų82116.4 Ų116.457%0.57363%0.633SS**Hα-helixtrans-67.4-32.6-17553.10000114.4S243 W248 E249 E250S243-S246 PolarHBondContact O-OG 3.4Å; S246-W248 PolarHBondContact O-N 3.34Å; S246-E249 PolarHBondContact O-N 2.91Å; S246-E250 PolarHBondContact O-N 2.9Å
247G67.5Low64.5Low45 Ų45115.1 Ų115.146%0.46462%0.62SS.*Hα-helixtrans-67.6-35.5-176.100000114.5E245 E251E245-G247 PolarHBondContact O-N 2.91Å; G247-E251 PolarHBondContact O-N 3.41Å; G247-E251 VanDerWaalsContact O-N 3.15Å
248W79.1Confident66.9Low215 Ų215115 Ų11581%0.81461%0.612SS**Hα-helixtrans-72.6-33.1179.1-71.897000112.4S246 R252S246-W248 PolarHBondContact O-N 3.34Å; W248-R252 WeakPolarHBondContact O-CB 3.5Å; W248-R252 PolarHBondContact O-N 2.89Å
249E80.2Confident69.5Low93 Ų93113.8 Ų113.844%0.43561%0.605SS.*Hα-helixtrans-70.4-39178.1-161.758.2-135.100111.1S246 R252 Q253S246-E249 PolarHBondContact O-N 2.91Å; E249-R252 PolarHBondContact O-N 3.31Å; E249-R252 IonicContact OE1-CZ 2.72Å; E249-R252 IonicContact OE1-NE 3.13Å; E249-R252 PolarHBondContact OE1-NE 3.45Å; E249-R252 IonicContact OE1-NH2 3.81Å; E249-R252 PolarHBondContact OE1-NH2 3.29Å; E249-R252 IonicContact OE2-CZ 2.7Å; E249-R252 IonicContact OE2-NE 2.65Å; E249-R252 IonicContact OE2-NH2 2.71Å; E249-Q253 WeakPolarHBondContact O-CB 3.33Å; E249-Q253 PolarHBondContact O-N 3.21Å
250E81Confident72.1Confident125 Ų125113.8 Ų113.858%0.58460%0.595SS**Hα-helixtrans-67.5-41.8176.1-150.8-167.8-121.100112.1S246 Q253 K254S246-E250 PolarHBondContact O-N 2.9Å; E250-Q253 PolarHBondContact O-N 3.37Å; E250-K254 WeakPolarHBondContact O-CG 3.48Å; E250-K254 PolarHBondContact O-N 3.16Å; E250-K254 WeakPolarHBondContact OE2-CE 3.35Å; E250-K254 IonicContact OE2-NZ 2.94Å; E250-K254 PolarHBondContact OE2-NZ 3.3Å
251E82.1Confident74.2Confident97 Ų97113.7 Ų113.745%0.45358%0.584SS.*Hα-helixtrans-69.6-37.3176.5-153.565.1-167.300112G247 Q253 K254 L255G247-E251 PolarHBondContact O-N 3.41Å; G247-E251 VanDerWaalsContact O-N 3.15Å; E251-Q253 VanDerWaalsContact C-N 3.31Å; E251-Q253 PolarHBondContact O-N 3.01Å; E251-K254 PolarHBondContact O-N 3.42Å; E251-K254 WeakPolarHBondContact OE2-CD 3.44Å; E251-K254 IonicContact OE2-NZ 3.17Å; E251-K254 PolarHBondContact OE2-NZ 2.97Å; E251-L255 WeakPolarHBondContact O-CG 3.47Å; E251-L255 PolarHBondContact O-N 3.29Å
252R86.1Confident76.5Confident149 Ų149108.4 Ų108.456%0.56256%0.56SS**Hα-helixtrans-58.1-44170.1-175174.888146.72.6111W248 E249 L255 W256W248-R252 WeakPolarHBondContact O-CB 3.5Å; W248-R252 PolarHBondContact O-N 2.89Å; E249-R252 PolarHBondContact O-N 3.31Å; E249-R252 IonicContact OE1-CZ 2.72Å; E249-R252 IonicContact OE1-NE 3.13Å; E249-R252 PolarHBondContact OE1-NE 3.45Å; E249-R252 IonicContact OE1-NH2 3.81Å; E249-R252 PolarHBondContact OE1-NH2 3.29Å; E249-R252 IonicContact OE2-CZ 2.7Å; E249-R252 IonicContact OE2-NE 2.65Å; E249-R252 IonicContact OE2-NH2 2.71Å; R252-L255 PolarHBondContact O-N 3.01Å; R252-W256 WeakPolarHBondContact O-CB 3.48Å; R252-W256 PolarHBondContact O-N 2.88Å
253Q88.7Confident79Confident110 Ų110113.4 Ų113.451%0.51456%0.559SS.*Hα-helixtrans-68.2-38.3-179.8-165.366.92.600112.5E249 E250 E251 W256 T257E249-Q253 WeakPolarHBondContact O-CB 3.33Å; E249-Q253 PolarHBondContact O-N 3.21Å; E250-Q253 PolarHBondContact O-N 3.37Å; E251-Q253 VanDerWaalsContact C-N 3.31Å; E251-Q253 PolarHBondContact O-N 3.01Å; Q253-W256 PolarHBondContact O-N 3.01Å; Q253-T257 PolarHBondContact O-N 2.95Å; Q253-T257 PolarHBondContact O-OG1 3.33Å
254K89.3Confident81.3Confident99 Ų99112.9 Ų112.943%0.4355%0.549SS..Hα-helixtrans-60.5-48.4171.9-68.6167.2-152.6156.70111.3E250 E251 W256 T257 L258E250-K254 WeakPolarHBondContact O-CG 3.48Å; E250-K254 PolarHBondContact O-N 3.16Å; E250-K254 WeakPolarHBondContact OE2-CE 3.35Å; E250-K254 IonicContact OE2-NZ 2.94Å; E250-K254 PolarHBondContact OE2-NZ 3.3Å; E251-K254 PolarHBondContact O-N 3.42Å; E251-K254 WeakPolarHBondContact OE2-CD 3.44Å; E251-K254 IonicContact OE2-NZ 3.17Å; E251-K254 PolarHBondContact OE2-NZ 2.97Å; K254-W256 VanDerWaalsContact C-N 3.32Å; K254-W256 PolarHBondContact O-N 3.24Å; K254-T257 PolarHBondContact O-N 2.85Å; K254-L258 PolarHBondContact O-N 3.23Å
255L88.5Confident83.3Confident102 Ų102115 Ų11553%0.53454%0.536SS..Hα-helixtrans-61.8-38176.5-75.1170.8000112.5E251 R252 L258 L259E251-L255 WeakPolarHBondContact O-CG 3.47Å; E251-L255 PolarHBondContact O-N 3.29Å; R252-L255 PolarHBondContact O-N 3.01Å; L255-L258 PolarHBondContact O-N 2.97Å; L255-L259 WeakPolarHBondContact O-CB 3.47Å; L255-L259 PolarHBondContact O-N 3.14Å
256W91.4Very high85Confident167 Ų167112.3 Ų112.363%0.63353%0.526SS*.Hα-helixtrans-66.4-40.2176.1-142.2100.2000112R252 Q253 K254 L259 K260R252-W256 WeakPolarHBondContact O-CB 3.48Å; R252-W256 PolarHBondContact O-N 2.88Å; Q253-W256 PolarHBondContact O-N 3.01Å; K254-W256 VanDerWaalsContact C-N 3.32Å; K254-W256 PolarHBondContact O-N 3.24Å; W256-L259 PolarHBondContact O-N 3.24Å; W256-K260 HydrophobicContact CE3-CB 4.45Å; W256-K260 HydrophobicContact CZ3-CB 4.43Å; W256-K260 HydrophobicContact CZ3-CD 4.33Å; W256-K260 WeakPolarHBondContact O-CB 3.31Å; W256-K260 PolarHBondContact O-N 3.48Å
257T91Very high86.5Confident81 Ų81112.8 Ų112.850%0.49752%0.522SS..Hα-helixtrans-64.3-44.6175.3-52.60000111Q253 K254 K260 E261Q253-T257 PolarHBondContact O-N 2.95Å; Q253-T257 PolarHBondContact O-OG1 3.33Å; K254-T257 PolarHBondContact O-N 2.85Å; T257-K260 WeakPolarHBondContact O-CB 3.26Å; T257-K260 PolarHBondContact O-N 2.95Å; T257-E261 PolarHBondContact O-N 3.26Å
258L89.8Confident87.3Confident86 Ų86116 Ų11645%0.4553%0.533SS..Hα-helixtrans-63.8-41.7176-175.865000112.3K254 L255 K260 E261 M262K254-L258 PolarHBondContact O-N 3.23Å; L255-L258 PolarHBondContact O-N 2.97Å; L258-K260 VanDerWaalsContact C-N 3.3Å; L258-K260 PolarHBondContact O-N 2.85Å; L258-E261 PolarHBondContact O-N 3.41Å; L258-M262 HydrophobicContact CD1-CE 3.88Å; L258-M262 HydrophobicContact CD1-CG 4.42Å; L258-M262 WeakPolarHBondContact O-CB 3.48Å; L258-M262 VanDerWaalsContact O-CG 3.24Å; L258-M262 WeakPolarHBondContact O-CG 3.44Å; L258-M262 PolarHBondContact O-N 3.41Å
259L89.6Confident87.5Confident116 Ų116111.4 Ų111.461%0.60752%0.524SS*.Hα-helixtrans-61.2-39174.2-98.6164.5000112.1L255 W256 R263L255-L259 WeakPolarHBondContact O-CB 3.47Å; L255-L259 PolarHBondContact O-N 3.14Å; W256-L259 PolarHBondContact O-N 3.24Å; L259-R263 WeakPolarHBondContact O-CB 3.45Å; L259-R263 PolarHBondContact O-N 2.94Å
260K90.7Very high87.7Confident121 Ų121111.4 Ų111.453%0.52652%0.524SS..Hα-helixtrans-66.6-49.3175.1-169-176.9179.5-176.40111.2W256 T257 L258 M262 R263 D264W256-K260 HydrophobicContact CE3-CB 4.45Å; W256-K260 HydrophobicContact CZ3-CB 4.43Å; W256-K260 HydrophobicContact CZ3-CD 4.33Å; W256-K260 WeakPolarHBondContact O-CB 3.31Å; W256-K260 PolarHBondContact O-N 3.48Å; T257-K260 WeakPolarHBondContact O-CB 3.26Å; T257-K260 PolarHBondContact O-N 2.95Å; L258-K260 VanDerWaalsContact C-N 3.3Å; L258-K260 PolarHBondContact O-N 2.85Å; K260-M262 VanDerWaalsContact C-N 3.33Å; K260-M262 PolarHBondContact O-N 3.19Å; K260-R263 WeakPolarHBondContact O-CB 3.39Å; K260-R263 PolarHBondContact O-N 3.33Å; K260-R263 VanDerWaalsContact O-N 3.11Å; K260-D264 PolarHBondContact O-N 3.38Å
261E89.8Confident88Confident92 Ų92109.3 Ų109.343%0.4352%0.521SS..Hα-helixtrans-61.3-39.7179-165.3-170.8163.400112.1T257 L258 D264 R265T257-E261 PolarHBondContact O-N 3.26Å; L258-E261 PolarHBondContact O-N 3.41Å; E261-D264 PolarHBondContact O-N 3.25Å; E261-R265 WeakPolarHBondContact O-CB 3.42Å; E261-R265 WeakPolarHBondContact O-CG 3.14Å; E261-R265 PolarHBondContact O-N 3.41Å; E261-R265 IonicContact OE1-CZ 3.15Å; E261-R265 IonicContact OE1-NE 2.68Å; E261-R265 IonicContact OE1-NH2 2.78Å; E261-R265 PolarHBondContact OE1-NH2 2.91Å
262M88.1Confident88.2Confident88 Ų88107.6 Ų107.643%0.43352%0.52SS..Hα-helixtrans-66.5-37.8174.6-70.5-65.9169.400112.2L258 K260 R265 I266L258-M262 HydrophobicContact CD1-CE 3.88Å; L258-M262 HydrophobicContact CD1-CG 4.42Å; L258-M262 WeakPolarHBondContact O-CB 3.48Å; L258-M262 VanDerWaalsContact O-CG 3.24Å; L258-M262 WeakPolarHBondContact O-CG 3.44Å; L258-M262 PolarHBondContact O-N 3.41Å; K260-M262 VanDerWaalsContact C-N 3.33Å; K260-M262 PolarHBondContact O-N 3.19Å; M262-R265 PolarHBondContact O-N 2.86Å; M262-I266 VanDerWaalsContact O-CG1 3.29Å; M262-I266 WeakPolarHBondContact O-CG1 3.27Å; M262-I266 PolarHBondContact O-N 2.9Å
263R90.9Very high88.3Confident171 Ų171107.8 Ų107.865%0.64552%0.52SS*.Hα-helixtrans-67-41.6174.3-177162.9-68.1-171.9-0.9112L259 K260 I266 N267L259-R263 WeakPolarHBondContact O-CB 3.45Å; L259-R263 PolarHBondContact O-N 2.94Å; K260-R263 WeakPolarHBondContact O-CB 3.39Å; K260-R263 PolarHBondContact O-N 3.33Å; K260-R263 VanDerWaalsContact O-N 3.11Å; R263-I266 PolarHBondContact O-N 2.92Å; R263-N267 VanDerWaalsContact O-CG 3.23Å; R263-N267 PolarHBondContact O-N 3.07Å; R263-N267 PolarHBondContact O-ND2 2.77Å
264D89.4Confident88.2Confident78 Ų78107.2 Ų107.242%0.41752%0.518SS..Hα-helixtrans-66.4-38.3177.1-67.5-22.5000111.1K260 E261 N267 V268K260-D264 PolarHBondContact O-N 3.38Å; E261-D264 PolarHBondContact O-N 3.25Å; D264-N267 PolarHBondContact O-N 2.98Å; D264-V268 WeakPolarHBondContact O-CG2 3.45Å; D264-V268 PolarHBondContact O-N 3.12Å
265R88Confident88.2Confident139 Ų139109.4 Ų109.453%0.52553%0.527SS..Hα-helixtrans-61.3-42.5170.3-79.2179.7177.8-173.24.3113.2E261 M262 V268 L269E261-R265 WeakPolarHBondContact O-CB 3.42Å; E261-R265 WeakPolarHBondContact O-CG 3.14Å; E261-R265 PolarHBondContact O-N 3.41Å; E261-R265 IonicContact OE1-CZ 3.15Å; E261-R265 IonicContact OE1-NE 2.68Å; E261-R265 IonicContact OE1-NH2 2.78Å; E261-R265 PolarHBondContact OE1-NH2 2.91Å; M262-R265 PolarHBondContact O-N 2.86Å; R265-V268 PolarHBondContact O-N 2.81Å; R265-L269 WeakPolarHBondContact O-CG 3.34Å; R265-L269 PolarHBondContact O-N 2.97Å; R265-L269 VanDerWaalsContact O-N 3.07Å
266I86.5Confident88.1Confident103 Ų103108.2 Ų108.253%0.52852%0.519SS..Hα-helixtrans-60.8-46.6175.1-71.4164.1000110.1M262 R263 V268 L269 Q270M262-I266 VanDerWaalsContact O-CG1 3.29Å; M262-I266 WeakPolarHBondContact O-CG1 3.27Å; M262-I266 PolarHBondContact O-N 2.9Å; R263-I266 PolarHBondContact O-N 2.92Å; I266-V268 VanDerWaalsContact C-N 3.31Å; I266-V268 PolarHBondContact O-N 3.42Å; I266-L269 PolarHBondContact O-N 3.38Å; I266-Q270 WeakPolarHBondContact O-CB 3.43Å; I266-Q270 PolarHBondContact O-N 3.17Å
267N87.9Confident87.9Confident91 Ų91103.4 Ų103.449%0.48750%0.503SS..Hα-helixtrans-60.8-36.7178.7-67.8-21.9000112.9R263 D264 P271R263-N267 VanDerWaalsContact O-CG 3.23Å; R263-N267 PolarHBondContact O-N 3.07Å; R263-N267 PolarHBondContact O-ND2 2.77Å; D264-N267 PolarHBondContact O-N 2.98Å; N267-P271 VanDerWaalsContact O-CD 3.26Å; N267-P271 WeakPolarHBondContact O-CD 3.38Å
268V84.9Confident87.8Confident114 Ų114103.9 Ų103.969%0.69150%0.502SS*.Hα-helixtrans-73.1-34.6176.9170.90000112.5D264 R265 I266D264-V268 WeakPolarHBondContact O-CG2 3.45Å; D264-V268 PolarHBondContact O-N 3.12Å; R265-V268 PolarHBondContact O-N 2.81Å; I266-V268 VanDerWaalsContact C-N 3.31Å; I266-V268 PolarHBondContact O-N 3.42Å
269L83.3Confident87.7Confident117 Ų117104.7 Ų104.761%0.61350%0.504SS*.Hα-helixtrans-81.5-25.1-178.8-69.8172.2000113.4R265 I266 S272 R273R265-L269 WeakPolarHBondContact O-CG 3.34Å; R265-L269 PolarHBondContact O-N 2.97Å; R265-L269 VanDerWaalsContact O-N 3.07Å; I266-L269 PolarHBondContact O-N 3.38Å; L269-S272 WeakPolarHBondContact O-CB 3.37Å; L269-S272 PolarHBondContact O-N 3.49Å; L269-R273 PolarHBondContact O-N 3.22Å
270Q85.3Confident87.6Confident94 Ų94102 Ų10244%0.43949%0.489SS..Hα-helixtrans-59.2-44.6-175-178.2161.6-15.100114.2I266 S272 R273 E274I266-Q270 WeakPolarHBondContact O-CB 3.43Å; I266-Q270 PolarHBondContact O-N 3.17Å; Q270-S272 VanDerWaalsContact C-N 3.27Å; Q270-S272 PolarHBondContact O-N 3Å; Q270-R273 WeakPolarHBondContact O-CB 3.36Å; Q270-R273 PolarHBondContact O-N 3.41Å; Q270-E274 VanDerWaalsContact CG-OE1 3.31Å; Q270-E274 WeakPolarHBondContact CG-OE1 3.41Å; Q270-E274 PolarHBondContact NE2-OE1 2.75Å; Q270-E274 VanDerWaalsContact NE2-OE1 3.1Å; Q270-E274 PolarHBondContact O-N 2.86Å
271P87.3Confident87.5Confident81 Ų81100.8 Ų100.853%0.52649%0.485SS..Hα-helixtrans-62.8-30.4173.4-23.734.4000113.8N267 K275N267-P271 VanDerWaalsContact O-CD 3.26Å; N267-P271 WeakPolarHBondContact O-CD 3.38Å; P271-K275 WeakPolarHBondContact O-CB 3.36Å; P271-K275 PolarHBondContact O-N 3.01Å
272S85Confident87.5Confident61 Ų61101.8 Ų101.843%0.42749%0.49SS..Hα-helixtrans-70.3-39.9175.3-171.80000111.3L269 Q270 K275 Q276L269-S272 WeakPolarHBondContact O-CB 3.37Å; L269-S272 PolarHBondContact O-N 3.49Å; Q270-S272 VanDerWaalsContact C-N 3.27Å; Q270-S272 PolarHBondContact O-N 3Å; S272-K275 PolarHBondContact O-N 3.13Å; S272-Q276 WeakPolarHBondContact O-CG 3.47Å; S272-Q276 PolarHBondContact O-N 3.46Å
273R88.1Confident87.5Confident152 Ų152103.4 Ų103.457%0.57450%0.5SS*.Hα-helixtrans-61.9-48.5174.2-175.3-166.7170.7-134.3-8.5110.9L269 Q270 K275 Q276 Q277L269-R273 PolarHBondContact O-N 3.22Å; Q270-R273 WeakPolarHBondContact O-CB 3.36Å; Q270-R273 PolarHBondContact O-N 3.41Å; R273-K275 VanDerWaalsContact C-N 3.31Å; R273-K275 PolarHBondContact O-N 3.29Å; R273-Q276 PolarHBondContact O-N 2.88Å; R273-Q276 VanDerWaalsContact O-N 3.14Å; R273-Q277 WeakPolarHBondContact O-CB 3.12Å; R273-Q277 PolarHBondContact O-N 3.49Å
274E88Confident87.4Confident99 Ų99100 Ų10046%0.46349%0.494SS..Hα-helixtrans-60-41.3179.1-72.3165.1-169.200111.3Q270 Q276 Q277 I278Q270-E274 VanDerWaalsContact CG-OE1 3.31Å; Q270-E274 WeakPolarHBondContact CG-OE1 3.41Å; Q270-E274 PolarHBondContact NE2-OE1 2.75Å; Q270-E274 VanDerWaalsContact NE2-OE1 3.1Å; Q270-E274 PolarHBondContact O-N 2.86Å; E274-Q276 PolarHBondContact O-N 2.66Å; E274-Q277 WeakPolarHBondContact O-CB 3.46Å; E274-Q277 PolarHBondContact O-N 2.92Å; E274-I278 WeakPolarHBondContact O-CG1 3.41Å; E274-I278 PolarHBondContact O-N 2.77Å; E274-I278 VanDerWaalsContact O-N 3.12Å
275K88.6Confident87.3Confident144 Ų144102.9 Ų102.963%0.62651%0.505SS*.Hα-helixtrans-64.2-38.4173.8-172.7173.8-177.6175.60113.6P271 S272 R273 Q279P271-K275 WeakPolarHBondContact O-CB 3.36Å; P271-K275 PolarHBondContact O-N 3.01Å; S272-K275 PolarHBondContact O-N 3.13Å; R273-K275 VanDerWaalsContact C-N 3.31Å; R273-K275 PolarHBondContact O-N 3.29Å; K275-Q279 PolarHBondContact O-N 3.01Å
276Q86.1Confident87.3Confident77 Ų7798.4 Ų98.436%0.3650%0.497SS..Hα-helixtrans-71.4-34.1176.4-73.1179-87.300112.2S272 R273 E274 Q279 I280S272-Q276 WeakPolarHBondContact O-CG 3.47Å; S272-Q276 PolarHBondContact O-N 3.46Å; R273-Q276 PolarHBondContact O-N 2.88Å; R273-Q276 VanDerWaalsContact O-N 3.14Å; E274-Q276 PolarHBondContact O-N 2.66Å; Q276-Q279 PolarHBondContact O-N 3.5Å; Q276-I280 VanDerWaalsContact O-CG1 3.31Å; Q276-I280 WeakPolarHBondContact O-CG1 3.43Å; Q276-I280 PolarHBondContact O-N 3.23Å
277Q88.6Confident87.3Confident66 Ų6697 Ų9731%0.30849%0.491SS..Hα-helixtrans-60.3-48.2173.9-171.470.334.600110.7R273 E274 Q279 I280 E281R273-Q277 WeakPolarHBondContact O-CB 3.12Å; R273-Q277 PolarHBondContact O-N 3.49Å; E274-Q277 WeakPolarHBondContact O-CB 3.46Å; E274-Q277 PolarHBondContact O-N 2.92Å; Q277-Q279 PolarHBondContact O-N 3.15Å; Q277-I280 PolarHBondContact O-N 3Å; Q277-I280 VanDerWaalsContact O-N 3.1Å; Q277-E281 WeakPolarHBondContact CG-OE1 3.38Å; Q277-E281 PolarHBondContact NE2-OE1 3.22Å; Q277-E281 PolarHBondContact O-N 2.95Å
