A0A096MJJ4_RAT Loading...

Cilia and flagella associated protein 58

AlphaFold DB , UniProt , Accession A0A096MJJ4, Species RAT (Rattus norvegicus, Rat), Gene Cfap58, Length 873 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
1M34.4Very low42.6Very low239 Ų239139.5 Ų139.5100%1.17774%0.736SS**  0115.50-72.9-101.6-84.300105.8
2S37.4Very low43.7Very low112 Ų112136.3 Ų136.378%0.78371%0.714SS**  trans-15.4122.7177-0.60000116E4S2-E4 PolarHBondContact O-N 3.36Å; S2-E4 VanDerWaalsContact O-N 3.09Å
3E37.1Very low45Very low187 Ų187132.5 Ų132.587%0.87469%0.691SS**  trans-61.3102.7163.2-72.2176151.700109.1K5E3-K5 PolarHBondContact O-N 2.63Å
4E37.4Very low46.8Very low187 Ų187128.6 Ų128.687%0.87468%0.676SS**  trans-69.699.3165.7-79.6-174.1153.700108.7S2S2-E4 PolarHBondContact O-N 3.36Å; S2-E4 VanDerWaalsContact O-N 3.09Å
5K37.7Very low48.8Very low168 Ų168122.7 Ų122.773%0.7365%0.653SS**  trans-57.4124.5169.5-76.1-177.8172.6-175.40110.5E3 D7E3-K5 PolarHBondContact O-N 2.63Å; K5-D7 VanDerWaalsContact C-N 3.31Å; K5-D7 PolarHBondContact O-N 3.18Å; K5-D7 VanDerWaalsContact O-N 3.14Å
6P44.1Very low50.9Low119 Ų119116.1 Ų116.177%0.77362%0.617SS**  trans-8964.717636.9-32.2000110.2K8P6-K8 VanDerWaalsContact C-N 3.31Å; P6-K8 PolarHBondContact O-N 3.06Å
7D42Very low52.7Low123 Ų123117.1 Ų117.166%0.65862%0.617SS**  trans-89.818179.3-86.3-25.3000113.8K5 I9K5-D7 VanDerWaalsContact C-N 3.31Å; K5-D7 PolarHBondContact O-N 3.18Å; K5-D7 VanDerWaalsContact O-N 3.14Å; D7-I9 PolarHBondContact O-N 2.85Å
8K44.9Very low54.3Low187 Ų187117.9 Ų117.981%0.81362%0.617SS**  trans-87.53.8-174.2-86.1-171.1176.5-1790116.7P6 P11P6-K8 VanDerWaalsContact C-N 3.31Å; P6-K8 PolarHBondContact O-N 3.06Å; K8-P11 WeakPolarHBondContact O-CD 3.01Å
9I49.2Very low55.9Low63 Ų63115.9 Ų115.932%0.32361%0.606SS.*SBendtrans-103.3-16.7-175.3-51.6173.1000113.6D7 M61 R65D7-I9 PolarHBondContact O-N 2.85Å; I9-M61 HydrophobicContact CD1-CE 4.38Å; I9-M61 HydrophobicContact CG1-CE 4.39Å; I9-M61 HydrophobicContact CG2-CE 3.59Å; I9-R65 VanDerWaalsContact CG2-NH2 3.33Å
10A51.7Low57.3Low72 Ų72111.9 Ų111.960%0.59558%0.584SS**Hα-helixtrans-59.3-34.7174.300000115.6E12 T14A10-E12 VanDerWaalsContact C-N 3.29Å; A10-E12 PolarHBondContact O-N 3.32Å; A10-T14 PolarHBondContact O-OG1 2.97Å