278I88.6Confident87.2Confident92 Ų9299.1 Ų99.147%0.47250%0.498SS..Hα-helixtrans-59.1-45.1175.7-65.6164.6000111E274 I280 E281 E282E274-I278 WeakPolarHBondContact O-CG1 3.41Å; E274-I278 PolarHBondContact O-N 2.77Å; E274-I278 VanDerWaalsContact O-N 3.12Å; I278-I280 VanDerWaalsContact C-N 3.28Å; I278-I280 PolarHBondContact O-N 3.39Å; I278-E281 PolarHBondContact O-N 3.45Å; I278-E282 HydrophobicContact CG2-CG 4.32Å; I278-E282 WeakPolarHBondContact O-CG 3.42Å; I278-E282 PolarHBondContact O-N 3.46Å
279Q87.7Confident87.2Confident103 Ų10397.8 Ų97.848%0.48149%0.487SS..Hα-helixtrans-64.1-30176.4-74-166.5-48.300113.7K275 Q276 Q277 L283K275-Q279 PolarHBondContact O-N 3.01Å; Q276-Q279 PolarHBondContact O-N 3.5Å; Q277-Q279 PolarHBondContact O-N 3.15Å; Q279-L283 WeakPolarHBondContact O-CB 3.37Å; Q279-L283 WeakPolarHBondContact O-CD1 3.3Å; Q279-L283 WeakPolarHBondContact O-CG 3.46Å; Q279-L283 PolarHBondContact O-N 3.31Å; Q279-L283 VanDerWaalsContact O-N 3.1Å
280I86.8Confident87.2Confident59 Ų5997 Ų9730%0.30348%0.482SS..Hα-helixtrans-72.1-40.6174.6-71.1164.9000110.1Q276 Q277 I278 L283 L284Q276-I280 VanDerWaalsContact O-CG1 3.31Å; Q276-I280 WeakPolarHBondContact O-CG1 3.43Å; Q276-I280 PolarHBondContact O-N 3.23Å; Q277-I280 PolarHBondContact O-N 3Å; Q277-I280 VanDerWaalsContact O-N 3.1Å; I278-I280 VanDerWaalsContact C-N 3.28Å; I278-I280 PolarHBondContact O-N 3.39Å; I280-L283 PolarHBondContact O-N 2.99Å; I280-L284 HydrophobicContact CG2-CD1 4Å; I280-L284 HydrophobicContact CG2-CG 4.46Å; I280-L284 WeakPolarHBondContact O-CB 3.49Å; I280-L284 VanDerWaalsContact O-CG 3.28Å; I280-L284 WeakPolarHBondContact O-CG 3.1Å; I280-L284 PolarHBondContact O-N 3.17Å
281E88.9Confident87.1Confident95 Ų9597.5 Ų97.544%0.44449%0.485SS..Hα-helixtrans-65.3-46.3175.9-73.6162.1-162.600111.3Q277 I278 L283 L284 E285Q277-E281 WeakPolarHBondContact CG-OE1 3.38Å; Q277-E281 PolarHBondContact NE2-OE1 3.22Å; Q277-E281 PolarHBondContact O-N 2.95Å; I278-E281 PolarHBondContact O-N 3.45Å; E281-L283 VanDerWaalsContact C-N 3.3Å; E281-L283 PolarHBondContact O-N 2.98Å; E281-L284 PolarHBondContact O-N 3.28Å; E281-L284 VanDerWaalsContact O-N 3.14Å; E281-E285 PolarHBondContact O-N 3.27Å
282E90.6Very high86.7Confident114 Ų11499.5 Ų99.553%0.53349%0.485SS..Hα-helixtrans-56.1-40.1171.9-72.4174167.600112.7I278 A286I278-E282 HydrophobicContact CG2-CG 4.32Å; I278-E282 WeakPolarHBondContact O-CG 3.42Å; I278-E282 PolarHBondContact O-N 3.46Å; E282-A286 VanDerWaalsContact O-CB 3.28Å; E282-A286 WeakPolarHBondContact O-CB 3.46Å; E282-A286 PolarHBondContact O-N 3.45Å
283L87Confident86.4Confident121 Ų121103 Ų10363%0.63449%0.489SS*.Hα-helixtrans-75-30.6177.9-75.9171.7000113.1Q279 I280 E281 N287Q279-L283 WeakPolarHBondContact O-CB 3.37Å; Q279-L283 WeakPolarHBondContact O-CD1 3.3Å; Q279-L283 WeakPolarHBondContact O-CG 3.46Å; Q279-L283 PolarHBondContact O-N 3.31Å; Q279-L283 VanDerWaalsContact O-N 3.1Å; I280-L283 PolarHBondContact O-N 2.99Å; E281-L283 VanDerWaalsContact C-N 3.3Å; E281-L283 PolarHBondContact O-N 2.98Å; L283-N287 WeakPolarHBondContact O-CB 3.46Å; L283-N287 PolarHBondContact O-N 3.03Å
284L88.2Confident85.7Confident100 Ų100100.6 Ų100.652%0.52449%0.487SS..Hα-helixtrans-69.2-47.4173.1-75.4168.5000110.6I280 E281 A286 N287 E288I280-L284 HydrophobicContact CG2-CD1 4Å; I280-L284 HydrophobicContact CG2-CG 4.46Å; I280-L284 WeakPolarHBondContact O-CB 3.49Å; I280-L284 VanDerWaalsContact O-CG 3.28Å; I280-L284 WeakPolarHBondContact O-CG 3.1Å; I280-L284 PolarHBondContact O-N 3.17Å; E281-L284 PolarHBondContact O-N 3.28Å; E281-L284 VanDerWaalsContact O-N 3.14Å; L284-A286 VanDerWaalsContact C-N 3.31Å; L284-A286 PolarHBondContact O-N 3.5Å; L284-N287 PolarHBondContact O-N 3.36Å; L284-E288 PolarHBondContact O-N 3.4Å
285E88.4Confident85.1Confident138 Ų138101.2 Ų101.265%0.64549%0.493SS*.Hα-helixtrans-58.5-42.3173.4-70.9-175.717500111.7E281 N287 E288 L289E281-E285 PolarHBondContact O-N 3.27Å; E285-N287 VanDerWaalsContact C-N 3.3Å; E285-N287 PolarHBondContact O-N 2.89Å; E285-E288 PolarHBondContact O-N 3.42Å; E285-L289 WeakPolarHBondContact O-CB 3.36Å; E285-L289 PolarHBondContact O-N 2.89Å
286A87.4Confident84.2Confident45 Ų4599 Ų9937%0.37249%0.485SS..Hα-helixtrans-65.1-32.4175.400000113E282 L284 L290E282-A286 VanDerWaalsContact O-CB 3.28Å; E282-A286 WeakPolarHBondContact O-CB 3.46Å; E282-A286 PolarHBondContact O-N 3.45Å; L284-A286 VanDerWaalsContact C-N 3.31Å; L284-A286 PolarHBondContact O-N 3.5Å; A286-L290 WeakPolarHBondContact O-CG 3.44Å; A286-L290 PolarHBondContact O-N 3.47Å; A286-L290 VanDerWaalsContact O-N 3.12Å
287N87Confident83Confident74 Ų74100 Ų10040%0.39649%0.493SS..Hα-helixtrans-76.7-41.4176.5-167.967.3000112L283 L284 E285 L289 L290 E291L283-N287 WeakPolarHBondContact O-CB 3.46Å; L283-N287 PolarHBondContact O-N 3.03Å; L284-N287 PolarHBondContact O-N 3.36Å; E285-N287 VanDerWaalsContact C-N 3.3Å; E285-N287 PolarHBondContact O-N 2.89Å; N287-L289 VanDerWaalsContact C-N 3.27Å; N287-L289 PolarHBondContact O-N 3.24Å; N287-L290 CarbonylContact O-C 3.55Å; N287-L290 WeakPolarHBondContact O-CA 3.46Å; N287-L290 WeakPolarHBondContact O-CB 3.43Å; N287-L290 PolarHBondContact O-N 2.93Å; N287-E291 PolarHBondContact ND2-OE1 3.43Å; N287-E291 PolarHBondContact O-N 2.98Å
288E85.7Confident81.8Confident135 Ų135104.5 Ų104.563%0.63151%0.514SS*.Hα-helixtrans-58.6-39.8171.4-72-177.3-179.200111.1L284 E285 L290 E291 F292L284-E288 PolarHBondContact O-N 3.4Å; E285-E288 PolarHBondContact O-N 3.42Å; E288-L290 VanDerWaalsContact C-N 3.33Å; E288-L290 PolarHBondContact O-N 3.47Å; E288-E291 PolarHBondContact O-N 3.5Å; E288-F292 WeakPolarHBondContact O-CB 3.34Å; E288-F292 PolarHBondContact O-N 3.1Å
289L85.5Confident80.3Confident87 Ų87104.5 Ų104.546%0.45552%0.522SS..Hα-helixtrans-67-30.6173.7-174.765000113.3E285 N287 R293E285-L289 WeakPolarHBondContact O-CB 3.36Å; E285-L289 PolarHBondContact O-N 2.89Å; N287-L289 VanDerWaalsContact C-N 3.27Å; N287-L289 PolarHBondContact O-N 3.24Å; L289-R293 WeakPolarHBondContact O-CG 3.44Å; L289-R293 PolarHBondContact O-N 3.06Å; L289-R293 VanDerWaalsContact O-N 3.17Å
290L82.8Confident78.3Confident99 Ų99102.7 Ų102.752%0.51852%0.52SS..Hα-helixtrans-75.2-41.8173.8-78.8169.5000111.8A286 N287 E288 F292 R293 L294A286-L290 WeakPolarHBondContact O-CG 3.44Å; A286-L290 PolarHBondContact O-N 3.47Å; A286-L290 VanDerWaalsContact O-N 3.12Å; N287-L290 CarbonylContact O-C 3.55Å; N287-L290 WeakPolarHBondContact O-CA 3.46Å; N287-L290 WeakPolarHBondContact O-CB 3.43Å; N287-L290 PolarHBondContact O-N 2.93Å; E288-L290 VanDerWaalsContact C-N 3.33Å; E288-L290 PolarHBondContact O-N 3.47Å; L290-F292 VanDerWaalsContact C-N 3.35Å; L290-R293 PolarHBondContact O-N 3.14Å; L290-L294 WeakPolarHBondContact O-CG 3.48Å; L290-L294 PolarHBondContact O-N 2.98Å
291E82Confident76.4Confident105 Ų105106 Ų10649%0.49155%0.545SS..Hα-helixtrans-62.4-42.2173.7-73.8179.1-165.500111.1N287 E288 R293 L294 L295N287-E291 PolarHBondContact ND2-OE1 3.43Å; N287-E291 PolarHBondContact O-N 2.98Å; E288-E291 PolarHBondContact O-N 3.5Å; E291-R293 PolarHBondContact O-N 2.88Å; E291-L294 PolarHBondContact O-N 3.12Å; E291-L295 WeakPolarHBondContact O-CG 3.37Å; E291-L295 PolarHBondContact O-N 3.07Å
292F80.5Confident74.5Confident123 Ų123105.8 Ų105.854%0.53956%0.56SS.*Hα-helixtrans-58.3-45.7172.4-171.5-94.6000112E288 L290 L294 L295 E296E288-F292 WeakPolarHBondContact O-CB 3.34Å; E288-F292 PolarHBondContact O-N 3.1Å; L290-F292 VanDerWaalsContact C-N 3.35Å; F292-L294 PolarHBondContact O-N 2.68Å; F292-L295 PolarHBondContact O-N 2.82Å; F292-E296 HydrophobicContact CD1-CG 4.22Å; F292-E296 HydrophobicContact CE1-CG 3.96Å; F292-E296 WeakPolarHBondContact CE1-OE1 3.46Å; F292-E296 WeakPolarHBondContact O-CG 3.28Å; F292-E296 PolarHBondContact O-N 3.43Å
293R78.1Confident72.5Confident134 Ų134105 Ų10551%0.50656%0.562SS.*Hα-helixtrans-67.5-31.1175.9-81173.7170148.4-0.1113.9L289 L290 E291 L297L289-R293 WeakPolarHBondContact O-CG 3.44Å; L289-R293 PolarHBondContact O-N 3.06Å; L289-R293 VanDerWaalsContact O-N 3.17Å; L290-R293 PolarHBondContact O-N 3.14Å; E291-R293 PolarHBondContact O-N 2.88Å; R293-L297 WeakPolarHBondContact O-CB 3.5Å; R293-L297 WeakPolarHBondContact O-CD1 3.28Å; R293-L297 VanDerWaalsContact O-CG 3.23Å; R293-L297 WeakPolarHBondContact O-CG 3.49Å; R293-L297 PolarHBondContact O-N 2.93Å
294L74Confident70.5Confident102 Ų102103 Ų10353%0.53456%0.555SS.*Hα-helixtrans-68.8-42.9173.4-74.5169.4000110.6L290 E291 F292 L297 E298L290-L294 WeakPolarHBondContact O-CG 3.48Å; L290-L294 PolarHBondContact O-N 2.98Å; E291-L294 PolarHBondContact O-N 3.12Å; F292-L294 PolarHBondContact O-N 2.68Å; L294-L297 PolarHBondContact O-N 3.15Å; L294-L297 VanDerWaalsContact O-N 3.15Å; L294-E298 WeakPolarHBondContact O-CG 3.48Å; L294-E298 PolarHBondContact O-N 2.7Å
295L74.1Confident68.6Low112 Ų112102.1 Ų102.159%0.58656%0.562SS**Hα-helixtrans-61.3-42.5172.9-74.8161.6000112.1E291 F292 L297 E298 S299E291-L295 WeakPolarHBondContact O-CG 3.37Å; E291-L295 PolarHBondContact O-N 3.07Å; F292-L295 PolarHBondContact O-N 2.82Å; L295-L297 VanDerWaalsContact C-N 3.33Å; L295-L297 PolarHBondContact O-N 3.01Å; L295-E298 PolarHBondContact O-N 2.95Å; L295-S299 WeakPolarHBondContact O-CB 3Å; L295-S299 PolarHBondContact O-N 3.45Å; L295-S299 PolarHBondContact O-OG 2.93Å
296E70.5Confident66.8Low98 Ų98102.3 Ų102.346%0.45856%0.563SS.*Hα-helixtrans-57.8-44.5171.6-74.4-176.5138.300111.6F292 S299F292-E296 HydrophobicContact CD1-CG 4.22Å; F292-E296 HydrophobicContact CE1-CG 3.96Å; F292-E296 WeakPolarHBondContact CE1-OE1 3.46Å; F292-E296 WeakPolarHBondContact O-CG 3.28Å; F292-E296 PolarHBondContact O-N 3.43Å; E296-S299 PolarHBondContact O-N 2.95Å; E296-S299 PolarHBondContact O-OG 3.25Å
297L60.4Low65.1Low99 Ų99104.4 Ų104.452%0.51857%0.571SS.*Hα-helixtrans-69.9-35.2-179.8-74.8168000113.7R293 L294 L295 S299R293-L297 WeakPolarHBondContact O-CB 3.5Å; R293-L297 WeakPolarHBondContact O-CD1 3.28Å; R293-L297 VanDerWaalsContact O-CG 3.23Å; R293-L297 WeakPolarHBondContact O-CG 3.49Å; R293-L297 PolarHBondContact O-N 2.93Å; L294-L297 PolarHBondContact O-N 3.15Å; L294-L297 VanDerWaalsContact O-N 3.15Å; L295-L297 VanDerWaalsContact C-N 3.33Å; L295-L297 PolarHBondContact O-N 3.01Å; L297-S299 VanDerWaalsContact C-N 3.32Å
298E63.1Low63.4Low160 Ų160104 Ų10475%0.74857%0.574SS**Hα-helixtrans-70.3-29.9173.4-73.2-174.716200111.9L294 L295 C300L294-E298 WeakPolarHBondContact O-CG 3.48Å; L294-E298 PolarHBondContact O-N 2.7Å; L295-E298 PolarHBondContact O-N 2.95Å; E298-C300 VanDerWaalsContact C-N 3.27Å; E298-C300 PolarHBondContact O-N 3.47Å
299S57.9Low62Low92 Ų9299.7 Ų99.764%0.64356%0.562SS**THydrogen-bonded Turntrans-75.4-5.3179.177.70000115.3L295 E296 L297L295-S299 WeakPolarHBondContact O-CB 3Å; L295-S299 PolarHBondContact O-N 3.45Å; L295-S299 PolarHBondContact O-OG 2.93Å; E296-S299 PolarHBondContact O-N 2.95Å; E296-S299 PolarHBondContact O-OG 3.25Å; L297-S299 VanDerWaalsContact C-N 3.32Å
300C45.2Very low61.1Low65 Ų65102.1 Ų102.144%0.43957%0.569SS.*  trans-125.889.8-173.4-1570000113.2E298 A302E298-C300 VanDerWaalsContact C-N 3.27Å; E298-C300 PolarHBondContact O-N 3.47Å; C300-A302 PolarHBondContact O-N 2.94Å
301P46.3Very low60.2Low129 Ų129104.8 Ų104.884%0.83858%0.576SS**THydrogen-bonded Turntrans-68.515.2-168-2334.8000118.2
302A49.2Very low59.5Low90 Ų90102.9 Ų102.974%0.74457%0.571SS**THydrogen-bonded Turntrans-123.4-6.9-163.900000116.6C300C300-A302 PolarHBondContact O-N 2.94Å
303V48.9Very low59.3Low98 Ų98101.3 Ų101.359%0.59457%0.569SS**SBendtrans-121.2-14.9-167.2-172.80000114.5
304T45.9Very low59.2Low79 Ų7998.6 Ų98.649%0.48556%0.564SS.*THydrogen-bonded Turntrans-84.4-12.7-170.647.40000115.8S308T304-S308 PolarHBondContact O-OG 2.88Å
305A47Very low59.2Low80 Ų8099.3 Ų99.366%0.66157%0.566SS**Hα-helixtrans-75.1-24.1178.700000114.4S308A305-S308 PolarHBondContact O-OG 3.47Å
306Q50.9Low59.5Low143 Ų14398.8 Ų98.867%0.66856%0.561SS**Hα-helixtrans-91.1-17.6-171.7-140.1-174.852.800114K310Q306-K310 WeakPolarHBondContact O-CG 3.26Å
307T52Low60Low88 Ų88102 Ų10254%0.5457%0.569SS.*Hα-helixtrans-92.6-30.7179.842.30000113.1K311T307-K311 PolarHBondContact O-N 3.17Å
308S51.2Low60.9Low65 Ų65103.3 Ų103.346%0.45557%0.57SS.*Hα-helixtrans-65.1-48.717154.20000111.4T304 A305 K310 K311 V312T304-S308 PolarHBondContact O-OG 2.88Å; A305-S308 PolarHBondContact O-OG 3.47Å; S308-K310 VanDerWaalsContact C-N 3.28Å; S308-K310 PolarHBondContact O-N 3.49Å; S308-K311 PolarHBondContact O-N 2.94Å; S308-V312 PolarHBondContact O-N 3.39Å
309A56.7Low61.6Low46 Ų46100.7 Ų100.738%0.3856%0.561SS.*Hα-helixtrans-56.4-38.517600000112.9V312 N313A309-V312 PolarHBondContact O-N 3.46Å; A309-N313 WeakPolarHBondContact O-CB 3.49Å; A309-N313 PolarHBondContact O-N 3.34Å; A309-N313 PolarHBondContact O-ND2 2.75Å
310K65.7Low62.8Low138 Ų138100.8 Ų100.860%0.656%0.558SS**Hα-helixtrans-67.8-31.6175.3-77.2175.7180171.70113.4Q306 S308 N314Q306-K310 WeakPolarHBondContact O-CG 3.26Å; S308-K310 VanDerWaalsContact C-N 3.28Å; S308-K310 PolarHBondContact O-N 3.49Å; K310-N314 WeakPolarHBondContact O-CB 3.49Å; K310-N314 PolarHBondContact O-N 3.32Å
311K65.4Low64.5Low154 Ų154103.2 Ų103.267%0.6756%0.562SS**Hα-helixtrans-72.7-43.7174.1-78.7-176.6175.9179.10111.6T307 S308 N314 M315T307-K311 PolarHBondContact O-N 3.17Å; S308-K311 PolarHBondContact O-N 2.94Å; K311-N314 WeakPolarHBondContact O-CB 3.36Å; K311-N314 PolarHBondContact O-N 3.11Å; K311-N314 VanDerWaalsContact O-N 3.1Å; K311-M315 WeakPolarHBondContact O-CG 3.34Å; K311-M315 PolarHBondContact O-N 2.92Å
312V67.7Low65.7Low65 Ų65102.1 Ų102.139%0.39455%0.549SS..Hα-helixtrans-59.7-51.5176.6177.30000110.8S308 A309 N314 M315 E316S308-V312 PolarHBondContact O-N 3.39Å; A309-V312 PolarHBondContact O-N 3.46Å; V312-N314 PolarHBondContact O-N 2.95Å; V312-M315 HydrophobicContact CG2-CE 4.35Å; V312-M315 PolarHBondContact O-N 2.87Å; V312-E316 HydrophobicContact CG1-CG 4.31Å; V312-E316 WeakPolarHBondContact O-CG 3.31Å; V312-E316 PolarHBondContact O-N 3.38Å
313N75Confident66.9Low90 Ų90103.8 Ų103.848%0.48154%0.541SS..Hα-helixtrans-60.6-12.6174.9-83-89.3000115A309 E316 R317A309-N313 WeakPolarHBondContact O-CB 3.49Å; A309-N313 PolarHBondContact O-N 3.34Å; A309-N313 PolarHBondContact O-ND2 2.75Å; N313-E316 WeakPolarHBondContact CA-OE2 3.37Å; N313-R317 PolarHBondContact O-NE 3.37Å; N313-R317 PolarHBondContact O-NH2 3Å
314N76.5Confident68.2Low78 Ų78101.4 Ų101.442%0.41753%0.532SS..Hα-helixtrans-92.9-37.3173.5-166.23.4000111K310 K311 V312 K318K310-N314 WeakPolarHBondContact O-CB 3.49Å; K310-N314 PolarHBondContact O-N 3.32Å; K311-N314 WeakPolarHBondContact O-CB 3.36Å; K311-N314 PolarHBondContact O-N 3.11Å; K311-N314 VanDerWaalsContact O-N 3.1Å; V312-N314 PolarHBondContact O-N 2.95Å; N314-K318 WeakPolarHBondContact O-CG 3.49Å; N314-K318 PolarHBondContact O-N 3.5Å
315M73.8Confident69.4Low117 Ų117102.8 Ų102.858%0.57653%0.533SS*.Hα-helixtrans-68.1-41.4173.7-64.9-173.4-58.600111.8K311 V312 K318 L319K311-M315 WeakPolarHBondContact O-CG 3.34Å; K311-M315 PolarHBondContact O-N 2.92Å; V312-M315 HydrophobicContact CG2-CE 4.35Å; V312-M315 PolarHBondContact O-N 2.87Å; M315-K318 PolarHBondContact O-N 3.04Å; M315-L319 PolarHBondContact O-N 2.89Å
316E79.8Confident70.3Confident101 Ų101105.5 Ų105.547%0.47253%0.533SS..Hα-helixtrans-60.9-44.7174.9-69.7167.4150.400111.4V312 N313 K318 L319 V320V312-E316 HydrophobicContact CG1-CG 4.31Å; V312-E316 WeakPolarHBondContact O-CG 3.31Å; V312-E316 PolarHBondContact O-N 3.38Å; N313-E316 WeakPolarHBondContact CA-OE2 3.37Å; E316-K318 VanDerWaalsContact C-N 3.34Å; E316-K318 PolarHBondContact O-N 3.37Å; E316-L319 PolarHBondContact O-N 3.36Å; E316-V320 WeakPolarHBondContact O-CG2 3.38Å; E316-V320 PolarHBondContact O-N 3.48Å
317R81Confident71.2Confident165 Ų165104.8 Ų104.862%0.62353%0.53SS*.Hα-helixtrans-60.9-39.7173.7-86-175.7-71.9157.7-4.4113N313 V320 E321N313-R317 PolarHBondContact O-NE 3.37Å; N313-R317 PolarHBondContact O-NH2 3Å; R317-V320 PolarHBondContact O-N 3.25Å; R317-E321 WeakPolarHBondContact O-CB 3.47Å; R317-E321 PolarHBondContact O-N 3.44Å
318K80.7Confident71.6Confident126 Ų126104.3 Ų104.355%0.54853%0.529SS..Hα-helixtrans-68.6-33.2175.8-76.9-174174.9-166.50113.4N314 M315 E316 L322N314-K318 WeakPolarHBondContact O-CG 3.49Å; N314-K318 PolarHBondContact O-N 3.5Å; M315-K318 PolarHBondContact O-N 3.04Å; E316-K318 VanDerWaalsContact C-N 3.34Å; E316-K318 PolarHBondContact O-N 3.37Å; K318-L322 WeakPolarHBondContact O-CB 3.35Å; K318-L322 WeakPolarHBondContact O-CG 3.47Å; K318-L322 PolarHBondContact O-N 3.41Å
319L77.9Confident72.2Confident106 Ų106104.5 Ų104.556%0.55553%0.531SS*.Hα-helixtrans-65.1-49.9173.1-87.9162.5000110.6M315 E316 E321 L322 E323M315-L319 PolarHBondContact O-N 2.89Å; E316-L319 PolarHBondContact O-N 3.36Å; L319-E321 VanDerWaalsContact C-N 3.29Å; L319-E321 PolarHBondContact O-N 3.01Å; L319-L322 PolarHBondContact O-N 3.03Å; L319-L322 VanDerWaalsContact O-N 3.1Å; L319-E323 WeakPolarHBondContact O-CG 3.47Å; L319-E323 PolarHBondContact O-N 3.31Å
320V81.4Confident72.6Confident94 Ų94108.7 Ų108.757%0.5754%0.542SS*.Hα-helixtrans-59.8-38.5175.8174.20000111.8E316 R317 A324E316-V320 WeakPolarHBondContact O-CG2 3.38Å; E316-V320 PolarHBondContact O-N 3.48Å; R317-V320 PolarHBondContact O-N 3.25Å; V320-A324 WeakPolarHBondContact O-CB 3.42Å; V320-A324 PolarHBondContact O-N 3.41Å
321E80.7Confident72.4Confident116 Ų116107 Ų10754%0.54254%0.539SS..Hα-helixtrans-67-35.6176-170.9173.5-164.300112.6R317 L319 Q325R317-E321 WeakPolarHBondContact O-CB 3.47Å; R317-E321 PolarHBondContact O-N 3.44Å; L319-E321 VanDerWaalsContact C-N 3.29Å; L319-E321 PolarHBondContact O-N 3.01Å; E321-Q325 WeakPolarHBondContact O-CG 3.46Å; E321-Q325 PolarHBondContact O-N 2.95Å; E321-Q325 VanDerWaalsContact O-N 3.09Å
322L71.7Confident73Confident105 Ų105103.5 Ų103.555%0.5553%0.53SS..Hα-helixtrans-73-40.2174.4-77.8167.8000112.5K318 L319 Q325 M326K318-L322 WeakPolarHBondContact O-CB 3.35Å; K318-L322 WeakPolarHBondContact O-CG 3.47Å; K318-L322 PolarHBondContact O-N 3.41Å; L319-L322 PolarHBondContact O-N 3.03Å; L319-L322 VanDerWaalsContact O-N 3.1Å; L322-Q325 PolarHBondContact O-N 3.2Å; L322-M326 PolarHBondContact O-N 3.28Å
323E75.4Confident73.3Confident126 Ų126105.7 Ų105.759%0.58954%0.539SS*.Hα-helixtrans-60.4-46.4173.7-73.3176.7152.300110.7L319 Q325 M326 E327L319-E323 WeakPolarHBondContact O-CG 3.47Å; L319-E323 PolarHBondContact O-N 3.31Å; E323-Q325 VanDerWaalsContact C-N 3.33Å; E323-Q325 PolarHBondContact O-N 3.42Å; E323-M326 PolarHBondContact O-N 3.44Å; E323-M326 VanDerWaalsContact O-N 3.15Å; E323-E327 PolarHBondContact O-N 2.85Å
324A76Confident73.4Confident47 Ų47105.9 Ų105.939%0.38854%0.54SS..Hα-helixtrans-62.3-35.3174.900000113.2V320 C328V320-A324 WeakPolarHBondContact O-CB 3.42Å; V320-A324 PolarHBondContact O-N 3.41Å; A324-C328 WeakPolarHBondContact O-CB 3.3Å; A324-C328 PolarHBondContact O-N 3.49Å; A324-C328 PolarHBondContact O-SG 3.47Å; A324-C328 VanDerWaalsContact O-SG 3.33Å
325Q70.2Confident73.6Confident108 Ų108105.3 Ų105.351%0.50554%0.539SS..Hα-helixtrans-68.8-36173.7-77.8179.621.900112.8E321 L322 E323 S329E321-Q325 WeakPolarHBondContact O-CG 3.46Å; E321-Q325 PolarHBondContact O-N 2.95Å; E321-Q325 VanDerWaalsContact O-N 3.09Å; L322-Q325 PolarHBondContact O-N 3.2Å; E323-Q325 VanDerWaalsContact C-N 3.33Å; E323-Q325 PolarHBondContact O-N 3.42Å; Q325-S329 WeakPolarHBondContact O-CB 3.36Å; Q325-S329 PolarHBondContact O-N 3.31Å; Q325-S329 VanDerWaalsContact O-N 3.12Å; Q325-S329 PolarHBondContact O-OG 2.72Å
326M66.3Low73.9Confident137 Ų137104.8 Ų104.868%0.67553%0.534SS*.Hα-helixtrans-66.4-45.9173.4-78-178.149.400111.5L322 E323 C328 S329 E330L322-M326 PolarHBondContact O-N 3.28Å; E323-M326 PolarHBondContact O-N 3.44Å; E323-M326 VanDerWaalsContact O-N 3.15Å; M326-C328 PolarHBondContact O-N 3.03Å; M326-S329 CarbonylContact O-C 3.57Å; M326-S329 WeakPolarHBondContact O-CA 3.43Å; M326-S329 WeakPolarHBondContact O-CB 3.35Å; M326-S329 PolarHBondContact O-N 3.28Å; M326-E330 PolarHBondContact O-N 3.38Å
327E69.7Low74Confident128 Ų128102.5 Ų102.560%0.59853%0.526SS*.Hα-helixtrans-61.1-43.5178.2-167173.4-161.900111.6E323 S329 E330 I331E323-E327 PolarHBondContact O-N 2.85Å; E327-S329 VanDerWaalsContact C-N 3.25Å; E327-S329 PolarHBondContact O-N 3.17Å; E327-E330 PolarHBondContact O-N 3.05Å; E327-I331 HydrophobicContact CG-CD1 4.43Å; E327-I331 VanDerWaalsContact O-CG1 3.3Å; E327-I331 WeakPolarHBondContact O-CG1 3.43Å; E327-I331 PolarHBondContact O-N 2.95Å
328C60.4Low74.3Confident78 Ų78100.8 Ų100.853%0.52753%0.526SS..Hα-helixtrans-59.1-33.6170.7-770000113.6A324 M326 T332A324-C328 WeakPolarHBondContact O-CB 3.3Å; A324-C328 PolarHBondContact O-N 3.49Å; A324-C328 PolarHBondContact O-SG 3.47Å; A324-C328 VanDerWaalsContact O-SG 3.33Å; M326-C328 PolarHBondContact O-N 3.03Å; C328-T332 PolarHBondContact O-N 2.77Å; C328-T332 PolarHBondContact O-OG1 3.41Å
329S64.2Low74.3Confident69 Ų6998.8 Ų98.848%0.48352%0.518SS..Hα-helixtrans-75.2-37.6178.5-59.10000111.8Q325 M326 E327 T332 I333Q325-S329 WeakPolarHBondContact O-CB 3.36Å; Q325-S329 PolarHBondContact O-N 3.31Å; Q325-S329 VanDerWaalsContact O-N 3.12Å; Q325-S329 PolarHBondContact O-OG 2.72Å; M326-S329 CarbonylContact O-C 3.57Å; M326-S329 WeakPolarHBondContact O-CA 3.43Å; M326-S329 WeakPolarHBondContact O-CB 3.35Å; M326-S329 PolarHBondContact O-N 3.28Å; E327-S329 VanDerWaalsContact C-N 3.25Å; E327-S329 PolarHBondContact O-N 3.17Å; S329-T332 WeakPolarHBondContact O-CB 3.37Å; S329-T332 PolarHBondContact O-N 2.75Å; S329-I333 WeakPolarHBondContact O-CG1 3.46Å; S329-I333 PolarHBondContact O-N 2.91Å
330E64.6Low74.5Confident135 Ų13597.8 Ų97.863%0.63152%0.519SS*.Hα-helixtrans-66.1-44.8175.1-169.6163.2-158.800111.3M326 E327 T332 I333 D334M326-E330 PolarHBondContact O-N 3.38Å; E327-E330 PolarHBondContact O-N 3.05Å; E330-T332 PolarHBondContact O-N 3.04Å; E330-I333 PolarHBondContact O-N 3.06Å; E330-D334 PolarHBondContact O-N 3.33Å
331I62.8Low74.9Confident102 Ų102101.3 Ų101.352%0.52352%0.522SS..Hα-helixtrans-55.4-36.9170.5-67.2165000111.3E327 T335E327-I331 HydrophobicContact CG-CD1 4.43Å; E327-I331 VanDerWaalsContact O-CG1 3.3Å; E327-I331 WeakPolarHBondContact O-CG1 3.43Å; E327-I331 PolarHBondContact O-N 2.95Å; I331-T335 WeakPolarHBondContact O-CB 3.47Å; I331-T335 PolarHBondContact O-N 3.42Å; I331-T335 PolarHBondContact O-OG1 2.92Å
332T77.1Confident75.1Confident80 Ų8097.6 Ų97.649%0.49151%0.512SS..Hα-helixtrans-69.3-40.5177-58.90000111.9C328 S329 E330 T335 K336C328-T332 PolarHBondContact O-N 2.77Å; C328-T332 PolarHBondContact O-OG1 3.41Å; S329-T332 WeakPolarHBondContact O-CB 3.37Å; S329-T332 PolarHBondContact O-N 2.75Å; E330-T332 PolarHBondContact O-N 3.04Å; T332-T335 PolarHBondContact O-N 3.32Å; T332-K336 WeakPolarHBondContact O-CG 3.44Å; T332-K336 PolarHBondContact O-N 3.45Å
333I74.7Confident75.7Confident111 Ų11198.1 Ų98.157%0.56951%0.514SS*.Hα-helixtrans-63.9-47.7175.5-68.6168.2000110.4S329 E330 T335 K336 V337S329-I333 WeakPolarHBondContact O-CG1 3.46Å; S329-I333 PolarHBondContact O-N 2.91Å; E330-I333 PolarHBondContact O-N 3.06Å; I333-T335 VanDerWaalsContact C-N 3.32Å; I333-T335 PolarHBondContact O-N 3.24Å; I333-K336 CarbonylContact O-C 3.59Å; I333-K336 WeakPolarHBondContact O-CA 3.47Å; I333-K336 PolarHBondContact O-N 3.09Å; I333-V337 HydrophobicContact CG2-CG2 4.36Å; I333-V337 WeakPolarHBondContact O-CG2 3.4Å; I333-V337 PolarHBondContact O-N 3.1Å
334D77.5Confident76.4Confident94 Ų9498.7 Ų98.750%0.50352%0.515SS..Hα-helixtrans-61.7-40.8179-103.1-10.2000112.1E330 K336 V337 Q338E330-D334 PolarHBondContact O-N 3.33Å; D334-K336 VanDerWaalsContact C-N 3.31Å; D334-K336 PolarHBondContact O-N 3.06Å; D334-V337 PolarHBondContact O-N 3.28Å; D334-Q338 WeakPolarHBondContact O-CG 3.33Å; D334-Q338 PolarHBondContact O-N 3.42Å
335T80.9Confident76.9Confident66 Ų66103.7 Ų103.741%0.40552%0.523SS..Hα-helixtrans-57.5-44.7172.3-57.70000111I331 T332 I333 Q338 E339I331-T335 WeakPolarHBondContact O-CB 3.47Å; I331-T335 PolarHBondContact O-N 3.42Å; I331-T335 PolarHBondContact O-OG1 2.92Å; T332-T335 PolarHBondContact O-N 3.32Å; I333-T335 VanDerWaalsContact C-N 3.32Å; I333-T335 PolarHBondContact O-N 3.24Å; T335-Q338 PolarHBondContact O-N 3.25Å; T335-E339 WeakPolarHBondContact O-CG 3.37Å; T335-E339 PolarHBondContact O-N 2.86Å
336K78.1Confident77.6Confident106 Ų106101.7 Ų101.746%0.46152%0.519SS..Hα-helixtrans-69.2-33.3177.2-67.5-69.3166-135.30113.3T332 I333 D334 E339 C340T332-K336 WeakPolarHBondContact O-CG 3.44Å; T332-K336 PolarHBondContact O-N 3.45Å; I333-K336 CarbonylContact O-C 3.59Å; I333-K336 WeakPolarHBondContact O-CA 3.47Å; I333-K336 PolarHBondContact O-N 3.09Å; D334-K336 VanDerWaalsContact C-N 3.31Å; D334-K336 PolarHBondContact O-N 3.06Å; K336-E339 WeakPolarHBondContact CD-OE2 3.31Å; K336-E339 IonicContact NZ-OE1 2.61Å; K336-E339 PolarHBondContact NZ-OE1 2.77Å; K336-E339 IonicContact NZ-OE2 2.71Å; K336-E339 PolarHBondContact NZ-OE2 2.92Å; K336-E339 PolarHBondContact O-N 3.16Å; K336-C340 WeakPolarHBondContact O-CB 3.27Å; K336-C340 PolarHBondContact O-N 3.38Å; K336-C340 PolarHBondContact O-SG 2.85Å; K336-C340 VanDerWaalsContact O-SG 3.39Å
337V83.7Confident78.4Confident53 Ų5398.5 Ų98.532%0.32151%0.507SS..Hα-helixtrans-65.6-40.2171.6171.10000110.6I333 D334 C340 R341I333-V337 HydrophobicContact CG2-CG2 4.36Å; I333-V337 WeakPolarHBondContact O-CG2 3.4Å; I333-V337 PolarHBondContact O-N 3.1Å; D334-V337 PolarHBondContact O-N 3.28Å; V337-C340 PolarHBondContact O-N 2.97Å; V337-R341 VanDerWaalsContact O-CG 3.3Å; V337-R341 WeakPolarHBondContact O-CG 3.48Å; V337-R341 PolarHBondContact O-N 2.8Å
338Q85.9Confident79.3Confident130 Ų13095.9 Ų95.961%0.60750%0.497SS*.Hα-helixtrans-66.2-43.2174.7-69.6-175.331.300112.3D334 T335 C340 R341 A342D334-Q338 WeakPolarHBondContact O-CG 3.33Å; D334-Q338 PolarHBondContact O-N 3.42Å; T335-Q338 PolarHBondContact O-N 3.25Å; Q338-C340 PolarHBondContact O-N 3.45Å; Q338-R341 CarbonylContact O-C 3.52Å; Q338-R341 PolarHBondContact O-N 2.61Å; Q338-A342 PolarHBondContact O-N 3.14Å
339E81.7Confident80.6Confident83 Ų8397.6 Ų97.639%0.38850%0.497SS..Hα-helixtrans-56.3-48.2171.8-76174-147.400111.5T335 K336 R341 A342 L343T335-E339 WeakPolarHBondContact O-CG 3.37Å; T335-E339 PolarHBondContact O-N 2.86Å; K336-E339 WeakPolarHBondContact CD-OE2 3.31Å; K336-E339 IonicContact NZ-OE1 2.61Å; K336-E339 PolarHBondContact NZ-OE1 2.77Å; K336-E339 IonicContact NZ-OE2 2.71Å; K336-E339 PolarHBondContact NZ-OE2 2.92Å; K336-E339 PolarHBondContact O-N 3.16Å; E339-R341 VanDerWaalsContact C-N 3.34Å; E339-R341 PolarHBondContact O-N 3.4Å; E339-A342 WeakPolarHBondContact O-CB 3.5Å; E339-A342 PolarHBondContact O-N 3.34Å; E339-A342 VanDerWaalsContact O-N 3.1Å; E339-L343 WeakPolarHBondContact O-CG 3.41Å; E339-L343 PolarHBondContact O-N 3.06Å
340C81.6Confident81.5Confident86 Ų8699 Ų9958%0.58150%0.499SS*.Hα-helixtrans-61-38.7175.9-77.10000112.8K336 V337 Q338 A342 K344K336-C340 WeakPolarHBondContact O-CB 3.27Å; K336-C340 PolarHBondContact O-N 3.38Å; K336-C340 PolarHBondContact O-SG 2.85Å; K336-C340 VanDerWaalsContact O-SG 3.39Å; V337-C340 PolarHBondContact O-N 2.97Å; Q338-C340 PolarHBondContact O-N 3.45Å; C340-A342 VanDerWaalsContact C-N 3.33Å; C340-K344 WeakPolarHBondContact O-CB 3.42Å; C340-K344 PolarHBondContact O-N 3.28Å
341R89.2Confident82.5Confident168 Ų16899.9 Ų99.963%0.63450%0.496SS*.Hα-helixtrans-69.2-28.2174.1-71.6176.2-170.2-169.37.6112.8V337 Q338 E339 R345V337-R341 VanDerWaalsContact O-CG 3.3Å; V337-R341 WeakPolarHBondContact O-CG 3.48Å; V337-R341 PolarHBondContact O-N 2.8Å; Q338-R341 CarbonylContact O-C 3.52Å; Q338-R341 PolarHBondContact O-N 2.61Å; E339-R341 VanDerWaalsContact C-N 3.34Å; E339-R341 PolarHBondContact O-N 3.4Å; R341-R345 PolarHBondContact O-NE 3.21Å
342A84.9Confident83.6Confident38 Ų3898 Ų9831%0.31450%0.495SS..Hα-helixtrans-74.1-51.1173.200000110.9Q338 E339 C340 K344 R345 T346Q338-A342 PolarHBondContact O-N 3.14Å; E339-A342 WeakPolarHBondContact O-CB 3.5Å; E339-A342 PolarHBondContact O-N 3.34Å; E339-A342 VanDerWaalsContact O-N 3.1Å; C340-A342 VanDerWaalsContact C-N 3.33Å; A342-K344 VanDerWaalsContact C-N 3.27Å; A342-K344 PolarHBondContact O-N 3.49Å; A342-R345 WeakPolarHBondContact O-CB 3.25Å; A342-R345 PolarHBondContact O-N 3Å; A342-T346 PolarHBondContact O-N 3.38Å; A342-T346 VanDerWaalsContact O-N 3.09Å; A342-T346 PolarHBondContact O-OG1 3.14Å
343L84.7Confident83.9Confident115 Ų11599.8 Ų99.860%0.60250%0.498SS*.Hα-helixtrans-56.5-39.7176-72.2172000112.3E339 R345 T346 V347E339-L343 WeakPolarHBondContact O-CG 3.41Å; E339-L343 PolarHBondContact O-N 3.06Å; L343-R345 PolarHBondContact O-N 3.07Å; L343-T346 PolarHBondContact O-N 3.31Å; L343-V347 WeakPolarHBondContact O-CG2 3.38Å; L343-V347 PolarHBondContact O-N 2.91Å
344K89.4Confident84.2Confident138 Ų13898.7 Ų98.760%0.649%0.491SS*.Hα-helixtrans-59.8-44.6175.1-174.9175.8178.6-178.10112.4C340 A342 V347 D348C340-K344 WeakPolarHBondContact O-CB 3.42Å; C340-K344 PolarHBondContact O-N 3.28Å; A342-K344 VanDerWaalsContact C-N 3.27Å; A342-K344 PolarHBondContact O-N 3.49Å; K344-V347 PolarHBondContact O-N 2.97Å; K344-D348 PolarHBondContact O-N 3.44Å
345R88.4Confident84.8Confident152 Ų152101.1 Ų101.157%0.57450%0.497SS*.Hα-helixtrans-60.1-46.9176.1-77.6174.8-80.8150.1-9.9111.2R341 A342 L343 V347 D348 E349R341-R345 PolarHBondContact O-NE 3.21Å; A342-R345 WeakPolarHBondContact O-CB 3.25Å; A342-R345 PolarHBondContact O-N 3Å; L343-R345 PolarHBondContact O-N 3.07Å; R345-V347 VanDerWaalsContact C-N 3.33Å; R345-V347 PolarHBondContact O-N 3.08Å; R345-D348 PolarHBondContact O-N 3.15Å; R345-E349 WeakPolarHBondContact O-CG 3.19Å; R345-E349 PolarHBondContact O-N 3.38Å
346T85Confident85Confident67 Ų67102.5 Ų102.541%0.41150%0.499SS..Hα-helixtrans-61.2-38.1176.2-52.10000112.7A342 L343 E349 L350A342-T346 PolarHBondContact O-N 3.38Å; A342-T346 VanDerWaalsContact O-N 3.09Å; A342-T346 PolarHBondContact O-OG1 3.14Å; L343-T346 PolarHBondContact O-N 3.31Å; T346-E349 PolarHBondContact O-N 3.08Å; T346-L350 HydrophobicContact CG2-CD1 4.2Å; T346-L350 WeakPolarHBondContact O-CB 3.44Å; T346-L350 VanDerWaalsContact O-CG 3.25Å; T346-L350 WeakPolarHBondContact O-CG 3.49Å; T346-L350 PolarHBondContact O-N 3.45Å
347V82.1Confident85.3Confident70 Ų70102.4 Ų102.442%0.42450%0.503SS..Hα-helixtrans-66.2-40.4175.2168.10000111.9L343 K344 R345 L350 R351L343-V347 WeakPolarHBondContact O-CG2 3.38Å; L343-V347 PolarHBondContact O-N 2.91Å; K344-V347 PolarHBondContact O-N 2.97Å; R345-V347 VanDerWaalsContact C-N 3.33Å; R345-V347 PolarHBondContact O-N 3.08Å; V347-L350 PolarHBondContact O-N 3.37Å; V347-R351 VanDerWaalsContact O-CG 3.31Å; V347-R351 WeakPolarHBondContact O-CG 3.38Å; V347-R351 PolarHBondContact O-N 2.93Å