11P52.4Low58.7Low77 Ų77112.8 Ų112.850%0.558%0.583SS.*Hα-helixtrans-70.2-22.1-174.924.7-31.8000114.3K8 T14 A15K8-P11 WeakPolarHBondContact O-CD 3.01Å; P11-T14 PolarHBondContact O-OG1 3.34Å; P11-T14 VanDerWaalsContact O-OG1 3.04Å; P11-A15 WeakPolarHBondContact O-CB 3.28Å; P11-A15 PolarHBondContact O-N 3.14Å
12E56.4Low61.1Low101 Ų101105.9 Ų105.947%0.47255%0.551SS.*Hα-helixtrans-78.3-37.4-177.1-72.3177.6174.600112.9A10 A15 F16 M61A10-E12 VanDerWaalsContact C-N 3.29Å; A10-E12 PolarHBondContact O-N 3.32Å; E12-A15 PolarHBondContact O-N 3.3Å; E12-F16 PolarHBondContact O-N 2.88Å; E12-M61 WeakPolarHBondContact OE2-CE 3.49Å
13E60.8Low63.5Low87 Ų87101 Ų10141%0.40752%0.516SS..Hα-helixtrans-70.6-38.8178.6-66-162.2129.800111.7A15 F16 E17 Y54 K58E13-A15 PolarHBondContact O-N 3.37Å; E13-F16 PolarHBondContact O-N 3.17Å; E13-E17 PolarHBondContact O-N 3.45Å; E13-Y54 WeakPolarHBondContact CA-OH 2.9Å; E13-Y54 WeakPolarHBondContact CG-OH 3.37Å; E13-K58 WeakPolarHBondContact OE1-CE 3.3Å; E13-K58 IonicContact OE1-NZ 3.29Å; E13-K58 PolarHBondContact OE1-NZ 3.43Å
14T69.1Low65.8Low78 Ų7897.6 Ų97.648%0.47950%0.5SS..Hα-helixtrans-64.9-38.1175.444.60000112.4A10 P11 F16 E17 E18A10-T14 PolarHBondContact O-OG1 2.97Å; P11-T14 PolarHBondContact O-OG1 3.34Å; P11-T14 VanDerWaalsContact O-OG1 3.04Å; T14-F16 PolarHBondContact O-N 3.21Å; T14-E17 PolarHBondContact O-N 3.16Å; T14-E18 WeakPolarHBondContact O-CG 3.44Å; T14-E18 PolarHBondContact O-N 2.62Å; T14-E18 VanDerWaalsContact O-N 3.12Å
15A77.2Confident68.1Low40 Ų4093.2 Ų93.233%0.33148%0.479SS..Hα-helixtrans-66.6-37.7-179.700000112.2P11 E12 E13 I19P11-A15 WeakPolarHBondContact O-CB 3.28Å; P11-A15 PolarHBondContact O-N 3.14Å; E12-A15 PolarHBondContact O-N 3.3Å; E13-A15 PolarHBondContact O-N 3.37Å; A15-I19 WeakPolarHBondContact O-CD1 3.47Å; A15-I19 WeakPolarHBondContact O-CG1 3.06Å; A15-I19 PolarHBondContact O-N 2.81Å; A15-I19 VanDerWaalsContact O-N 3.11Å
16F81.9Confident70.4Confident18 Ų1887.6 Ų87.68%0.07946%0.459CS..Hα-helixtrans-70.7-39.5178-173.9-92.7000112.3E12 E13 T14 E18 I19 E20 M50 K51 Y54E12-F16 PolarHBondContact O-N 2.88Å; E13-F16 PolarHBondContact O-N 3.17Å; T14-F16 PolarHBondContact O-N 3.21Å; F16-E18 VanDerWaalsContact C-N 3.33Å; F16-E18 PolarHBondContact O-N 3.05Å; F16-I19 PolarHBondContact O-N 3.14Å; F16-E20 HydrophobicContact CE1-CB 4.29Å; F16-E20 WeakPolarHBondContact CE1-OE2 3.41Å; F16-E20 WeakPolarHBondContact O-CB 3.45Å; F16-E20 PolarHBondContact O-N 3.37Å; F16-M50 HydrophobicContact CE2-CE 