348D87.8Confident85.4Confident73 Ų73106.8 Ų106.839%0.3951%0.514SS..Hα-helixtrans-71.5-34.4178.2-69.2-31.2000111.7K344 R345 R351 A352K344-D348 PolarHBondContact O-N 3.44Å; R345-D348 PolarHBondContact O-N 3.15Å; D348-R351 PolarHBondContact O-N 3Å; D348-R351 IonicContact OD1-NH1 2.92Å; D348-R351 PolarHBondContact OD1-NH1 3.49Å; D348-A352 PolarHBondContact O-N 3.07Å; D348-A352 VanDerWaalsContact O-N 3.07Å
349E87.8Confident85.4Confident114 Ų114104.1 Ų104.153%0.53350%0.503SS..Hα-helixtrans-62.6-47.7169.4-73.7163.2-168.800112.1R345 T346 R351 A352 Q353R345-E349 WeakPolarHBondContact O-CG 3.19Å; R345-E349 PolarHBondContact O-N 3.38Å; T346-E349 PolarHBondContact O-N 3.08Å; E349-R351 VanDerWaalsContact C-N 3.31Å; E349-R351 PolarHBondContact O-N 3.12Å; E349-A352 WeakPolarHBondContact O-CB 3.42Å; E349-A352 PolarHBondContact O-N 3.41Å; E349-A352 VanDerWaalsContact O-N 3.12Å; E349-Q353 PolarHBondContact O-N 2.99Å
350L84Confident85.5Confident97 Ų97104.3 Ų104.351%0.50850%0.504SS..Hα-helixtrans-62.4-37176.7-73.8170.3000112T346 V347 A352 Q353 E354T346-L350 HydrophobicContact CG2-CD1 4.2Å; T346-L350 WeakPolarHBondContact O-CB 3.44Å; T346-L350 VanDerWaalsContact O-CG 3.25Å; T346-L350 WeakPolarHBondContact O-CG 3.49Å; T346-L350 PolarHBondContact O-N 3.45Å; V347-L350 PolarHBondContact O-N 3.37Å; L350-A352 VanDerWaalsContact C-N 3.34Å; L350-Q353 PolarHBondContact O-N 3.48Å; L350-E354 WeakPolarHBondContact O-CB 3.46Å; L350-E354 PolarHBondContact O-N 3.42Å
351R85.1Confident85.6Confident155 Ų155106.6 Ų106.659%0.58551%0.508SS*.Hα-helixtrans-64.9-36172.9-77.8169.5167.9177.7-5.3112.9V347 D348 E349 K355V347-R351 VanDerWaalsContact O-CG 3.31Å; V347-R351 WeakPolarHBondContact O-CG 3.38Å; V347-R351 PolarHBondContact O-N 2.93Å; D348-R351 PolarHBondContact O-N 3Å; D348-R351 IonicContact OD1-NH1 2.92Å; D348-R351 PolarHBondContact OD1-NH1 3.49Å; E349-R351 VanDerWaalsContact C-N 3.31Å; E349-R351 PolarHBondContact O-N 3.12Å; R351-K355 WeakPolarHBondContact O-CB 3.48Å; R351-K355 PolarHBondContact O-N 3.15Å; R351-K355 VanDerWaalsContact O-N 3.09Å
352A86Confident85.5Confident61 Ų61104.6 Ų104.650%0.50450%0.504SS..Hα-helixtrans-66.6-44.8174.400000111.2D348 E349 L350 K355 E356D348-A352 PolarHBondContact O-N 3.07Å; D348-A352 VanDerWaalsContact O-N 3.07Å; E349-A352 WeakPolarHBondContact O-CB 3.42Å; E349-A352 PolarHBondContact O-N 3.41Å; E349-A352 VanDerWaalsContact O-N 3.12Å; L350-A352 VanDerWaalsContact C-N 3.34Å; A352-K355 PolarHBondContact O-N 2.9Å; A352-E356 PolarHBondContact O-N 2.64Å
353Q83.5Confident85.5Confident118 Ų118108 Ų10855%0.55152%0.517SS*.Hα-helixtrans-62.1-42.6174.6-68.2177.42.300112.3E349 L350 K355 E356 L357E349-Q353 PolarHBondContact O-N 2.99Å; L350-Q353 PolarHBondContact O-N 3.48Å; Q353-K355 VanDerWaalsContact C-N 3.32Å; Q353-K355 PolarHBondContact O-N 2.77Å; Q353-E356 PolarHBondContact O-N 2.91Å; Q353-L357 WeakPolarHBondContact O-CG 3.5Å; Q353-L357 PolarHBondContact O-N 3.4Å
354E81.5Confident85.5Confident89 Ų89108.1 Ų108.142%0.41652%0.517SS..Hα-helixtrans-61.6-39.9177.2-166.3-165.7-170.200111.8L350 R358L350-E354 WeakPolarHBondContact O-CB 3.46Å; L350-E354 PolarHBondContact O-N 3.42Å; E354-R358 WeakPolarHBondContact O-CG 3.39Å; E354-R358 PolarHBondContact O-N 3.36Å; E354-R358 IonicContact OE1-CZ 3.84Å; E354-R358 IonicContact OE1-NH1 2.66Å; E354-R358 PolarHBondContact OE1-NH1 3.29Å; E354-R358 IonicContact OE1-NH2 3.12Å; E354-R358 PolarHBondContact OE1-NH2 2.96Å; E354-R358 IonicContact OE2-CZ 2.77Å; E354-R358 IonicContact OE2-NH2 2.77Å; E354-R358 PolarHBondContact OE2-NH2 2.9Å
355K89.2Confident85.3Confident145 Ų145106.7 Ų106.763%0.6351%0.513SS*.Hα-helixtrans-65.5-41.5175.5-173-177.7178.5-173.20111.9R351 A352 Q353 R358 N359R351-K355 WeakPolarHBondContact O-CB 3.48Å; R351-K355 PolarHBondContact O-N 3.15Å; R351-K355 VanDerWaalsContact O-N 3.09Å; A352-K355 PolarHBondContact O-N 2.9Å; Q353-K355 VanDerWaalsContact C-N 3.32Å; Q353-K355 PolarHBondContact O-N 2.77Å; K355-R358 PolarHBondContact O-N 3.02Å; K355-N359 PolarHBondContact O-N 3.48Å; K355-N359 VanDerWaalsContact O-N 3.16Å; K355-N359 PolarHBondContact O-ND2 3.36Å
356E85.5Confident85.2Confident94 Ų94103 Ų10344%0.43950%0.504SS..Hα-helixtrans-65.3-47.6177.6-18053.9-154.500111.6A352 Q353 R358 N359 Q360A352-E356 PolarHBondContact O-N 2.64Å; Q353-E356 PolarHBondContact O-N 2.91Å; E356-R358 VanDerWaalsContact C-N 3.29Å; E356-R358 PolarHBondContact O-N 3.45Å; E356-N359 WeakPolarHBondContact O-CB 3.42Å; E356-N359 PolarHBondContact O-N 2.82Å; E356-Q360 WeakPolarHBondContact O-CG 3.47Å; E356-Q360 PolarHBondContact O-N 3.42Å; E356-Q360 PolarHBondContact OE1-NE2 3.44Å
357L83.9Confident85.2Confident104 Ų104105.7 Ų105.755%0.54551%0.51SS..Hα-helixtrans-59.2-38.2175-72171.6000112.3Q353 N359 Q360 M361Q353-L357 WeakPolarHBondContact O-CG 3.5Å; Q353-L357 PolarHBondContact O-N 3.4Å; L357-N359 VanDerWaalsContact C-N 3.35Å; L357-N359 PolarHBondContact O-N 3Å; L357-Q360 PolarHBondContact O-N 2.93Å; L357-M361 WeakPolarHBondContact O-CB 3.29Å; L357-M361 WeakPolarHBondContact O-CG 3.42Å; L357-M361 PolarHBondContact O-N 2.98Å
358R85.7Confident85.1Confident145 Ų145105.4 Ų105.455%0.54751%0.512SS..Hα-helixtrans-63.9-36.1174.2-80-160.7-102.4-91.311.9113.2E354 K355 E356 K362E354-R358 WeakPolarHBondContact O-CG 3.39Å; E354-R358 PolarHBondContact O-N 3.36Å; E354-R358 IonicContact OE1-CZ 3.84Å; E354-R358 IonicContact OE1-NH1 2.66Å; E354-R358 PolarHBondContact OE1-NH1 3.29Å; E354-R358 IonicContact OE1-NH2 3.12Å; E354-R358 PolarHBondContact OE1-NH2 2.96Å; E354-R358 IonicContact OE2-CZ 2.77Å; E354-R358 IonicContact OE2-NH2 2.77Å; E354-R358 PolarHBondContact OE2-NH2 2.9Å; K355-R358 PolarHBondContact O-N 3.02Å; E356-R358 VanDerWaalsContact C-N 3.29Å; E356-R358 PolarHBondContact O-N 3.45Å; R358-K362 PolarHBondContact O-N 3.44Å
359N85.9Confident85.2Confident74 Ų74106.8 Ų106.840%0.39651%0.514SS..Hα-helixtrans-66.3-48.7173.7-64.9-26.7000110.5K355 E356 L357 M361 K362 D363K355-N359 PolarHBondContact O-N 3.48Å; K355-N359 VanDerWaalsContact O-N 3.16Å; K355-N359 PolarHBondContact O-ND2 3.36Å; E356-N359 WeakPolarHBondContact O-CB 3.42Å; E356-N359 PolarHBondContact O-N 2.82Å; L357-N359 VanDerWaalsContact C-N 3.35Å; L357-N359 PolarHBondContact O-N 3Å; N359-M361 VanDerWaalsContact C-N 3.33Å; N359-M361 PolarHBondContact O-N 2.95Å; N359-K362 WeakPolarHBondContact O-CB 3.34Å; N359-K362 PolarHBondContact O-N 2.89Å; N359-D363 PolarHBondContact O-N 3.23Å
360Q85Confident85.2Confident87 Ų87105.3 Ų105.341%0.40751%0.509SS..Hα-helixtrans-60.7-40179.4-6617711.500112.4E356 L357 K362 D363 I364E356-Q360 WeakPolarHBondContact O-CG 3.47Å; E356-Q360 PolarHBondContact O-N 3.42Å; E356-Q360 PolarHBondContact OE1-NE2 3.44Å; L357-Q360 PolarHBondContact O-N 2.93Å; Q360-K362 VanDerWaalsContact C-N 3.31Å; Q360-K362 PolarHBondContact O-N 3.37Å; Q360-D363 PolarHBondContact O-N 2.86Å; Q360-I364 WeakPolarHBondContact O-CD1 3.44Å; Q360-I364 VanDerWaalsContact O-CG1 3.26Å; Q360-I364 WeakPolarHBondContact O-CG1 3.46Å; Q360-I364 PolarHBondContact O-N 3.11Å
361M82.1Confident85.1Confident134 Ų134104.8 Ų104.866%0.6651%0.506SS*.Hα-helixtrans-59.9-40.8173.1-77-175.570.900112.3L357 N359 I364 E365L357-M361 WeakPolarHBondContact O-CB 3.29Å; L357-M361 WeakPolarHBondContact O-CG 3.42Å; L357-M361 PolarHBondContact O-N 2.98Å; N359-M361 VanDerWaalsContact C-N 3.33Å; N359-M361 PolarHBondContact O-N 2.95Å; M361-I364 PolarHBondContact O-N 3.45Å; M361-E365 WeakPolarHBondContact O-CB 3.38Å; M361-E365 PolarHBondContact O-N 3.24Å
362K88.5Confident85Confident127 Ų127101.5 Ų101.555%0.55250%0.504SS*.Hα-helixtrans-66-44.1177.7-173.4-174.2174.1-169.30111.7R358 N359 Q360 I364 E365 D366R358-K362 PolarHBondContact O-N 3.44Å; N359-K362 WeakPolarHBondContact O-CB 3.34Å; N359-K362 PolarHBondContact O-N 2.89Å; Q360-K362 VanDerWaalsContact C-N 3.31Å; Q360-K362 PolarHBondContact O-N 3.37Å; K362-I364 VanDerWaalsContact C-N 3.3Å; K362-I364 PolarHBondContact O-N 3.25Å; K362-E365 WeakPolarHBondContact O-CB 3.37Å; K362-E365 PolarHBondContact O-N 3.37Å; K362-E365 VanDerWaalsContact O-N 3.15Å; K362-D366 PolarHBondContact O-N 2.95Å
363D85.2Confident85Confident108 Ų108105.7 Ų105.758%0.57851%0.511SS*.Hα-helixtrans-62-38.7177-67.4-20.7000111.6N359 Q360 F367N359-D363 PolarHBondContact O-N 3.23Å; Q360-D363 PolarHBondContact O-N 2.86Å; D363-F367 VanDerWaalsContact O-CB 3.28Å; D363-F367 WeakPolarHBondContact O-CB 3.47Å; D363-F367 PolarHBondContact O-N 3.18Å
364I83.2Confident85.1Confident119 Ų119105.8 Ų105.861%0.6151%0.509SS*.Hα-helixtrans-65.4-41.5173.4-69.1165.3000111.4Q360 M361 K362 F367 S368Q360-I364 WeakPolarHBondContact O-CD1 3.44Å; Q360-I364 VanDerWaalsContact O-CG1 3.26Å; Q360-I364 WeakPolarHBondContact O-CG1 3.46Å; Q360-I364 PolarHBondContact O-N 3.11Å; M361-I364 PolarHBondContact O-N 3.45Å; K362-I364 VanDerWaalsContact C-N 3.3Å; K362-I364 PolarHBondContact O-N 3.25Å; I364-F367 PolarHBondContact O-N 3.32Å; I364-S368 WeakPolarHBondContact O-CB 3.39Å; I364-S368 PolarHBondContact O-N 3.28Å
365E85.1Confident85Confident108 Ų108107 Ų10751%0.50552%0.518SS..Hα-helixtrans-64.1-44178.1-158.7-162.9131.200111.5M361 K362 S368 K369M361-E365 WeakPolarHBondContact O-CB 3.38Å; M361-E365 PolarHBondContact O-N 3.24Å; K362-E365 WeakPolarHBondContact O-CB 3.37Å; K362-E365 PolarHBondContact O-N 3.37Å; K362-E365 VanDerWaalsContact O-N 3.15Å; E365-S368 WeakPolarHBondContact O-CB 3.29Å; E365-S368 PolarHBondContact O-N 3.48Å; E365-K369 WeakPolarHBondContact O-CG 3.41Å; E365-K369 PolarHBondContact O-N 2.94Å; E365-K369 WeakPolarHBondContact OE1-CE 3.24Å; E365-K369 IonicContact OE1-NZ 3.75Å; E365-K369 PolarHBondContact OE1-NZ 2.97Å
366D87.7Confident84.9Confident73 Ų73108 Ų10839%0.3952%0.522SS..Hα-helixtrans-70.7-34.8178.5-71.3-18.1000111.9K362 K369 L370K362-D366 PolarHBondContact O-N 2.95Å; D366-K369 PolarHBondContact O-N 3.25Å; D366-K369 IonicContact OD1-NZ 3.62Å; D366-K369 PolarHBondContact OD1-NZ 2.88Å; D366-L370 PolarHBondContact O-N 2.92Å
367F85.1Confident84.9Confident125 Ų125106.9 Ų106.955%0.54852%0.52SS..Hα-helixtrans-63.8-40.1169.1-176.4-107.7000112.5D363 I364 L370 L371D363-F367 VanDerWaalsContact O-CB 3.28Å; D363-F367 WeakPolarHBondContact O-CB 3.47Å; D363-F367 PolarHBondContact O-N 3.18Å; I364-F367 PolarHBondContact O-N 3.32Å; F367-L370 PolarHBondContact O-N 2.99Å; F367-L371 HydrophobicContact CD1-CD1 3.85Å; F367-L371 HydrophobicContact CD1-CG 4.36Å; F367-L371 HydrophobicContact CE1-CD1 3.38Å; F367-L371 HydrophobicContact CE1-CG 4Å; F367-L371 HydrophobicContact CZ-CD1 3.91Å; F367-L371 HydrophobicContact CZ-CD2 4.36Å; F367-L371 HydrophobicContact CZ-CG 4.11Å; F367-L371 PolarHBondContact O-N 2.92Å
368S80.2Confident84.8Confident64 Ų64105.9 Ų105.945%0.44852%0.518SS..Hα-helixtrans-64-41.9175.9-175.70000112.2I364 E365 L370 L371 T372I364-S368 WeakPolarHBondContact O-CB 3.39Å; I364-S368 PolarHBondContact O-N 3.28Å; E365-S368 WeakPolarHBondContact O-CB 3.29Å; E365-S368 PolarHBondContact O-N 3.48Å; S368-L370 PolarHBondContact O-N 3.26Å; S368-L371 PolarHBondContact O-N 3.46Å; S368-T372 WeakPolarHBondContact O-CB 3.45Å; S368-T372 PolarHBondContact O-N 3.38Å; S368-T372 PolarHBondContact O-OG1 3.28Å
369K90Very high84.4Confident101 Ų101102.3 Ų102.344%0.43951%0.512SS..Hα-helixtrans-60.2-44.6172.2-68.6165.9-163.21540111.5E365 D366 T372 F373E365-K369 WeakPolarHBondContact O-CG 3.41Å; E365-K369 PolarHBondContact O-N 2.94Å; E365-K369 WeakPolarHBondContact OE1-CE 3.24Å; E365-K369 IonicContact OE1-NZ 3.75Å; E365-K369 PolarHBondContact OE1-NZ 2.97Å; D366-K369 PolarHBondContact O-N 3.25Å; D366-K369 IonicContact OD1-NZ 3.62Å; D366-K369 PolarHBondContact OD1-NZ 2.88Å; K369-T372 PolarHBondContact O-N 3.41Å; K369-F373 PolarHBondContact O-N 2.97Å
370L86.7Confident84.3Confident84 Ų84100.6 Ų100.644%0.4451%0.512SS..Hα-helixtrans-63.9-42.9177.7-179.862.5000112.6D366 F367 S368 F373 K374D366-L370 PolarHBondContact O-N 2.92Å; F367-L370 PolarHBondContact O-N 2.99Å; S368-L370 PolarHBondContact O-N 3.26Å; L370-F373 PolarHBondContact O-N 3.33Å; L370-K374 WeakPolarHBondContact O-CG 3.47Å; L370-K374 PolarHBondContact O-N 2.89Å
371L82.4Confident84.4Confident85 Ų85102.6 Ų102.645%0.44552%0.519SS..Hα-helixtrans-61.8-45.8174-80.2177.6000111.6F367 S368 F373 K374 L375F367-L371 HydrophobicContact CD1-CD1 3.85Å; F367-L371 HydrophobicContact CD1-CG 4.36Å; F367-L371 HydrophobicContact CE1-CD1 3.38Å; F367-L371 HydrophobicContact CE1-CG 4Å; F367-L371 HydrophobicContact CZ-CD1 3.91Å; F367-L371 HydrophobicContact CZ-CD2 4.36Å; F367-L371 HydrophobicContact CZ-CG 4.11Å; F367-L371 PolarHBondContact O-N 2.92Å; S368-L371 PolarHBondContact O-N 3.46Å; L371-F373 VanDerWaalsContact C-N 3.3Å; L371-F373 PolarHBondContact O-N 3.48Å; L371-K374 PolarHBondContact O-N 3.18Å; L371-L375 WeakPolarHBondContact O-CB 3.37Å; L371-L375 PolarHBondContact O-N 2.7Å
372T82.8Confident84.2Confident87 Ų87103.2 Ų103.253%0.53452%0.515SS..Hα-helixtrans-59.4-41.8177.9-58.60000111.5S368 K369 L375 K376S368-T372 WeakPolarHBondContact O-CB 3.45Å; S368-T372 PolarHBondContact O-N 3.38Å; S368-T372 PolarHBondContact O-OG1 3.28Å; K369-T372 PolarHBondContact O-N 3.41Å; T372-L375 PolarHBondContact O-N 2.99Å; T372-K376 WeakPolarHBondContact O-CB 3.26Å; T372-K376 PolarHBondContact O-N 2.86Å
373F85.4Confident83.9Confident148 Ų148101.1 Ų101.165%0.64951%0.51SS*.Hα-helixtrans-63.1-48.7174.5-179.5-94.6000112.4K369 L370 L371 L375 K376 D377K369-F373 PolarHBondContact O-N 2.97Å; L370-F373 PolarHBondContact O-N 3.33Å; L371-F373 VanDerWaalsContact C-N 3.3Å; L371-F373 PolarHBondContact O-N 3.48Å; F373-L375 VanDerWaalsContact C-N 3.32Å; F373-L375 PolarHBondContact O-N 3.4Å; F373-K376 PolarHBondContact O-N 3.35Å; F373-D377 PolarHBondContact O-N 3.09Å
374K85.7Confident83.9Confident120 Ų120103.9 Ų103.952%0.52251%0.514SS..Hα-helixtrans-60.6-39.4177.1-74.8179.5178.4179.90112.5L370 L371 T378L370-K374 WeakPolarHBondContact O-CG 3.47Å; L370-K374 PolarHBondContact O-N 2.89Å; L371-K374 PolarHBondContact O-N 3.18Å; K374-T378 WeakPolarHBondContact O-CB 3.35Å; K374-T378 PolarHBondContact O-N 2.65Å; K374-T378 PolarHBondContact O-OG1 2.94Å
375L80.4Confident83.9Confident115 Ų11599.6 Ų99.660%0.60250%0.498SS*.Hα-helixtrans-64.9-45.1176.3-175.763.8000110.9L371 T372 F373 D377 T378 V379L371-L375 WeakPolarHBondContact O-CB 3.37Å; L371-L375 PolarHBondContact O-N 2.7Å; T372-L375 PolarHBondContact O-N 2.99Å; F373-L375 VanDerWaalsContact C-N 3.32Å; F373-L375 PolarHBondContact O-N 3.4Å; L375-D377 PolarHBondContact O-N 3.1Å; L375-T378 PolarHBondContact O-N 2.89Å; L375-V379 HydrophobicContact CD1-CG2 4.37Å; L375-V379 HydrophobicContact CG-CG2 4.49Å; L375-V379 WeakPolarHBondContact O-CB 3.39Å; L375-V379 WeakPolarHBondContact O-CG2 3.45Å; L375-V379 PolarHBondContact O-N 2.9Å
376K85.4Confident83.6Confident165 Ų16598.8 Ų98.872%0.71750%0.496SS*.Hα-helixtrans-61.5-42.9177.8-171.2175.6-178.8178.20112.5T372 F373 G380T372-K376 WeakPolarHBondContact O-CB 3.26Å; T372-K376 PolarHBondContact O-N 2.86Å; F373-K376 PolarHBondContact O-N 3.35Å; K376-G380 PolarHBondContact O-N 3.49Å
377D86Confident83.6Confident72 Ų72100.6 Ų100.639%0.38551%0.505SS..Hα-helixtrans-62.7-44.4173.2170.561.3000112F373 L375 G380 K381F373-D377 PolarHBondContact O-N 3.09Å; L375-D377 PolarHBondContact O-N 3.1Å; D377-G380 PolarHBondContact O-N 2.91Å; D377-K381 VanDerWaalsContact CG-NZ 3.27Å; D377-K381 WeakPolarHBondContact O-CG 3.39Å; D377-K381 PolarHBondContact O-N 3.05Å; D377-K381 WeakPolarHBondContact OD1-CE 3.5Å; D377-K381 IonicContact OD1-NZ 3.25Å; D377-K381 PolarHBondContact OD1-NZ 2.71Å; D377-K381 VanDerWaalsContact OD1-NZ 3.12Å; D377-K381 WeakPolarHBondContact OD2-CE 3.46Å; D377-K381 IonicContact OD2-NZ 2.67Å; D377-K381 PolarHBondContact OD2-NZ 3.02Å
378T81.9Confident83.7Confident82 Ų8298.8 Ų98.850%0.50350%0.501SS..Hα-helixtrans-64.4-43.4178.6-55.90000112.1K374 L375 G380 K381 Y382K374-T378 WeakPolarHBondContact O-CB 3.35Å; K374-T378 PolarHBondContact O-N 2.65Å; K374-T378 PolarHBondContact O-OG1 2.94Å; L375-T378 PolarHBondContact O-N 2.89Å; T378-G380 VanDerWaalsContact C-N 3.34Å; T378-K381 PolarHBondContact O-N 3.05Å; T378-Y382 PolarHBondContact O-N 3.35Å
379V78Confident83.7Confident70 Ų7099.8 Ų99.842%0.42450%0.504SS..Hα-helixtrans-64-39.5174.2170.60000111L375 Y382 N383L375-V379 HydrophobicContact CD1-CG2 4.37Å; L375-V379 HydrophobicContact CG-CG2 4.49Å; L375-V379 WeakPolarHBondContact O-CB 3.39Å; L375-V379 WeakPolarHBondContact O-CG2 3.45Å; L375-V379 PolarHBondContact O-N 2.9Å; V379-Y382 PolarHBondContact O-N 3.38Å; V379-N383 WeakPolarHBondContact O-CB 3.48Å; V379-N383 VanDerWaalsContact O-CG 3.29Å; V379-N383 PolarHBondContact O-N 3.21Å; V379-N383 PolarHBondContact O-ND2 3.35Å
380G83.2Confident83.4Confident38 Ų3897.8 Ų97.839%0.39250%0.503SS..Hα-helixtrans-58.4-47.517300000112.6K376 D377 T378 N383 Y384K376-G380 PolarHBondContact O-N 3.49Å; D377-G380 PolarHBondContact O-N 2.91Å; T378-G380 VanDerWaalsContact C-N 3.34Å; G380-N383 PolarHBondContact O-N 3.42Å; G380-Y384 WeakPolarHBondContact O-CB 3.37Å; G380-Y384 PolarHBondContact O-N 3.36Å
381K87.1Confident83.5Confident130 Ų13097.8 Ų97.857%0.56550%0.501SS*.Hα-helixtrans-63.3-40.8176-72.8165.6178.5164.40112.6D377 T378 Y384 G385D377-K381 VanDerWaalsContact CG-NZ 3.27Å; D377-K381 WeakPolarHBondContact O-CG 3.39Å; D377-K381 PolarHBondContact O-N 3.05Å; D377-K381 WeakPolarHBondContact OD1-CE 3.5Å; D377-K381 IonicContact OD1-NZ 3.25Å; D377-K381 PolarHBondContact OD1-NZ 2.71Å; D377-K381 VanDerWaalsContact OD1-NZ 3.12Å; D377-K381 WeakPolarHBondContact OD2-CE 3.46Å; D377-K381 IonicContact OD2-NZ 2.67Å; D377-K381 PolarHBondContact OD2-NZ 3.02Å; T378-K381 PolarHBondContact O-N 3.05Å; K381-Y384 PolarHBondContact O-N 3.02Å; K381-G385 PolarHBondContact O-N 2.99Å
382Y79.1Confident83.7Confident147 Ų14798.4 Ų98.458%0.57650%0.504SS*.Hα-helixtrans-62.3-48.4175.1177.5-97.2000111.8T378 V379 Y384 G385 M386T378-Y382 PolarHBondContact O-N 3.35Å; V379-Y382 PolarHBondContact O-N 3.38Å; Y382-Y384 VanDerWaalsContact C-N 3.35Å; Y382-Y384 PolarHBondContact O-N 3.32Å; Y382-G385 PolarHBondContact O-N 3.26Å; Y382-G385 VanDerWaalsContact O-N 3.14Å; Y382-M386 HydrophobicContact CD1-CG 4.11Å; Y382-M386 HydrophobicContact CD2-CG 4.5Å; Y382-M386 HydrophobicContact CE1-CG 3.61Å; Y382-M386 HydrophobicContact CE2-CG 4.04Å; Y382-M386 HydrophobicContact CE2-SD 4.3Å; Y382-M386 WeakPolarHBondContact O-CG 3.33Å; Y382-M386 PolarHBondContact O-N 2.87Å
383N80.8Confident83.7Confident82 Ų8298.8 Ų98.844%0.43950%0.5SS..Hα-helixtrans-62.4-40.8178.6-72-18.3000111.9V379 G380 M386 N387V379-N383 WeakPolarHBondContact O-CB 3.48Å; V379-N383 VanDerWaalsContact O-CG 3.29Å; V379-N383 PolarHBondContact O-N 3.21Å; V379-N383 PolarHBondContact O-ND2 3.35Å; G380-N383 PolarHBondContact O-N 3.42Å; N383-M386 PolarHBondContact O-N 3.07Å; N383-N387 WeakPolarHBondContact O-CB 3.44Å; N383-N387 VanDerWaalsContact O-CG 3.27Å; N383-N387 PolarHBondContact O-N 3.37Å; N383-N387 PolarHBondContact O-ND2 3.5Å
384Y86.2Confident83.8Confident167 Ų16796.8 Ų96.866%0.65549%0.491SS*.Hα-helixtrans-60.4-45.3172.3179.4-97000112G380 K381 Y382 N387 L388G380-Y384 WeakPolarHBondContact O-CB 3.37Å; G380-Y384 PolarHBondContact O-N 3.36Å; K381-Y384 PolarHBondContact O-N 3.02Å; Y382-Y384 VanDerWaalsContact C-N 3.35Å; Y382-Y384 PolarHBondContact O-N 3.32Å; Y384-N387 PolarHBondContact O-N 2.95Å; Y384-L388 PolarHBondContact O-N 2.97Å
385G81.8Confident83.9Confident28 Ų2897.6 Ų97.629%0.28949%0.494SS..Hα-helixtrans-60.9-44.3175.500000113.2K381 Y382 L388 V389K381-G385 PolarHBondContact O-N 2.99Å; Y382-G385 PolarHBondContact O-N 3.26Å; Y382-G385 VanDerWaalsContact O-N 3.14Å; G385-L388 PolarHBondContact O-N 2.9Å; G385-V389 WeakPolarHBondContact O-CG2 3.3Å; G385-V389 PolarHBondContact O-N 3.39Å
386M80.3Confident84Confident91 Ų9195.8 Ų95.845%0.44849%0.485SS..Hα-helixtrans-64.3-39.9176.8-74.2-60.2-65.200112.5Y382 N383 V389 S390Y382-M386 HydrophobicContact CD1-CG 4.11Å; Y382-M386 HydrophobicContact CD2-CG 4.5Å; Y382-M386 HydrophobicContact CE1-CG 3.61Å; Y382-M386 HydrophobicContact CE2-CG 4.04Å; Y382-M386 HydrophobicContact CE2-SD 4.3Å; Y382-M386 WeakPolarHBondContact O-CG 3.33Å; Y382-M386 PolarHBondContact O-N 2.87Å; N383-M386 PolarHBondContact O-N 3.07Å; M386-V389 PolarHBondContact O-N 3.24Å; M386-S390 WeakPolarHBondContact O-CB 3.48Å; M386-S390 PolarHBondContact O-N 3.2Å
387N86.8Confident84Confident111 Ų11191.7 Ų91.759%0.59447%0.471SS*.Hα-helixtrans-63.3-42.8173.6-73.4-19.5000111.5N383 Y384 S390 E391N383-N387 WeakPolarHBondContact O-CB 3.44Å; N383-N387 VanDerWaalsContact O-CG 3.27Å; N383-N387 PolarHBondContact O-N 3.37Å; N383-N387 PolarHBondContact O-ND2 3.5Å; Y384-N387 PolarHBondContact O-N 2.95Å; N387-S390 WeakPolarHBondContact O-CB 3.38Å; N387-S390 PolarHBondContact O-N 3.32Å; N387-E391 PolarHBondContact O-N 3.42Å
388L88.3Confident84Confident87 Ų8793 Ų9346%0.45548%0.477SS..Hα-helixtrans-63.1-42.1175.7-177.962.1000112Y384 G385 E391 L392Y384-L388 PolarHBondContact O-N 2.97Å; G385-L388 PolarHBondContact O-N 2.9Å; L388-E391 PolarHBondContact O-N 3.25Å; L388-L392 HydrophobicContact CD1-CD1 4.46Å; L388-L392 HydrophobicContact CD1-CG 4.48Å; L388-L392 HydrophobicContact CG-CD1 4.18Å; L388-L392 WeakPolarHBondContact O-CB 3.43Å; L388-L392 VanDerWaalsContact O-CG 3.27Å; L388-L392 WeakPolarHBondContact O-CG 3.49Å; L388-L392 PolarHBondContact O-N 3.5Å
389V79.8Confident84.3Confident86 Ų8694.7 Ų94.752%0.52148%0.477SS..Hα-helixtrans-63-41.9174.4169.80000111.2G385 M386 L392 Q393G385-V389 WeakPolarHBondContact O-CG2 3.3Å; G385-V389 PolarHBondContact O-N 3.39Å; M386-V389 PolarHBondContact O-N 3.24Å; V389-L392 PolarHBondContact O-N 2.78Å; V389-Q393 WeakPolarHBondContact O-CB 3.47Å; V389-Q393 PolarHBondContact O-N 2.68Å
390S84.2Confident84.6Confident59 Ų5995.1 Ų95.141%0.41348%0.475SS..Hα-helixtrans-60.8-45.8175.7-169.80000112M386 N387 Q393 K394M386-S390 WeakPolarHBondContact O-CB 3.48Å; M386-S390 PolarHBondContact O-N 3.2Å; N387-S390 WeakPolarHBondContact O-CB 3.38Å; N387-S390 PolarHBondContact O-N 3.32Å; S390-Q393 PolarHBondContact O-N 3.39Å; S390-K394 WeakPolarHBondContact O-CG 3.31Å; S390-K394 PolarHBondContact O-N 3Å
391E87.7Confident84.6Confident83 Ų83101.4 Ų101.439%0.38849%0.486SS..Hα-helixtrans-64.1-40.1175.4-77.8-58.7124.800113N387 L388 K394 K395N387-E391 PolarHBondContact O-N 3.42Å; L388-E391 PolarHBondContact O-N 3.25Å; E391-K394 PolarHBondContact O-N 3.48Å; E391-K394 WeakPolarHBondContact OE1-CD 3.46Å; E391-K394 WeakPolarHBondContact OE1-CE 3.22Å; E391-K394 IonicContact OE1-NZ 3.46Å; E391-K394 PolarHBondContact OE1-NZ 3.19Å; E391-K395 WeakPolarHBondContact O-CG 3.42Å; E391-K395 PolarHBondContact O-N 2.96Å
392L86.2Confident84.5Confident99 Ų9999.7 Ų99.752%0.51848%0.484SS..Hα-helixtrans-65.3-39.3174.4-71.8171.9000111.8L388 V389 K395 L396L388-L392 HydrophobicContact CD1-CD1 4.46Å; L388-L392 HydrophobicContact CD1-CG 4.48Å; L388-L392 HydrophobicContact CG-CD1 4.18Å; L388-L392 WeakPolarHBondContact O-CB 3.43Å; L388-L392 VanDerWaalsContact O-CG 3.27Å; L388-L392 WeakPolarHBondContact O-CG 3.49Å; L388-L392 PolarHBondContact O-N 3.5Å; V389-L392 PolarHBondContact O-N 2.78Å; L392-K395 PolarHBondContact O-N 3.48Å; L392-L396 WeakPolarHBondContact O-CB 3.46Å; L392-L396 PolarHBondContact O-N 3.44Å
393Q83.5Confident84.8Confident95 Ų9597.4 Ų97.444%0.44448%0.478SS..Hα-helixtrans-64.6-42175.4-171.36549.900111.7V389 S390 K395 L396 N397V389-Q393 WeakPolarHBondContact O-CB 3.47Å; V389-Q393 PolarHBondContact O-N 2.68Å; S390-Q393 PolarHBondContact O-N 3.39Å; Q393-K395 PolarHBondContact O-N 3.03Å; Q393-L396 PolarHBondContact O-N 3.44Å; Q393-N397 PolarHBondContact NE2-OD1 3.06Å; Q393-N397 WeakPolarHBondContact O-CB 3.38Å; Q393-N397 PolarHBondContact O-N 2.97Å; Q393-N397 PolarHBondContact O-OD1 3.41Å
394K88.3Confident85Confident106 Ų106100.9 Ų100.946%0.46149%0.485SS..Hα-helixtrans-58.1-47.5173-68.9172.1-165.2172.40111.1S390 E391 L396 N397 I398S390-K394 WeakPolarHBondContact O-CG 3.31Å; S390-K394 PolarHBondContact O-N 3Å; E391-K394 PolarHBondContact O-N 3.48Å; E391-K394 WeakPolarHBondContact OE1-CD 3.46Å; E391-K394 WeakPolarHBondContact OE1-CE 3.22Å; E391-K394 IonicContact OE1-NZ 3.46Å; E391-K394 PolarHBondContact OE1-NZ 3.19Å; K394-L396 PolarHBondContact O-N 3.39Å; K394-N397 PolarHBondContact O-N 3.47Å; K394-I398 VanDerWaalsContact O-CG1 3.29Å; K394-I398 WeakPolarHBondContact O-CG1 3.47Å; K394-I398 PolarHBondContact O-N 2.96Å
395K86.8Confident84.9Confident136 Ų13696.4 Ų96.459%0.59147%0.472SS*.Hα-helixtrans-63.2-39.4178.2-72.1176-177179.70112.5E391 L392 Q393 I398 K399E391-K395 WeakPolarHBondContact O-CG 3.42Å; E391-K395 PolarHBondContact O-N 2.96Å; L392-K395 PolarHBondContact O-N 3.48Å; Q393-K395 PolarHBondContact O-N 3.03Å; K395-I398 PolarHBondContact O-N 2.91Å; K395-K399 PolarHBondContact O-N 3.31Å
396L83.5Confident85.1Confident78 Ų78100.3 Ų100.341%0.40849%0.485SS..Hα-helixtrans-63.6-49.8175-177.961.5000111.4L392 Q393 K394 I398 K399 E400L392-L396 WeakPolarHBondContact O-CB 3.46Å; L392-L396 PolarHBondContact O-N 3.44Å; Q393-L396 PolarHBondContact O-N 3.44Å; K394-L396 PolarHBondContact O-N 3.39Å; L396-I398 VanDerWaalsContact C-N 3.26Å; L396-I398 PolarHBondContact O-N 3.1Å; L396-K399 WeakPolarHBondContact O-CA 3.47Å; L396-K399 WeakPolarHBondContact O-CB 3.41Å; L396-K399 PolarHBondContact O-N 3.17Å; L396-E400 HydrophobicContact CD1-CG 4.41Å; L396-E400 WeakPolarHBondContact O-CG 3.41Å; L396-E400 PolarHBondContact O-N 2.89Å
397N85.3Confident85.3Confident79 Ų79101.7 Ų101.742%0.42249%0.491SS..Hα-helixtrans-57.2-39.3177.4-67.4-2.4000111.9Q393 K394 R401Q393-N397 PolarHBondContact NE2-OD1 3.06Å; Q393-N397 WeakPolarHBondContact O-CB 3.38Å; Q393-N397 PolarHBondContact O-N 2.97Å; Q393-N397 PolarHBondContact O-OD1 3.41Å; K394-N397 PolarHBondContact O-N 3.47Å; N397-R401 WeakPolarHBondContact O-CB 3.4Å; N397-R401 PolarHBondContact O-N 3.02Å
398I84.9Confident85Confident99 Ų99100.3 Ų100.351%0.50848%0.48SS..Hα-helixtrans-66.2-43.8174.8-68.2164.3000110.9K394 K395 L396 R401 N402K394-I398 VanDerWaalsContact O-CG1 3.29Å; K394-I398 WeakPolarHBondContact O-CG1 3.47Å; K394-I398 PolarHBondContact O-N 2.96Å; K395-I398 PolarHBondContact O-N 2.91Å; L396-I398 VanDerWaalsContact C-N 3.26Å; L396-I398 PolarHBondContact O-N 3.1Å; I398-R401 PolarHBondContact O-N 3Å; I398-N402 VanDerWaalsContact O-CG 3.26Å; I398-N402 PolarHBondContact O-N 3.49Å
399K87.7Confident84.8Confident118 Ų118102.9 Ų102.951%0.51349%0.488SS..Hα-helixtrans-60.7-48.7177-171.8177.7-175.3-88.30111.6K395 L396 R401 N402 E403K395-K399 PolarHBondContact O-N 3.31Å; L396-K399 WeakPolarHBondContact O-CA 3.47Å; L396-K399 WeakPolarHBondContact O-CB 3.41Å; L396-K399 PolarHBondContact O-N 3.17Å; K399-R401 VanDerWaalsContact C-N 3.28Å; K399-R401 PolarHBondContact O-N 3.06Å; K399-N402 PolarHBondContact O-N 2.87Å; K399-N402 VanDerWaalsContact O-N 3.13Å; K399-E403 WeakPolarHBondContact CE-OE1 3.33Å; K399-E403 IonicContact NZ-OE1 2.91Å; K399-E403 PolarHBondContact NZ-OE1 3.09Å; K399-E403 WeakPolarHBondContact O-CG 3.43Å; K399-E403 PolarHBondContact O-N 3.45Å
400E84.5Confident85Confident79 Ų79103.9 Ų103.937%0.36949%0.488SS..Hα-helixtrans-62.4-32.4176.6-69.3178.8-179.700113.1L396 R404L396-E400 HydrophobicContact CD1-CG 4.41Å; L396-E400 WeakPolarHBondContact O-CG 3.41Å; L396-E400 PolarHBondContact O-N 2.89Å; E400-R404 WeakPolarHBondContact O-CB 3.47Å; E400-R404 WeakPolarHBondContact O-CG 3.42Å; E400-R404 PolarHBondContact O-N 3.05Å; E400-R404 VanDerWaalsContact O-N 3.16Å; E400-R404 PolarHBondContact O-NE 3.3Å; E400-R404 IonicContact OE2-NH2 2.67Å
401R83.8Confident85.1Confident169 Ų169105.1 Ų105.164%0.63849%0.486SS*.Hα-helixtrans-69-43.9173.1-175179.91791160.7110.8N397 I398 K399 R404 I405N397-R401 WeakPolarHBondContact O-CB 3.4Å; N397-R401 PolarHBondContact O-N 3.02Å; I398-R401 PolarHBondContact O-N 3Å; K399-R401 VanDerWaalsContact C-N 3.28Å; K399-R401 PolarHBondContact O-N 3.06Å; R401-R404 PolarHBondContact O-N 3.49Å; R401-I405 HydrophobicContact CG-CD1 4.06Å; R401-I405 VanDerWaalsContact O-CG1 3.31Å; R401-I405 WeakPolarHBondContact O-CG1 3.42Å; R401-I405 PolarHBondContact O-N 2.94Å
402N85.4Confident84.8Confident95 Ų95106.8 Ų106.851%0.50849%0.489SS..Hα-helixtrans-66.6-40178.5-69.8-12.9000112.1I398 K399 I405 L406I398-N402 VanDerWaalsContact O-CG 3.26Å; I398-N402 PolarHBondContact O-N 3.49Å; K399-N402 PolarHBondContact O-N 2.87Å; K399-N402 VanDerWaalsContact O-N 3.13Å; N402-I405 PolarHBondContact O-N 3.14Å; N402-L406 WeakPolarHBondContact O-CB 3.47Å; N402-L406 PolarHBondContact O-N 2.9Å
403E86.1Confident84.7Confident98 Ų98108.9 Ų108.946%0.45849%0.494SS..Hα-helixtrans-63.7-41.5174.5-74.6174.3-17900111.8K399 L406 H407K399-E403 WeakPolarHBondContact CE-OE1 3.33Å; K399-E403 IonicContact NZ-OE1 2.91Å; K399-E403 PolarHBondContact NZ-OE1 3.09Å; K399-E403 WeakPolarHBondContact O-CG 3.43Å; K399-E403 PolarHBondContact O-N 3.45Å; E403-L406 PolarHBondContact O-N 3.18Å; E403-H407 WeakPolarHBondContact O-CB 3.35Å; E403-H407 PolarHBondContact O-N 3.33Å
404R84.7Confident84.9Confident155 Ų155108.9 Ų108.959%0.58549%0.494SS*.Hα-helixtrans-60.1-47.3172.1-81.4178.5-82.1-166.7-10.4112.3E400 R401 L406 H407 E408E400-R404 WeakPolarHBondContact O-CB 3.47Å; E400-R404 WeakPolarHBondContact O-CG 3.42Å; E400-R404 PolarHBondContact O-N 3.05Å; E400-R404 VanDerWaalsContact O-N 3.16Å; E400-R404 PolarHBondContact O-NE 3.3Å; E400-R404 IonicContact OE2-NH2 2.67Å; R401-R404 PolarHBondContact O-N 3.49Å; R404-L406 VanDerWaalsContact C-N 3.31Å; R404-L406 PolarHBondContact O-N 3.04Å; R404-H407 PolarHBondContact O-N 3.33Å; R404-E408 WeakPolarHBondContact O-CB 3.48Å; R404-E408 PolarHBondContact O-N 3.44Å
405I82.9Confident84.6Confident73 Ų73105.2 Ų105.237%0.37448%0.479SS..Hα-helixtrans-61.4-39.1176.8-68.5164.7000111.2R401 N402 K409R401-I405 HydrophobicContact CG-CD1 4.06Å; R401-I405 VanDerWaalsContact O-CG1 3.31Å; R401-I405 WeakPolarHBondContact O-CG1 3.42Å; R401-I405 PolarHBondContact O-N 2.94Å; N402-I405 PolarHBondContact O-N 3.14Å; I405-K409 HydrophobicContact CG2-CD 4.36Å; I405-K409 WeakPolarHBondContact O-CB 3.34Å; I405-K409 WeakPolarHBondContact O-CG 3.37Å; I405-K409 PolarHBondContact O-N 3.04Å
406L85.9Confident84.4Confident110 Ų110101 Ų10158%0.57647%0.47SS*.Hα-helixtrans-67.2-45.2178-174.967.3000111.9N402 E403 R404 E408 K409 M410N402-L406 WeakPolarHBondContact O-CB 3.47Å; N402-L406 PolarHBondContact O-N 2.9Å; E403-L406 PolarHBondContact O-N 3.18Å; R404-L406 VanDerWaalsContact C-N 3.31Å; R404-L406 PolarHBondContact O-N 3.04Å; L406-E408 VanDerWaalsContact C-N 3.33Å; L406-E408 PolarHBondContact O-N 3.3Å; L406-K409 PolarHBondContact O-N 3.01Å; L406-M410 PolarHBondContact O-N 3.45Å
407H84.8Confident84.4Confident121 Ų121103.2 Ų103.256%0.5648%0.478SS*.Hα-helixtrans-62.1-39.7176.4179.1-101.1000111.9E403 R404 M410 K411E403-H407 WeakPolarHBondContact O-CB 3.35Å; E403-H407 PolarHBondContact O-N 3.33Å; R404-H407 PolarHBondContact O-N 3.33Å; H407-M410 WeakPolarHBondContact O-CB 3.23Å; H407-M410 PolarHBondContact O-N 3.41Å; H407-K411 PolarHBondContact O-N 3.18Å
408E81.1Confident84.4Confident81 Ų81104.3 Ų104.338%0.37948%0.481SS..Hα-helixtrans-68.7-40.3175.3-169154-16500112.1R404 L406 M410 K411 W412R404-E408 WeakPolarHBondContact O-CB 3.48Å; R404-E408 PolarHBondContact O-N 3.44Å; L406-E408 VanDerWaalsContact C-N 3.33Å; L406-E408 PolarHBondContact O-N 3.3Å; E408-M410 VanDerWaalsContact C-N 3.31Å; E408-M410 PolarHBondContact O-N 3.12Å; E408-K411 PolarHBondContact O-N 3.48Å; E408-W412 PolarHBondContact O-N 2.83Å
409K84.3Confident84.1Confident141 Ų141101.5 Ų101.561%0.61347%0.468SS*.Hα-helixtrans-59.8-38.2170.2-77.5-179.8177.8-173.10112.8I405 L406 W412 F413I405-K409 HydrophobicContact CG2-CD 4.36Å; I405-K409 WeakPolarHBondContact O-CB 3.34Å; I405-K409 WeakPolarHBondContact O-CG 3.37Å; I405-K409 PolarHBondContact O-N 3.04Å; L406-K409 PolarHBondContact O-N 3.01Å; K409-W412 PolarHBondContact O-N 3.21Å; K409-F413 WeakPolarHBondContact O-CB 3.4Å; K409-F413 PolarHBondContact O-N 3.14Å
410M84.3Confident83.9Confident107 Ų107102.9 Ų102.953%0.52747%0.474SS..Hα-helixtrans-62.7-46.4173.8-84.1-168.264.400111.9L406 H407 E408 W412 F413 E414L406-M410 PolarHBondContact O-N 3.45Å; H407-M410 WeakPolarHBondContact O-CB 3.23Å; H407-M410 PolarHBondContact O-N 3.41Å; E408-M410 VanDerWaalsContact C-N 3.31Å; E408-M410 PolarHBondContact O-N 3.12Å; M410-W412 VanDerWaalsContact C-N 3.33Å; M410-W412 PolarHBondContact O-N 3.4Å; M410-F413 WeakPolarHBondContact O-CB 3.49Å; M410-F413 PolarHBondContact O-N 3.05Å; M410-F413 VanDerWaalsContact O-N 3.09Å; M410-E414 WeakPolarHBondContact O-CG 3.45Å; M410-E414 PolarHBondContact O-N 2.76Å
411K85.3Confident83.8Confident86 Ų86101.2 Ų101.237%0.37448%0.478SS..Hα-helixtrans-56.4-45.8174.3-74.1-171.9167.6-160.40112.4H407 E408 F413 E414 I415H407-K411 PolarHBondContact O-N 3.18Å; E408-K411 PolarHBondContact O-N 3.48Å; K411-F413 VanDerWaalsContact C-N 3.29Å; K411-F413 PolarHBondContact O-N 2.88Å; K411-E414 PolarHBondContact O-N 2.98Å; K411-I415 WeakPolarHBondContact O-CD1 3.19Å; K411-I415 VanDerWaalsContact O-CG1 3.28Å; K411-I415 WeakPolarHBondContact O-CG1 3.34Å; K411-I415 PolarHBondContact O-N 2.99Å
412W81.7Confident83.4Confident117 Ų11794.2 Ų94.244%0.44345%0.453SS..Hα-helixtrans-63.6-34.4176.8-75.7112.6000112.8E408 K409 M410 I415 A416 V447E408-W412 PolarHBondContact O-N 2.83Å; K409-W412 PolarHBondContact O-N 3.21Å; M410-W412 VanDerWaalsContact C-N 3.33Å; M410-W412 PolarHBondContact O-N 3.4Å; W412-I415 HydrophobicContact CE3-CD1 4.23Å; W412-A416 WeakPolarHBondContact O-CB 3.33Å; W412-A416 PolarHBondContact O-N 3.18Å; W412-V447 HydrophobicContact CH2-CG1 4.04Å; W412-V447 HydrophobicContact CZ3-CG1 4.16Å
413F84.5Confident82.9Confident143 Ų14394.6 Ų94.663%0.62745%0.452SS*.Hα-helixtrans-67.3-44.4173.1-175.1-90.5000112.2K409 M410 K411 A416 Q417K409-F413 WeakPolarHBondContact O-CB 3.4Å; K409-F413 PolarHBondContact O-N 3.14Å; M410-F413 WeakPolarHBondContact O-CB 3.49Å; M410-F413 PolarHBondContact O-N 3.05Å; M410-F413 VanDerWaalsContact O-N 3.09Å; K411-F413 VanDerWaalsContact C-N 3.29Å; K411-F413 PolarHBondContact O-N 2.88Å; F413-A416 PolarHBondContact O-N 3.22Å; F413-Q417 WeakPolarHBondContact O-CB 3.31Å; F413-Q417 PolarHBondContact O-N 3.26Å
414E86.5Confident82.6Confident95 Ų9592.3 Ų92.344%0.44445%0.45SS..Hα-helixtrans-60-44.9174.7-71.6171.8-172.300111.7M410 K411 Q417 Q418M410-E414 WeakPolarHBondContact O-CG 3.45Å; M410-E414 PolarHBondContact O-N 2.76Å; K411-E414 PolarHBondContact O-N 2.98Å; E414-Q417 PolarHBondContact O-N 3.12Å; E414-Q418 WeakPolarHBondContact O-CG 3.36Å; E414-Q418 PolarHBondContact O-N 3.3Å
415I82Confident82.1Confident29 Ų2986.6 Ų86.615%0.14944%0.435CS..Hα-helixtrans-60.7-46.6175-68160.7000110.5K411 W412 Q417 Q418 V419 V447K411-I415 WeakPolarHBondContact O-CD1 3.19Å; K411-I415 VanDerWaalsContact O-CG1 3.28Å; K411-I415 WeakPolarHBondContact O-CG1 3.34Å; K411-I415 PolarHBondContact O-N 2.99Å; W412-I415 HydrophobicContact CE3-CD1 4.23Å; I415-Q417 VanDerWaalsContact C-N 3.3Å; I415-Q417 PolarHBondContact O-N 3.05Å; I415-Q418 WeakPolarHBondContact O-CB 3.45Å; I415-Q418 PolarHBondContact O-N 2.8Å; I415-V419 WeakPolarHBondContact O-CG2 3.3Å; I415-V419 PolarHBondContact O-N 3.49Å; I415-V447 HydrophobicContact CD1-CG2 4.04Å; I415-V447 HydrophobicContact CG1-CG2 4.43Å; I415-V447 HydrophobicContact CG2-CG2 4.07Å
416A82.5Confident81.3Confident47 Ų4786.1 Ų86.139%0.38844%0.436SS..Hα-helixtrans-63.3-34.9177.800000112.7W412 F413 V419 K420W412-A416 WeakPolarHBondContact O-CB 3.33Å; W412-A416 PolarHBondContact O-N 3.18Å; F413-A416 PolarHBondContact O-N 3.22Å; A416-V419 PolarHBondContact O-N 3.18Å; A416-K420 WeakPolarHBondContact O-CG 3.33Å; A416-K420 PolarHBondContact O-N 3.01Å
417Q85.3Confident80.6Confident125 Ų12587.8 Ų87.858%0.58444%0.444SS*.Hα-helixtrans-69-37.7174.3-169.2173.17.700111.8F413 E414 I415 K420 G421F413-Q417 WeakPolarHBondContact O-CB 3.31Å; F413-Q417 PolarHBondContact O-N 3.26Å; E414-Q417 PolarHBondContact O-N 3.12Å; I415-Q417 VanDerWaalsContact C-N 3.3Å; I415-Q417 PolarHBondContact O-N 3.05Å; Q417-K420 PolarHBondContact O-N 2.93Å; Q417-G421 PolarHBondContact O-N 3.33Å
418Q83.7Confident79.5Confident102 Ų10287.6 Ų87.648%0.47745%0.451SS..Hα-helixtrans-64.2-43172.4-70.3174.232.400112E414 I415 G421 I422 L443E414-Q418 WeakPolarHBondContact O-CG 3.36Å; E414-Q418 PolarHBondContact O-N 3.3Å; I415-Q418 WeakPolarHBondContact O-CB 3.45Å; I415-Q418 PolarHBondContact O-N 2.8Å; Q418-G421 PolarHBondContact O-N 3.37Å; Q418-I422 WeakPolarHBondContact O-CG1 3.38Å; Q418-I422 PolarHBondContact O-N 2.98Å; Q418-L443 HydrophobicContact CB-CD2 4.35Å
419V79.4Confident78.3Confident41 Ų4187.4 Ų87.425%0.24847%0.471CS..Hα-helixtrans-57.9-52.3174.3173.80000110.5I415 A416 G421 I422 E423 L443I415-V419 WeakPolarHBondContact O-CG2 3.3Å; I415-V419 PolarHBondContact O-N 3.49Å; A416-V419 PolarHBondContact O-N 3.18Å; V419-G421 VanDerWaalsContact C-N 3.25Å; V419-G421 PolarHBondContact O-N 3.37Å; V419-I422 PolarHBondContact O-N 3.46Å; V419-E423 HydrophobicContact CG1-CG 4.35Å; V419-E423 WeakPolarHBondContact O-CG 3.33Å; V419-E423 PolarHBondContact O-N 2.96Å; V419-L443 HydrophobicContact CG2-CD2 3.6Å
420K83.2Confident77.1Confident147 Ų14784.1 Ų84.164%0.63948%0.477SS*.Hα-helixtrans-57.7-36.4176.8-75-177176.5-175.10113.2A416 Q417 E423 A424A416-K420 WeakPolarHBondContact O-CG 3.33Å; A416-K420 PolarHBondContact O-N 3.01Å; Q417-K420 PolarHBondContact O-N 2.93Å; K420-E423 PolarHBondContact O-N 2.73Å; K420-A424 VanDerWaalsContact O-CB 3.32Å; K420-A424 WeakPolarHBondContact O-CB 3.39Å; K420-A424 PolarHBondContact O-N 3.36Å
421G81.8Confident75.9Confident43 Ų4381.8 Ų81.844%0.44347%0.469SS..Hα-helixtrans-64.9-38.5174.700000113.3Q417 Q418 V419 A425Q417-G421 PolarHBondContact O-N 3.33Å; Q418-G421 PolarHBondContact O-N 3.37Å; V419-G421 VanDerWaalsContact C-N 3.25Å; V419-G421 PolarHBondContact O-N 3.37Å; G421-A425 WeakPolarHBondContact O-CB 3.43Å; G421-A425 PolarHBondContact O-N 3.33Å; G421-A425 VanDerWaalsContact O-N 3.12Å
422I75.7Confident74.9Confident23 Ų2381.6 Ų81.612%0.11848%0.479CS..Hα-helixtrans-70.7-41.9175.6-64.4162.7000110.8Q418 V419 A425 T426 C436 K439 M440 L443Q418-I422 WeakPolarHBondContact O-CG1 3.38Å; Q418-I422 PolarHBondContact O-N 2.98Å; V419-I422 PolarHBondContact O-N 3.46Å; I422-A425 PolarHBondContact O-N 2.93Å; I422-T426 PolarHBondContact O-N 3.23Å; I422-T426 VanDerWaalsContact O-N 3.12Å; I422-T426 PolarHBondContact O-OG1 2.99Å; I422-C436 HydrophobicContact CG2-CB 4.13Å; I422-K439 HydrophobicContact CD1-CB 3.96Å; I422-K439 HydrophobicContact CG1-CB 4.24Å; I422-M440 HydrophobicContact CG2-CB 4.48Å; I422-L443 HydrophobicContact CD1-CD2 4.29Å
423E76.4Confident74.3Confident103 Ų10380.1 Ų80.148%0.48148%0.482SS..Hα-helixtrans-60.2-50.5175.2-70.4172.5163.400111.2V419 K420 A425 T426 I427V419-E423 HydrophobicContact CG1-CG 4.35Å; V419-E423 WeakPolarHBondContact O-CG 3.33Å; V419-E423 PolarHBondContact O-N 2.96Å; K420-E423 PolarHBondContact O-N 2.73Å; E423-A425 VanDerWaalsContact C-N 3.35Å; E423-A425 PolarHBondContact O-N 3.29Å; E423-T426 WeakPolarHBondContact O-CB 3.45Å; E423-T426 PolarHBondContact O-N 2.97Å; E423-I427 PolarHBondContact O-N 2.87Å; E423-I427 VanDerWaalsContact O-N 3.1Å
424A78.3Confident73.7Confident50 Ų5078.5 Ų78.541%0.41348%0.48SS..Hα-helixtrans-59.8-42178.100000112.5K420 T426 I427 V428K420-A424 VanDerWaalsContact O-CB 3.32Å; K420-A424 WeakPolarHBondContact O-CB 3.39Å; K420-A424 PolarHBondContact O-N 3.36Å; A424-T426 PolarHBondContact O-N 3.41Å; A424-I427 PolarHBondContact O-N 2.98Å; A424-V428 WeakPolarHBondContact O-CG2 3.44Å; A424-V428 PolarHBondContact O-N 2.95Å
425A74Confident73.1Confident34 Ų3475.6 Ų75.628%0.28148%0.475SS..Hα-helixtrans-64.9-24.4175.800000113.4G421 I422 E423 T431G421-A425 WeakPolarHBondContact O-CB 3.43Å; G421-A425 PolarHBondContact O-N 3.33Å; G421-A425 VanDerWaalsContact O-N 3.12Å; I422-A425 PolarHBondContact O-N 2.93Å; E423-A425 VanDerWaalsContact C-N 3.35Å; E423-A425 PolarHBondContact O-N 3.29Å; A425-T431 PolarHBondContact O-OG1 3.1Å
426T67.4Low72.5Confident64 Ų6474.5 Ų74.539%0.39347%0.47SS..Hα-helixtrans-79.3-33.5175.2-49.80000111.8I422 E423 A424 C436I422-T426 PolarHBondContact O-N 3.23Å; I422-T426 VanDerWaalsContact O-N 3.12Å; I422-T426 PolarHBondContact O-OG1 2.99Å; E423-T426 WeakPolarHBondContact O-CB 3.45Å; E423-T426 PolarHBondContact O-N 2.97Å; A424-T426 PolarHBondContact O-N 3.41Å; T426-C436 VanDerWaalsContact OG1-CB 3.26Å; T426-C436 WeakPolarHBondContact OG1-CB 3.28Å; T426-C436 PolarHBondContact OG1-SG 3.24Å
427I69.7Low72.2Confident144 Ų14477.7 Ų77.774%0.73848%0.475SS*.Hα-helixtrans-76.1-43.6177.9-63.5166.5000111E423 A424 G429E423-I427 PolarHBondContact O-N 2.87Å; E423-I427 VanDerWaalsContact O-N 3.1Å; A424-I427 PolarHBondContact O-N 2.98Å; I427-G429 PolarHBondContact O-N 3.34Å
428V63.7Low71.8Confident118 Ų11873.4 Ų73.472%0.71547%0.465SS*.SBendtrans-86.451.7-176.4-166.10000111.6A424 G430A424-V428 WeakPolarHBondContact O-CG2 3.44Å; A424-V428 PolarHBondContact O-N 2.95Å; V428-G430 PolarHBondContact O-N 3.33Å
429G55.6Low71.6Confident77 Ų7774.4 Ų74.479%0.79447%0.468SS*.SBendtrans49-3.2155.500000122.3I427I427-G429 PolarHBondContact O-N 3.34Å
430G59.4Low71.4Confident72 Ų7276.4 Ų76.474%0.74248%0.475SS*.  trans-110.4-8.6-163.600000115.6V428V428-G430 PolarHBondContact O-N 3.33Å
431T58.4Low71.3Confident57 Ų5772.9 Ų72.935%0.3547%0.466SS..SBendtrans-118.1136.3171.425.50000110.1A425 C436A425-T431 PolarHBondContact O-OG1 3.1Å; T431-C436 PolarHBondContact OG1-SG 3.38Å
432S63.6Low71.2Confident83 Ų8374.9 Ų74.958%0.5847%0.47SS*.  trans-60.3142.7176.573.70000110.2D434 G435 C436S432-D434 PolarHBondContact O-N 3.1Å; S432-D434 VanDerWaalsContact O-N 3.13Å; S432-G435 WeakPolarHBondContact O-CA 3.28Å; S432-G435 PolarHBondContact O-N 3.43Å; S432-G435 PolarHBondContact OG-N 2.9Å; S432-C436 PolarHBondContact O-N 3.19Å; S432-C436 VanDerWaalsContact O-N 3.16Å
433V68.8Low71.4Confident86 Ų8674.8 Ų74.852%0.52147%0.47SS..Hα-helixtrans-53.9-36-179.9175.60000111C436 K437V433-C436 PolarHBondContact O-N 2.86Å; V433-K437 HydrophobicContact CG1-CD 4.43Å; V433-K437 WeakPolarHBondContact O-CG 3.34Å; V433-K437 PolarHBondContact O-N 2.97Å
434D72Confident71.7Confident109 Ų10975.1 Ų75.158%0.58347%0.474SS*.Hα-helixtrans-73.1-30178.3-59.2-38.9000113.3S432 K437 G438S432-D434 PolarHBondContact O-N 3.1Å; S432-D434 VanDerWaalsContact O-N 3.13Å; D434-K437 IonicContact OD1-NZ 2.85Å; D434-K437 PolarHBondContact OD1-NZ 3.15Å; D434-G438 PolarHBondContact O-N 3.45Å
435G74.6Confident72Confident33 Ų3380 Ų8034%0.3449%0.485SS..Hα-helixtrans-64.3-41.5169.500000112.4S432 G438 K439S432-G435 WeakPolarHBondContact O-CA 3.28Å; S432-G435 PolarHBondContact O-N 3.43Å; S432-G435 PolarHBondContact OG-N 2.9Å; G435-G438 PolarHBondContact O-N 2.95Å; G435-K439 WeakPolarHBondContact O-CG 3.47Å; G435-K439 PolarHBondContact O-N 3.07Å; G435-K439 VanDerWaalsContact O-N 3.12Å
436C69.8Low72.4Confident7 Ų781.5 Ų81.55%0.04749%0.491CS..Hα-helixtrans-68.2-43.7174.8-66.50000112.1I422 T426 T431 S432 V433 G438 K439 M440I422-C436 HydrophobicContact CG2-CB 4.13Å; T426-C436 VanDerWaalsContact OG1-CB 3.26Å; T426-C436 WeakPolarHBondContact OG1-CB 3.28Å; T426-C436 PolarHBondContact OG1-SG 3.24Å; T431-C436 PolarHBondContact OG1-SG 3.38Å; S432-C436 PolarHBondContact O-N 3.19Å; S432-C436 VanDerWaalsContact O-N 3.16Å; V433-C436 PolarHBondContact O-N 2.86Å; C436-G438 VanDerWaalsContact C-N 3.33Å; C436-G438 PolarHBondContact O-N 3Å; C436-K439 PolarHBondContact O-N 3.26Å; C436-M440 PolarHBondContact O-N 3.09Å
437K74.8Confident73Confident113 Ų11379.8 Ų79.849%0.49148%0.48SS..Hα-helixtrans-56.4-45.9171.7-73.3173.5-170.5154.50111.4V433 D434 K439 M440 V441V433-K437 HydrophobicContact CG1-CD 4.43Å; V433-K437 WeakPolarHBondContact O-CG 3.34Å; V433-K437 PolarHBondContact O-N 2.97Å; D434-K437 IonicContact OD1-NZ 2.85Å; D434-K437 PolarHBondContact OD1-NZ 3.15Å; K437-K439 PolarHBondContact O-N 3.05Å; K437-M440 PolarHBondContact O-N 2.93Å; K437-V441 WeakPolarHBondContact O-CB 3.48Å; K437-V441 WeakPolarHBondContact O-CG2 3.44Å; K437-V441 PolarHBondContact O-N 3.45Å
438G77.8Confident73.6Confident36 Ų3674.9 Ų74.937%0.37147%0.465SS..Hα-helixtrans-58.9-44.8178.600000112.8D434 G435 C436 T442D434-G438 PolarHBondContact O-N 3.45Å; G435-G438 PolarHBondContact O-N 2.95Å; C436-G438 VanDerWaalsContact C-N 3.33Å; C436-G438 PolarHBondContact O-N 3Å; G438-T442 WeakPolarHBondContact O-CB 3.34Å; G438-T442 PolarHBondContact O-N 3.02Å; G438-T442 PolarHBondContact O-OG1 3.04Å
439K78.9Confident74.5Confident122 Ų12271.9 Ų71.953%0.5345%0.45SS..Hα-helixtrans-62.2-45.8173.8-71.4177-178.91780111.9I422 G435 C436 K437 T442 L443I422-K439 HydrophobicContact CD1-CB 3.96Å; I422-K439 HydrophobicContact CG1-CB 4.24Å; G435-K439 WeakPolarHBondContact O-CG 3.47Å; G435-K439 PolarHBondContact O-N 3.07Å; G435-K439 VanDerWaalsContact O-N 3.12Å; C436-K439 PolarHBondContact O-N 3.26Å; K437-K439 PolarHBondContact O-N 3.05Å; K439-T442 WeakPolarHBondContact O-CB 3.45Å; K439-T442 PolarHBondContact O-N 3.17Å; K439-L443 PolarHBondContact O-N 2.97Å
440M76Confident75.7Confident83 Ų8371.9 Ų71.941%0.40943%0.429SS..Hα-helixtrans-68.2-40.8-178.3-165.9150.680.600112.7I422 C436 K437 T442 L443 I444I422-M440 HydrophobicContact CG2-CB 4.48Å; C436-M440 PolarHBondContact O-N 3.09Å; K437-M440 PolarHBondContact O-N 2.93Å; M440-T442 VanDerWaalsContact C-N 3.3Å; M440-T442 PolarHBondContact O-N 3.36Å; M440-L443 PolarHBondContact O-N 3.37Å; M440-I444 HydrophobicContact CG-CD1 4.02Å; M440-I444 WeakPolarHBondContact O-CB 3.5Å; M440-I444 VanDerWaalsContact O-CG1 3.27Å; M440-I444 WeakPolarHBondContact O-CG1 3.39Å; M440-I444 PolarHBondContact O-N 3.33Å
441V79.8Confident76.6Confident73 Ų7371 Ų7144%0.44241%0.407SS..Hα-helixtrans-61.6-39.2172.2169.50000111.2K437 K445K437-V441 WeakPolarHBondContact O-CB 3.48Å; K437-V441 WeakPolarHBondContact O-CG2 3.44Å; K437-V441 PolarHBondContact O-N 3.45Å; V441-K445 HydrophobicContact CG1-CD 4.3Å; V441-K445 WeakPolarHBondContact O-CB 3.43Å; V441-K445 WeakPolarHBondContact O-CG 3.5Å; V441-K445 PolarHBondContact O-N 2.85Å
442T81Confident77.8Confident86 Ų8675.7 Ų75.753%0.52842%0.42SS..Hα-helixtrans-64.4-46.4175.7-55.90000111G438 K439 M440 I444 K445 T446G438-T442 WeakPolarHBondContact O-CB 3.34Å; G438-T442 PolarHBondContact O-N 3.02Å; G438-T442 PolarHBondContact O-OG1 3.04Å; K439-T442 WeakPolarHBondContact O-CB 3.45Å; K439-T442 PolarHBondContact O-N 3.17Å; M440-T442 VanDerWaalsContact C-N 3.3Å; M440-T442 PolarHBondContact O-N 3.36Å; T442-I444 PolarHBondContact O-N 2.85Å; T442-K445 PolarHBondContact O-N 3.23Å; T442-T446 PolarHBondContact O-N 3.35Å; T442-T446 PolarHBondContact O-OG1 3.23Å; T442-T446 VanDerWaalsContact O-OG1 3.12Å
443L80.3Confident78.7Confident21 Ų2177.7 Ų77.711%0.1142%0.418CS..Hα-helixtrans-60.9-45.6177-173.363.5000111.9Q418 V419 I422 K439 M440 K445 T446 V447Q418-L443 HydrophobicContact CB-CD2 4.35Å; V419-L443 HydrophobicContact CG2-CD2 3.6Å; I422-L443 HydrophobicContact CD1-CD2 4.29Å; K439-L443 PolarHBondContact O-N 2.97Å; M440-L443 PolarHBondContact O-N 3.37Å; L443-K445 VanDerWaalsContact C-N 3.35Å; L443-K445 PolarHBondContact O-N 2.96Å; L443-T446 PolarHBondContact O-N 2.93Å; L443-V447 HydrophobicContact CD1-CG2 4.4Å; L443-V447 HydrophobicContact CG-CG2 4.5Å; L443-V447 WeakPolarHBondContact O-CB 3.48Å; L443-V447 WeakPolarHBondContact O-CG2 3.32Å; L443-V447 PolarHBondContact O-N 2.89Å
444I81.3Confident79.1Confident110 Ų11077 Ų7756%0.56441%0.411SS*.Hα-helixtrans-61.2-41.7176.8-69.6165.2000111.2M440 T442 G448M440-I444 HydrophobicContact CG-CD1 4.02Å; M440-I444 WeakPolarHBondContact O-CB 3.5Å; M440-I444 VanDerWaalsContact O-CG1 3.27Å; M440-I444 WeakPolarHBondContact O-CG1 3.39Å; M440-I444 PolarHBondContact O-N 3.33Å; T442-I444 PolarHBondContact O-N 2.85Å; I444-G448 PolarHBondContact O-N 2.92Å
445K84.3Confident79.5Confident152 Ų15280 Ų8066%0.66141%0.414SS*.Hα-helixtrans-63-43.7174.7-77.3178.3178.5-177.20112V441 T442 L443 G448 S449V441-K445 HydrophobicContact CG1-CD 4.3Å; V441-K445 WeakPolarHBondContact O-CB 3.43Å; V441-K445 WeakPolarHBondContact O-CG 3.5Å; V441-K445 PolarHBondContact O-N 2.85Å; T442-K445 PolarHBondContact O-N 3.23Å; L443-K445 VanDerWaalsContact C-N 3.35Å; L443-K445 PolarHBondContact O-N 2.96Å; K445-G448 PolarHBondContact O-N 3Å; K445-S449 WeakPolarHBondContact O-CB 3.28Å; K445-S449 PolarHBondContact O-N 2.89Å
446T82.3Confident79.8Confident66 Ų6683 Ų8341%0.40542%0.419SS..Hα-helixtrans-60.8-54.7176.1-58.90000110.8T442 L443 G448 S449 E450T442-T446 PolarHBondContact O-N 3.35Å; T442-T446 PolarHBondContact O-OG1 3.23Å; T442-T446 VanDerWaalsContact O-OG1 3.12Å; L443-T446 PolarHBondContact O-N 2.93Å; T446-G448 VanDerWaalsContact C-N 3.29Å; T446-G448 PolarHBondContact O-N 2.97Å; T446-S449 PolarHBondContact O-N 3.23Å; T446-S449 PolarHBondContact O-OG 3.14Å; T446-E450 PolarHBondContact O-N 3.01Å
447V80.4Confident80.3Confident27 Ų2788.2 Ų88.216%0.16444%0.443CS..Hα-helixtrans-59.8-38.5179.3173.10000111.7W412 I415 L443 E450 N451W412-V447 HydrophobicContact CH2-CG1 4.04Å; W412-V447 HydrophobicContact CZ3-CG1 4.16Å; I415-V447 HydrophobicContact CD1-CG2 4.04Å; I415-V447 HydrophobicContact CG1-CG2 4.43Å; I415-V447 HydrophobicContact CG2-CG2 4.07Å; L443-V447 HydrophobicContact CD1-CG2 4.4Å; L443-V447 HydrophobicContact CG-CG2 4.5Å; L443-V447 WeakPolarHBondContact O-CB 3.48Å; L443-V447 WeakPolarHBondContact O-CG2 3.32Å; L443-V447 PolarHBondContact O-N 2.89Å; V447-E450 PolarHBondContact O-N 3.31Å; V447-N451 WeakPolarHBondContact CG1-ND2 3.29Å; V447-N451 WeakPolarHBondContact O-CB 3.49Å; V447-N451 PolarHBondContact O-N 2.88Å; V447-N451 PolarHBondContact O-ND2 2.99Å
448G82.3Confident80.5Confident41 Ų4187.9 Ų87.942%0.42345%0.446SS..Hα-helixtrans-63.4-43.8173.600000112.6I444 K445 T446 N451 Y452I444-G448 PolarHBondContact O-N 2.92Å; K445-G448 PolarHBondContact O-N 3Å; T446-G448 VanDerWaalsContact C-N 3.29Å; T446-G448 PolarHBondContact O-N 2.97Å; G448-N451 PolarHBondContact O-N 2.9Å; G448-Y452 WeakPolarHBondContact O-CB 3.45Å; G448-Y452 PolarHBondContact O-N 3.07Å
449S83.7Confident80.7Confident55 Ų5591.2 Ų91.239%0.38546%0.455SS..Hα-helixtrans-67.2-35.6177.679.30000113.1K445 T446 K453K445-S449 WeakPolarHBondContact O-CB 3.28Å; K445-S449 PolarHBondContact O-N 2.89Å; T446-S449 PolarHBondContact O-N 3.23Å; T446-S449 PolarHBondContact O-OG 3.14Å; S449-K453 WeakPolarHBondContact O-CG 3.49Å; S449-K453 PolarHBondContact O-N 3.49Å; S449-K453 VanDerWaalsContact O-N 3.15Å
450E80Confident80.8Confident77 Ų7791.5 Ų91.536%0.3646%0.459SS..Hα-helixtrans-71.6-42.7174.8-68.8-164.9140.100111.4T446 V447 Y452 K453 L454T446-E450 PolarHBondContact O-N 3.01Å; V447-E450 PolarHBondContact O-N 3.31Å; E450-Y452 VanDerWaalsContact C-N 3.3Å; E450-Y452 PolarHBondContact O-N 3.42Å; E450-K453 PolarHBondContact O-N 3.01Å; E450-L454 WeakPolarHBondContact O-CG 3.47Å; E450-L454 PolarHBondContact O-N 2.9Å
451N78.8Confident80.7Confident53 Ų5389.8 Ų89.828%0.28346%0.457SS..Hα-helixtrans-61.1-37.4173.3-88.1-83.6000112.6V447 G448 L454 R455V447-N451 WeakPolarHBondContact CG1-ND2 3.29Å; V447-N451 WeakPolarHBondContact O-CB 3.49Å; V447-N451 PolarHBondContact O-N 2.88Å; V447-N451 PolarHBondContact O-ND2 2.99Å; G448-N451 PolarHBondContact O-N 2.9Å; N451-L454 PolarHBondContact O-N 3.1Å; N451-R455 VanDerWaalsContact O-CG 3.3Å; N451-R455 WeakPolarHBondContact O-CG 3.49Å; N451-R455 PolarHBondContact O-N 3.34Å
452Y83Confident80.7Confident157 Ų15789.7 Ų89.762%0.61646%0.459SS*.Hα-helixtrans-62.8-49.2174.7-174.5-85.6000111.1G448 E450 L454 R455 E456G448-Y452 WeakPolarHBondContact O-CB 3.45Å; G448-Y452 PolarHBondContact O-N 3.07Å; E450-Y452 VanDerWaalsContact C-N 3.3Å; E450-Y452 PolarHBondContact O-N 3.42Å; Y452-L454 VanDerWaalsContact C-N 3.34Å; Y452-L454 PolarHBondContact O-N 2.93Å; Y452-R455 WeakPolarHBondContact O-CB 3.35Å; Y452-R455 PolarHBondContact O-N 3.49Å; Y452-R455 VanDerWaalsContact O-N 3.16Å; Y452-E456 PolarHBondContact O-N 3.02Å
453K84Confident80.7Confident124 Ų12489.4 Ų89.454%0.53946%0.46SS..Hα-helixtrans-59.7-40.7176-71.9171.1-178.6174.60112.7S449 E450 E456 Q457S449-K453 WeakPolarHBondContact O-CG 3.49Å; S449-K453 PolarHBondContact O-N 3.49Å; S449-K453 VanDerWaalsContact O-N 3.15Å; E450-K453 PolarHBondContact O-N 3.01Å; K453-E456 PolarHBondContact O-N 3.46Å; K453-Q457 WeakPolarHBondContact O-CB 3.32Å; K453-Q457 WeakPolarHBondContact O-CG 3.37Å; K453-Q457 PolarHBondContact O-N 3.35Å
454L76.9Confident80.7Confident73 Ų7394.1 Ų94.138%0.38248%0.48SS..Hα-helixtrans-65.5-37.2176.5-73.1169.8000112.1E450 N451 Y452 L458E450-L454 WeakPolarHBondContact O-CG 3.47Å; E450-L454 PolarHBondContact O-N 2.9Å; N451-L454 PolarHBondContact O-N 3.1Å; Y452-L454 VanDerWaalsContact C-N 3.34Å; Y452-L454 PolarHBondContact O-N 2.93Å; L454-L458 VanDerWaalsContact O-CB 3.27Å; L454-L458 WeakPolarHBondContact O-CB 3.35Å; L454-L458 PolarHBondContact O-N 3.23Å
455R79Confident80.5Confident171 Ų17193 Ų9365%0.64548%0.475SS*.Hα-helixtrans-67.5-39.3173.4-73.7170.4-177.9-96.90.7112.2N451 Y452 L458 N459N451-R455 VanDerWaalsContact O-CG 3.3Å; N451-R455 WeakPolarHBondContact O-CG 3.49Å; N451-R455 PolarHBondContact O-N 3.34Å; Y452-R455 WeakPolarHBondContact O-CB 3.35Å; Y452-R455 PolarHBondContact O-N 3.49Å; Y452-R455 VanDerWaalsContact O-N 3.16Å; R455-L458 PolarHBondContact O-N 2.89Å; R455-N459 WeakPolarHBondContact O-CB 3.43Å; R455-N459 VanDerWaalsContact O-CG 3.24Å; R455-N459 PolarHBondContact O-N 3.15Å; R455-N459 PolarHBondContact O-ND2 3.5Å
456E81.4Confident80.5Confident95 Ų9592 Ų9244%0.44447%0.471SS..Hα-helixtrans-62.8-49.5175.3-165.7165.3-142.800110.7Y452 K453 L458 N459 E460Y452-E456 PolarHBondContact O-N 3.02Å; K453-E456 PolarHBondContact O-N 3.46Å; E456-L458 VanDerWaalsContact C-N 3.34Å; E456-L458 PolarHBondContact O-N 3.32Å; E456-N459 PolarHBondContact O-N 2.97Å; E456-E460 WeakPolarHBondContact O-CG 3.44Å; E456-E460 PolarHBondContact O-N 3.25Å
457Q79.9Confident80.6Confident118 Ų11894.4 Ų94.455%0.55148%0.477SS*.Hα-helixtrans-60.7-37.7173.8-72.8178.1-10.800113.3K453 A461K453-Q457 WeakPolarHBondContact O-CB 3.32Å; K453-Q457 WeakPolarHBondContact O-CG 3.37Å; K453-Q457 PolarHBondContact O-N 3.35Å; Q457-A461 WeakPolarHBondContact O-CB 3.42Å; Q457-A461 PolarHBondContact O-N 2.94Å
458L79.7Confident80.5Confident106 Ų10696.4 Ų96.456%0.55549%0.487SS*.Hα-helixtrans-66.5-41.8175.8-175.661.2000111.5L454 R455 E456 A461 C462L454-L458 VanDerWaalsContact O-CB 3.27Å; L454-L458 WeakPolarHBondContact O-CB 3.35Å; L454-L458 PolarHBondContact O-N 3.23Å; R455-L458 PolarHBondContact O-N 2.89Å; E456-L458 VanDerWaalsContact C-N 3.34Å; E456-L458 PolarHBondContact O-N 3.32Å; L458-A461 PolarHBondContact O-N 2.9Å; L458-C462 WeakPolarHBondContact O-CB 3.42Å; L458-C462 PolarHBondContact O-N 3.37Å; L458-C462 PolarHBondContact O-SG 3.36Å; L458-C462 VanDerWaalsContact O-SG 3.41Å
459N81.4Confident80.4Confident106 Ų106100.5 Ų100.557%0.56750%0.495SS*.Hα-helixtrans-64.7-43175.6-73.3-18.4000111.5R455 E456 C462 C463R455-N459 WeakPolarHBondContact O-CB 3.43Å; R455-N459 VanDerWaalsContact O-CG 3.24Å; R455-N459 PolarHBondContact O-N 3.15Å; R455-N459 PolarHBondContact O-ND2 3.5Å; E456-N459 PolarHBondContact O-N 2.97Å; N459-C462 PolarHBondContact O-N 3.13Å; N459-C463 PolarHBondContact O-N 2.9Å; N459-C463 PolarHBondContact O-SG 3.43Å; N459-C463 VanDerWaalsContact O-SG 3.41Å
460E80.9Confident80.6Confident128 Ų128103.4 Ų103.460%0.59850%0.502SS*.Hα-helixtrans-58.7-46.4172.8-72.6-178.5163.200111.6E456 C462 C463 F464E456-E460 WeakPolarHBondContact O-CG 3.44Å; E456-E460 PolarHBondContact O-N 3.25Å; E460-C462 PolarHBondContact O-N 2.71Å; E460-C463 PolarHBondContact O-N 3.4Å; E460-F464 WeakPolarHBondContact O-CB 3.5Å; E460-F464 PolarHBondContact O-N 3.06Å
461A75.4Confident80.7Confident46 Ų46104.7 Ų104.738%0.3851%0.508SS..Hα-helixtrans-64.1-38.2177.300000112.7Q457 L458 F464 N465Q457-A461 WeakPolarHBondContact O-CB 3.42Å; Q457-A461 PolarHBondContact O-N 2.94Å; L458-A461 PolarHBondContact O-N 2.9Å; A461-F464 PolarHBondContact O-N 2.88Å; A461-N465 WeakPolarHBondContact O-CB 3.37Å; A461-N465 PolarHBondContact O-N 3.47Å
462C79.4Confident80.8Confident71 Ų71106.7 Ų106.748%0.4852%0.518SS..Hα-helixtrans-64.5-43173.2-78.60000112.1L458 N459 E460 N465 K466L458-C462 WeakPolarHBondContact O-CB 3.42Å; L458-C462 PolarHBondContact O-N 3.37Å; L458-C462 PolarHBondContact O-SG 3.36Å; L458-C462 VanDerWaalsContact O-SG 3.41Å; N459-C462 PolarHBondContact O-N 3.13Å; E460-C462 PolarHBondContact O-N 2.71Å; C462-N465 PolarHBondContact O-N 2.74Å; C462-K466 WeakPolarHBondContact O-CB 3.27Å; C462-K466 PolarHBondContact O-N 3.04Å
463C81.1Confident80.9Confident81 Ų81106 Ų10655%0.54752%0.52SS..Hα-helixtrans-62-41.8174-74.90000112.1N459 E460 K466 Q467N459-C463 PolarHBondContact O-N 2.9Å; N459-C463 PolarHBondContact O-SG 3.43Å; N459-C463 VanDerWaalsContact O-SG 3.41Å; E460-C463 PolarHBondContact O-N 3.4Å; C463-K466 PolarHBondContact O-N 3.46Å; C463-Q467 WeakPolarHBondContact O-CG 3.46Å; C463-Q467 PolarHBondContact O-N 2.84Å; C463-Q467 VanDerWaalsContact O-N 3.13Å
464F79.7Confident81Confident119 Ų119105.3 Ų105.352%0.52252%0.522SS..Hα-helixtrans-66-43.6177-178.6-105.9000112.6E460 A461 K466 Q467 L468E460-F464 WeakPolarHBondContact O-CB 3.5Å; E460-F464 PolarHBondContact O-N 3.06Å; A461-F464 PolarHBondContact O-N 2.88Å; F464-K466 VanDerWaalsContact C-N 3.33Å; F464-K466 PolarHBondContact O-N 3.04Å; F464-Q467 WeakPolarHBondContact O-CB 3.44Å; F464-Q467 PolarHBondContact O-N 3.12Å; F464-L468 HydrophobicContact CD1-CD1 3.92Å; F464-L468 HydrophobicContact CD1-CG 4.47Å; F464-L468 HydrophobicContact CE1-CD1 3.41Å; F464-L468 VanDerWaalsContact CE1-CD1 3.41Å; F464-L468 HydrophobicContact CE1-CG 4.07Å; F464-L468 HydrophobicContact CZ-CD1 3.92Å; F464-L468 HydrophobicContact CZ-CD2 4.44Å; F464-L468 HydrophobicContact CZ-CG 4.16Å; F464-L468 PolarHBondContact O-N 2.88Å
465N76.9Confident81.3Confident86 Ų86109.6 Ų109.646%0.4653%0.533SS..Hα-helixtrans-60.1-42.7174.7-76.1-15.6000111.6A461 C462 Q467 L468 E469A461-N465 WeakPolarHBondContact O-CB 3.37Å; A461-N465 PolarHBondContact O-N 3.47Å; C462-N465 PolarHBondContact O-N 2.74Å; N465-Q467 VanDerWaalsContact C-N 3.29Å; N465-Q467 PolarHBondContact O-N 2.96Å; N465-L468 WeakPolarHBondContact O-CB 3.49Å; N465-L468 PolarHBondContact O-N 3.43Å; N465-L468 VanDerWaalsContact O-N 3.09Å; N465-E469 WeakPolarHBondContact O-CG 3.31Å; N465-E469 PolarHBondContact O-N 2.98Å
466K84.8Confident81.5Confident133 Ų133105.7 Ų105.758%0.57853%0.525SS*.Hα-helixtrans-62.7-34.3176.8-167.2172.6-175.3175.60112.8C462 C463 F464 Q470C462-K466 WeakPolarHBondContact O-CB 3.27Å; C462-K466 PolarHBondContact O-N 3.04Å; C463-K466 PolarHBondContact O-N 3.46Å; F464-K466 VanDerWaalsContact C-N 3.33Å; F464-K466 PolarHBondContact O-N 3.04Å; K466-Q470 WeakPolarHBondContact O-CG 3.4Å; K466-Q470 PolarHBondContact O-N 3.2Å
467Q83Confident81.8Confident116 Ų116105.7 Ų105.754%0.54253%0.525SS..Hα-helixtrans-69.9-38.3172-72.2178.9-7.100112.4C463 F464 N465 Q470 Q471C463-Q467 WeakPolarHBondContact O-CG 3.46Å; C463-Q467 PolarHBondContact O-N 2.84Å; C463-Q467 VanDerWaalsContact O-N 3.13Å; F464-Q467 WeakPolarHBondContact O-CB 3.44Å; F464-Q467 PolarHBondContact O-N 3.12Å; N465-Q467 VanDerWaalsContact C-N 3.29Å; N465-Q467 PolarHBondContact O-N 2.96Å; Q467-Q470 PolarHBondContact O-N 3.17Å; Q467-Q471 PolarHBondContact O-N 3.38Å
468L79.6Confident82Confident69 Ų69103.3 Ų103.336%0.36152%0.518SS..Hα-helixtrans-65.2-42.7175.1-78.5175.7000112.1F464 N465 Q470 Q471 I472F464-L468 HydrophobicContact CD1-CD1 3.92Å; F464-L468 HydrophobicContact CD1-CG 4.47Å; F464-L468 HydrophobicContact CE1-CD1 3.41Å; F464-L468 VanDerWaalsContact CE1-CD1 3.41Å; F464-L468 HydrophobicContact CE1-CG 4.07Å; F464-L468 HydrophobicContact CZ-CD1 3.92Å; F464-L468 HydrophobicContact CZ-CD2 4.44Å; F464-L468 HydrophobicContact CZ-CG 4.16Å; F464-L468 PolarHBondContact O-N 2.88Å; N465-L468 WeakPolarHBondContact O-CB 3.49Å; N465-L468 PolarHBondContact O-N 3.43Å; N465-L468 VanDerWaalsContact O-N 3.09Å; L468-Q470 PolarHBondContact O-N 3Å; L468-Q471 PolarHBondContact O-N 3.26Å; L468-I472 VanDerWaalsContact O-CG1 3.29Å; L468-I472 WeakPolarHBondContact O-CG1 3.37Å; L468-I472 PolarHBondContact O-N 3.04Å
469E80.8Confident82.1Confident126 Ų126103.2 Ų103.259%0.58952%0.517SS*.Hα-helixtrans-56.7-49175-73.4167.2172.400110.8N465 Q471 I472 E473N465-E469 WeakPolarHBondContact O-CG 3.31Å; N465-E469 PolarHBondContact O-N 2.98Å; E469-Q471 VanDerWaalsContact C-N 3.33Å; E469-Q471 PolarHBondContact O-N 3.42Å; E469-I472 PolarHBondContact O-N 2.83Å; E469-I472 VanDerWaalsContact O-N 3.14Å; E469-E473 WeakPolarHBondContact O-CB 3.46Å; E469-E473 PolarHBondContact O-N 3.1Å
470Q86.7Confident82.1Confident116 Ų116101.9 Ų101.954%0.54252%0.516SS..Hα-helixtrans-59.7-38.5175.2-72.2175.1-16.100113.1K466 Q467 L468 L474K466-Q470 WeakPolarHBondContact O-CG 3.4Å; K466-Q470 PolarHBondContact O-N 3.2Å; Q467-Q470 PolarHBondContact O-N 3.17Å; L468-Q470 PolarHBondContact O-N 3Å; Q470-L474 WeakPolarHBondContact O-CB 3.47Å; Q470-L474 PolarHBondContact O-N 3.49Å
471Q81.9Confident82.2Confident105 Ų105101.3 Ų101.349%0.49151%0.511SS..Hα-helixtrans-70.1-35.4174.9-75.3-163.527.400113.2Q467 L468 E469 R475Q467-Q471 PolarHBondContact O-N 3.38Å; L468-Q471 PolarHBondContact O-N 3.26Å; E469-Q471 VanDerWaalsContact C-N 3.33Å; E469-Q471 PolarHBondContact O-N 3.42Å; Q471-R475 WeakPolarHBondContact O-CB 3.45Å; Q471-R475 VanDerWaalsContact O-CG 3.27Å; Q471-R475 WeakPolarHBondContact O-CG 3.34Å; Q471-R475 PolarHBondContact O-N 2.98Å
472I82.1Confident82.3Confident95 Ų95102.7 Ų102.749%0.48751%0.512SS..Hα-helixtrans-67.2-43.1176.1-70.5164.5000109.8L468 E469 R475 N476L468-I472 VanDerWaalsContact O-CG1 3.29Å; L468-I472 WeakPolarHBondContact O-CG1 3.37Å; L468-I472 PolarHBondContact O-N 3.04Å; E469-I472 PolarHBondContact O-N 2.83Å; E469-I472 VanDerWaalsContact O-N 3.14Å; I472-R475 PolarHBondContact O-N 2.98Å; I472-N476 WeakPolarHBondContact O-CB 3.42Å; I472-N476 VanDerWaalsContact O-CG 3.22Å; I472-N476 PolarHBondContact O-N 3.21Å; I472-N476 PolarHBondContact O-ND2 3.08Å
473E84.3Confident82.3Confident141 Ų141105 Ų10566%0.65951%0.514SS*.Hα-helixtrans-61-48.9176.8-168.2165.9-144.900111.6E469 R475 N476 E477E469-E473 WeakPolarHBondContact O-CB 3.46Å; E469-E473 PolarHBondContact O-N 3.1Å; E473-R475 VanDerWaalsContact C-N 3.31Å; E473-R475 PolarHBondContact O-N 3.39Å; E473-N476 PolarHBondContact O-N 3.06Å; E473-E477 PolarHBondContact O-N 2.92Å
474L86.6Confident82.1Confident111 Ų111104.5 Ų104.558%0.58151%0.511SS*.Hα-helixtrans-59.5-38.6175.1-165.392.9000112.8Q470 T478Q470-L474 WeakPolarHBondContact O-CB 3.47Å; Q470-L474 PolarHBondContact O-N 3.49Å; L474-T478 WeakPolarHBondContact O-CB 3.14Å; L474-T478 PolarHBondContact O-N 3.32Å; L474-T478 PolarHBondContact O-OG1 3.03Å
475R83.7Confident81.9Confident162 Ų162102.2 Ų102.261%0.61150%0.501SS*.Hα-helixtrans-68-42.3175.5-77.8177.4-176.3-168.74.2111.8Q471 I472 E473 T478 I479Q471-R475 WeakPolarHBondContact O-CB 3.45Å; Q471-R475 VanDerWaalsContact O-CG 3.27Å; Q471-R475 WeakPolarHBondContact O-CG 3.34Å; Q471-R475 PolarHBondContact O-N 2.98Å; I472-R475 PolarHBondContact O-N 2.98Å; E473-R475 VanDerWaalsContact C-N 3.31Å; E473-R475 PolarHBondContact O-N 3.39Å; R475-T478 WeakPolarHBondContact O-CB 3.43Å; R475-T478 PolarHBondContact O-N 3.08Å; R475-I479 VanDerWaalsContact O-CG1 3.28Å; R475-I479 WeakPolarHBondContact O-CG1 3.23Å; R475-I479 PolarHBondContact O-N 3.04Å
476N83Confident81.8Confident89 Ų89104.2 Ų104.248%0.47651%0.512SS..Hα-helixtrans-63.4-43.4176.6-70.8-18.2000111I472 E473 T478 I479 C480I472-N476 WeakPolarHBondContact O-CB 3.42Å; I472-N476 VanDerWaalsContact O-CG 3.22Å; I472-N476 PolarHBondContact O-N 3.21Å; I472-N476 PolarHBondContact O-ND2 3.08Å; E473-N476 PolarHBondContact O-N 3.06Å; N476-T478 VanDerWaalsContact C-N 3.3Å; N476-T478 PolarHBondContact O-N 3.39Å; N476-I479 PolarHBondContact O-N 3.27Å; N476-C480 PolarHBondContact O-N 2.92Å; N476-C480 PolarHBondContact O-SG 3.48Å; N476-C480 VanDerWaalsContact O-SG 3.38Å
477E86.8Confident81.4Confident95 Ų95104.3 Ų104.344%0.44451%0.514SS..Hα-helixtrans-58.8-42173.6-164.5-161.6161.800111.6E473 C480 K481E473-E477 PolarHBondContact O-N 2.92Å; E477-C480 PolarHBondContact O-N 3.13Å; E477-K481 WeakPolarHBondContact O-CG 3.48Å; E477-K481 PolarHBondContact O-N 3.49Å; E477-K481 WeakPolarHBondContact OE1-CE 3.25Å; E477-K481 IonicContact OE1-NZ 2.64Å; E477-K481 PolarHBondContact OE1-NZ 2.92Å
478T84.6Confident80.9Confident68 Ų68103.6 Ų103.642%0.41751%0.514SS..Hα-helixtrans-64.7-43.1176.2-55.60000111.9L474 R475 N476 K481 L482L474-T478 WeakPolarHBondContact O-CB 3.14Å; L474-T478 PolarHBondContact O-N 3.32Å; L474-T478 PolarHBondContact O-OG1 3.03Å; R475-T478 WeakPolarHBondContact O-CB 3.43Å; R475-T478 PolarHBondContact O-N 3.08Å; N476-T478 VanDerWaalsContact C-N 3.3Å; N476-T478 PolarHBondContact O-N 3.39Å; T478-K481 PolarHBondContact O-N 2.92Å; T478-L482 HydrophobicContact CG2-CD1 4.2Å; T478-L482 WeakPolarHBondContact O-CG 3.43Å; T478-L482 PolarHBondContact O-N 3.2Å
479I81.6Confident79.8Confident104 Ų104103.6 Ų103.653%0.53353%0.531SS..Hα-helixtrans-62.8-42.8176.1-70.5163.7000110.6R475 N476 L482 K483R475-I479 VanDerWaalsContact O-CG1 3.28Å; R475-I479 WeakPolarHBondContact O-CG1 3.23Å; R475-I479 PolarHBondContact O-N 3.04Å; N476-I479 PolarHBondContact O-N 3.27Å; I479-L482 PolarHBondContact O-N 3.25Å; I479-K483 VanDerWaalsContact O-CB 3.32Å; I479-K483 WeakPolarHBondContact O-CB 3.37Å; I479-K483 PolarHBondContact O-N 3.46Å
480C80.6Confident78.4Confident79 Ų79104.1 Ų104.153%0.53453%0.531SS..Hα-helixtrans-60.8-46.5174.5-72.50000111.8N476 E477 L482 K483 C484N476-C480 PolarHBondContact O-N 2.92Å; N476-C480 PolarHBondContact O-SG 3.48Å; N476-C480 VanDerWaalsContact O-SG 3.38Å; E477-C480 PolarHBondContact O-N 3.13Å; C480-L482 PolarHBondContact O-N 3.05Å; C480-K483 PolarHBondContact O-N 2.93Å; C480-C484 PolarHBondContact O-N 3.19Å; C480-C484 PolarHBondContact O-SG 3.03Å; C480-C484 VanDerWaalsContact O-SG 3.34Å
481K83.5Confident76.8Confident115 Ų115104 Ų10450%0.554%0.543SS..Hα-helixtrans-59-45.2176.1-75.4171.3-179169.30112.5E477 T478 C484 Q485E477-K481 WeakPolarHBondContact O-CG 3.48Å; E477-K481 PolarHBondContact O-N 3.49Å; E477-K481 WeakPolarHBondContact OE1-CE 3.25Å; E477-K481 IonicContact OE1-NZ 2.64Å; E477-K481 PolarHBondContact OE1-NZ 2.92Å; T478-K481 PolarHBondContact O-N 2.92Å; K481-C484 PolarHBondContact O-N 2.92Å; K481-Q485 WeakPolarHBondContact O-CG 3.37Å; K481-Q485 PolarHBondContact O-N 3.45Å
482L77.3Confident75.5Confident76 Ų76104 Ų10440%0.39855%0.546SS..Hα-helixtrans-65.5-38.5176.7-71.6170.7000112.1T478 I479 C480 Q485 L486 L492T478-L482 HydrophobicContact CG2-CD1 4.2Å; T478-L482 WeakPolarHBondContact O-CG 3.43Å; T478-L482 PolarHBondContact O-N 3.2Å; I479-L482 PolarHBondContact O-N 3.25Å; C480-L482 PolarHBondContact O-N 3.05Å; L482-Q485 PolarHBondContact O-N 3.15Å; L482-L486 WeakPolarHBondContact O-CG 3.49Å; L482-L486 PolarHBondContact O-N 3.27Å; L482-L492 HydrophobicContact CD2-CD2 4.47Å
483K79.9Confident74.2Confident119 Ų119103.9 Ų103.952%0.51755%0.551SS.*Hα-helixtrans-63.6-46176.5-171.9-179.2170.5-1680111.4I479 C480 Q485 L486 E487I479-K483 VanDerWaalsContact O-CB 3.32Å; I479-K483 WeakPolarHBondContact O-CB 3.37Å; I479-K483 PolarHBondContact O-N 3.46Å; C480-K483 PolarHBondContact O-N 2.93Å; K483-Q485 VanDerWaalsContact C-N 3.33Å; K483-Q485 PolarHBondContact O-N 2.86Å; K483-L486 PolarHBondContact O-N 3.25Å; K483-E487 WeakPolarHBondContact CE-OE1 3.49Å; K483-E487 IonicContact NZ-OE1 3.72Å; K483-E487 WeakPolarHBondContact O-CG 3.12Å; K483-E487 PolarHBondContact O-N 3.48Å
484C77.1Confident72.6Confident71 Ų71103.1 Ų103.148%0.4856%0.559SS.*Hα-helixtrans-61.8-39175.1-64.40000112.3C480 K481 L486 E487 D488C480-C484 PolarHBondContact O-N 3.19Å; C480-C484 PolarHBondContact O-SG 3.03Å; C480-C484 VanDerWaalsContact O-SG 3.34Å; K481-C484 PolarHBondContact O-N 2.92Å; C484-L486 VanDerWaalsContact C-N 3.34Å; C484-L486 PolarHBondContact O-N 3.33Å; C484-E487 PolarHBondContact O-N 3.48Å; C484-D488 VanDerWaalsContact O-CB 3.3Å; C484-D488 WeakPolarHBondContact O-CB 3.46Å; C484-D488 PolarHBondContact O-N 3.27Å
485Q75.4Confident70.7Confident70 Ų70103.1 Ų103.133%0.32757%0.568SS.*Hα-helixtrans-63-38.6175.6-73.7174.14.200112.9K481 L482 K483 K490K481-Q485 WeakPolarHBondContact O-CG 3.37Å; K481-Q485 PolarHBondContact O-N 3.45Å; L482-Q485 PolarHBondContact O-N 3.15Å; K483-Q485 VanDerWaalsContact C-N 3.33Å; K483-Q485 PolarHBondContact O-N 2.86Å; Q485-K490 PolarHBondContact O-N 3.45Å
486L73.9Confident68.7Low129 Ų129102.1 Ų102.168%0.67557%0.57SS**Hα-helixtrans-69.5-38.4175.7-72.5167.2000112.5L482 K483 C484 G489L482-L486 WeakPolarHBondContact O-CG 3.49Å; L482-L486 PolarHBondContact O-N 3.27Å; K483-L486 PolarHBondContact O-N 3.25Å; C484-L486 VanDerWaalsContact C-N 3.34Å; C484-L486 PolarHBondContact O-N 3.33Å; L486-G489 PolarHBondContact O-N 3.24Å
487E76.4Confident66.8Low135 Ų135103.9 Ų103.963%0.63158%0.584SS**Hα-helixtrans-71.7-34.9177.1-72174.1167.800112.2K483 C484 G489K483-E487 WeakPolarHBondContact CE-OE1 3.49Å; K483-E487 IonicContact NZ-OE1 3.72Å; K483-E487 WeakPolarHBondContact O-CG 3.12Å; K483-E487 PolarHBondContact O-N 3.48Å; C484-E487 PolarHBondContact O-N 3.48Å; E487-G489 PolarHBondContact O-N 2.86Å
488D73.1Confident64.8Low100 Ų100109.2 Ų109.254%0.53560%0.6SS.*THydrogen-bonded Turntrans-70.8-6.5175.8-93.111.8000114.4C484 K490C484-D488 VanDerWaalsContact O-CB 3.3Å; C484-D488 WeakPolarHBondContact O-CB 3.46Å; C484-D488 PolarHBondContact O-N 3.27Å; D488-K490 HydrophobicContact CB-CD 4.09Å; D488-K490 HydrophobicContact CB-CG 4.25Å; D488-K490 PolarHBondContact O-N 3.18Å; D488-K490 VanDerWaalsContact O-N 3.1Å; D488-K490 IonicContact OD2-NZ 2.92Å; D488-K490 PolarHBondContact OD2-NZ 3.37Å
489G56Low62.7Low70 Ų70114 Ų11472%0.72262%0.617SS**THydrogen-bonded Turntrans64.212.4-177.400000114.8L486 E487L486-G489 PolarHBondContact O-N 3.24Å; E487-G489 PolarHBondContact O-N 2.86Å
490K52.7Low61.1Low137 Ų137112.9 Ų112.960%0.59662%0.618SS**PPolyproline II helixtrans-82.8125.1179.7-71.3167.5-170.4150.50109.4Q485 D488 L492Q485-K490 PolarHBondContact O-N 3.45Å; D488-K490 HydrophobicContact CB-CD 4.09Å; D488-K490 HydrophobicContact CB-CG 4.25Å; D488-K490 PolarHBondContact O-N 3.18Å; D488-K490 VanDerWaalsContact O-N 3.1Å; D488-K490 IonicContact OD2-NZ 2.92Å; D488-K490 PolarHBondContact OD2-NZ 3.37Å; K490-L492 PolarHBondContact O-N 3.01Å
491S53Low59.6Low113 Ų113114.2 Ų114.279%0.7963%0.628SS**PPolyproline II helixtrans-54135.717245.90000110.6
492L54.2Low58.1Low106 Ų106117 Ų11756%0.55564%0.643SS**PPolyproline II helixtrans-55.6133.8175-85.684000109.4L482 K490L482-L492 HydrophobicContact CD2-CD2 4.47Å; K490-L492 PolarHBondContact O-N 3.01Å
493P54.5Low56.8Low92 Ų92118.6 Ų118.660%0.59766%0.659SS**PPolyproline II helixtrans-61.1142.3165.327.7-33.1000108.7S495P493-S495 PolarHBondContact O-N 3.35Å; P493-S495 VanDerWaalsContact O-N 3.14Å
494P49.7Very low54.9Low125 Ų125118.1 Ų118.181%0.81267%0.667SS**PPolyproline II helixtrans-59.8122.917724.9-32.5000108.8E496P494-E496 PolarHBondContact O-N 3.06Å
495S47.1Very low53.4Low110 Ų110124.5 Ų124.577%0.76969%0.686SS**  trans-69.697.3-174.756.40000110.7P493 T497P493-S495 PolarHBondContact O-N 3.35Å; P493-S495 VanDerWaalsContact O-N 3.14Å; S495-T497 PolarHBondContact O-N 3.46Å; S495-T497 VanDerWaalsContact O-N 3.13Å
496E42.6Very low51.8Low141 Ų141130.9 Ų130.966%0.65971%0.713SS**  trans-54117159.9-77.5-168.1156.700108.7P494 R498P494-E496 PolarHBondContact O-N 3.06Å; E496-R498 HydrophobicContact CB-CG 4.43Å; E496-R498 PolarHBondContact O-N 3.03Å; E496-R498 IonicContact OE2-CZ 3.6Å; E496-R498 IonicContact OE2-NE 3.78Å; E496-R498 PolarHBondContact OE2-NE 2.86Å; E496-R498 VanDerWaalsContact OE2-NE 3.08Å; E496-R498 IonicContact OE2-NH2 2.59Å; E496-R498 PolarHBondContact OE2-NH2 2.73Å
497T42.4Very low50.3Low126 Ų126133.6 Ų133.677%0.77372%0.722SS**  trans-71.469.8176.7-30000110.8S495 H499S495-T497 PolarHBondContact O-N 3.46Å; S495-T497 VanDerWaalsContact O-N 3.13Å; T497-H499 PolarHBondContact O-N 3.32Å
498R44.9Very low48.8Very low207 Ų207132.9 Ų132.978%0.78173%0.729SS**  trans-68.994.8170.1-67.9-170.2-174.8-162.90109E496 C500E496-R498 HydrophobicContact CB-CG 4.43Å; E496-R498 PolarHBondContact O-N 3.03Å; E496-R498 IonicContact OE2-CZ 3.6Å; E496-R498 IonicContact OE2-NE 3.78Å; E496-R498 PolarHBondContact OE2-NE 2.86Å; E496-R498 VanDerWaalsContact OE2-NE 3.08Å; E496-R498 IonicContact OE2-NH2 2.59Å; E496-R498 PolarHBondContact OE2-NH2 2.73Å; R498-C500 PolarHBondContact O-N 3.43Å
499H41.6Very low47.3Very low169 Ų169137.3 Ų137.378%0.78274%0.743SS**  trans-51.5125.2171.7-78.9-9.6000110.6T497 S501T497-H499 PolarHBondContact O-N 3.32Å; H499-S501 PolarHBondContact O-N 3.32Å
500C46.6Very low46.7Very low80 Ų80139.6 Ų139.654%0.54175%0.749SS.*  trans-67.2103.7174.2-177.90000109.7R498 Q502 C503R498-C500 PolarHBondContact O-N 3.43Å; C500-Q502 PolarHBondContact O-N 2.82Å; C500-C503 PolarHBondContact O-N 3.02Å
501S48.8Very low46.1Very low108 Ų108139 Ų13976%0.75576%0.757SS**THydrogen-bonded Turntrans-68.32.8179.553.10000114.5H499H499-S501 PolarHBondContact O-N 3.32Å
502Q52.1Low45.6Very low174 Ų174142.8 Ų142.881%0.81376%0.759SS**THydrogen-bonded Turntrans-99.5-9.8173.9-63-169.1-1.100114C500 T504C500-Q502 PolarHBondContact O-N 2.82Å; Q502-T504 VanDerWaalsContact C-N 3.26Å; Q502-T504 PolarHBondContact O-N 3.05Å
503C49.8Very low45Very low109 Ų109148.3 Ų148.374%0.73677%0.772SS**SBendtrans-81.94.7179.1-670000114.5C500C500-C503 PolarHBondContact O-N 3.02Å
504T41.8Very low44.4Very low109 Ų109149.1 Ų149.167%0.66978%0.78SS**  trans-124.779.1-177.845.60000112.6Q502Q502-T504 VanDerWaalsContact C-N 3.26Å; Q502-T504 PolarHBondContact O-N 3.05Å
505K44.2Very low44.5Very low204 Ų204152 Ų15289%0.88778%0.78SS**  trans-159.8135.5159.5-108.7146.8-168.6176.30113.1
506K43.1Very low44.6Very low204 Ų204151.8 Ų151.889%0.88778%0.778SS**  trans74.972.7177.2-58.9-173.5178.6-179.50117.1
507E41.6Very low44.7Very low186 Ų186151.5 Ų151.587%0.86979%0.786SS**  trans-60.8132.2133.7-70.5-175.8127.700109.3K509E507-K509 PolarHBondContact O-N 2.96Å
508P44.3Very low45.3Very low120 Ų120155 Ų15578%0.77979%0.794SS**  trans-78.4114.2165.130.1-29.7000109.5S510P508-S510 PolarHBondContact O-N 2.97Å; P508-S510 VanDerWaalsContact O-N 3.1Å
509K41.6Very low45.5Very low193 Ų193150.3 Ų150.384%0.83979%0.793SS**  trans-53.7114.6176-71.1179.9176.1-179.80111.1E507 T511E507-K509 PolarHBondContact O-N 2.96Å; K509-T511 VanDerWaalsContact C-N 3.3Å; K509-T511 PolarHBondContact O-N 3.21Å
510S43.2Very low45.6Very low119 Ų119154.9 Ų154.983%0.83282%0.818SS**  trans-75.881.8168.751.20000110.3P508 K512P508-S510 PolarHBondContact O-N 2.97Å; P508-S510 VanDerWaalsContact O-N 3.1Å; S510-K512 PolarHBondContact O-N 3.09Å; S510-K512 VanDerWaalsContact O-N 3.16Å
511T41.2Very low45.6Very low125 Ų125158.6 Ų158.677%0.76783%0.832SS**  trans-68114176.3-53.10000110K509 R513K509-T511 VanDerWaalsContact C-N 3.3Å; K509-T511 PolarHBondContact O-N 3.21Å; T511-R513 PolarHBondContact O-N 3.2Å
512K42.6Very low45.4Very low192 Ų192161.3 Ų161.384%0.83584%0.836SS**  trans-52135.1173.3-65.9174.4177.9176.40110.8S510S510-K512 PolarHBondContact O-N 3.09Å; S510-K512 VanDerWaalsContact O-N 3.16Å
513R40.6Very low45Very low222 Ų222160.6 Ų160.684%0.83884%0.837SS**  trans-135.874.7156.5-151.6176.6-163.4-1745.9111.3T511 K515T511-R513 PolarHBondContact O-N 3.2Å; R513-K515 PolarHBondContact O-N 3.29Å
514S42.5Very low44.8Very low109 Ų109163.6 Ų163.676%0.76284%0.843SS**  trans-60.9125.1156.743.90000109.3
515K52.4Low44.9Very low185 Ų185167 Ų16780%0.80485%0.854SS**  trans-120.9105.2157.7-98.6-164.3167.7-161.60107.7R513R513-K515 PolarHBondContact O-N 3.29Å
516S48.1Very low45Very low105 Ų105164.5 Ų164.573%0.73485%0.851SS**  trans-74.5141.5161.7470000109.6
517T46.2Very low45.1Very low135 Ų135161.7 Ų161.783%0.82885%0.849SS**  trans7.8125.8146.553.20000118.6
518E53.2Low45.4Very low200 Ų200159.8 Ų159.894%0.93585%0.847SS**  trans-145.5149139.8-147.8161.2-146.800108.6
519S50.6Low45.5Very low109 Ų109163.2 Ų163.276%0.76285%0.853SS**  trans-99133.6-163.153.10000114
520M43.8Very low45.9Very low264 Ų264160.5 Ų160.5100%1.385%0.854SS**  -152.10128-82.1-157.27800108.7

Retrieved 520 of 520 residues in 477 ms (Link to these results)