3.87Å; F16-M50 HydrophobicContact CE2-CG 4.25Å; F16-M50 HydrophobicContact CZ-CE 4.29Å; F16-K51 HydrophobicContact CZ-CB 4.32Å; F16-K51 HydrophobicContact CZ-CG 4.39Å; F16-Y54 HydrophobicContact CB-CD1 4.36Å; F16-Y54 HydrophobicContact CB-CD2 3.96Å; F16-Y54 HydrophobicContact CB-CE1 4Å; F16-Y54 HydrophobicContact CB-CE2 3.57Å; F16-Y54 HydrophobicContact CB-CG 4.33Å; F16-Y54 AromaticContact CD1-CD1 3.42Å; F16-Y54 HydrophobicContact CD1-CD1 3.42Å; F16-Y54 VanDerWaalsContact CD1-CD1 3.42Å; F16-Y54 HydrophobicContact CD1-CD2 4.43Å; F16-Y54 AromaticContact CD1-CE1 3.39Å; F16-Y54 HydrophobicContact CD1-CE1 3.39Å; F16-Y54 HydrophobicContact CD1-CE2 4.42Å; F16-Y54 AromaticContact CD1-CG 3.95Å; F16-Y54 HydrophobicContact CD1-CG 3.95Å; F16-Y54 AromaticContact CD1-CZ 3.92Å; F16-Y54 AromaticContact CD2-CD1 3.82Å; F16-Y54 HydrophobicContact CD2-CD1 3.82Å; F16-Y54 AromaticContact CD2-CD2 3.62Å; F16-Y54 HydrophobicContact CD2-CD2 3.62Å; F16-Y54 HydrophobicContact CD2-CE1 4.31Å; F16-Y54 HydrophobicContact CD2-CE2 4.15Å; F16-Y54 AromaticContact CD2-CG 3.43Å; F16-Y54 HydrophobicContact CD2-CG 3.43Å; F16-Y54 VanDerWaalsContact CD2-CG 3.43Å; F16-Y54 AromaticContact CE1-CD1 3.53Å; F16-Y54 HydrophobicContact CE1-CD1 3.53Å; F16-Y54 AromaticContact CE1-CE1 3.92Å; F16-Y54 HydrophobicContact CE1-CE1 3.92Å; F16-Y54 HydrophobicContact CE1-CG 4.12Å; F16-Y54 VanDerWaalsContact CE2-CB 3.42Å; F16-Y54 AromaticContact CE2-CD1 3.92Å; F16-Y54 HydrophobicContact CE2-CD1 3.92Å; F16-Y54 HydrophobicContact CE2-CD2 4.26Å; F16-Y54 AromaticContact CE2-CG 3.62Å; F16-Y54 HydrophobicContact CE2-CG 3.62Å; F16-Y54 AromaticContact CG-CD1 3.57Å; F16-Y54 HydrophobicContact CG-CD1 3.57Å; F16-Y54 AromaticContact CG-CD2 3.73Å; F16-Y54 HydrophobicContact CG-CD2 3.73Å; F16-Y54 AromaticContact CG-CE1 3.61Å; F16-Y54 HydrophobicContact CG-CE1 3.61Å; F16-Y54 AromaticContact CG-CE2 3.79Å; F16-Y54 HydrophobicContact CG-CE2 3.79Å; F16-Y54 AromaticContact CG-CG 3.61Å; F16-Y54 HydrophobicContact CG-CG 3.61Å; F16-Y54 AromaticContact CG-CZ 3.72Å; F16-Y54 AromaticContact CZ-CD1 3.79Å; F16-Y54 HydrophobicContact CZ-CD1 3.79Å; F16-Y54 AromaticContact CZ-CG 3.97Å; F16-Y54 HydrophobicContact CZ-CG 3.97Å
17E81.5Confident72.3Confident133 Ų13383.4 Ų83.462%0.62143%0.43SS*.Hα-helixtrans-63.2-39.1176.8-71.9-178.8177.200112.1E13 T14 E20 K21E13-E17 PolarHBondContact O-N 3.45Å; T14-E17 PolarHBondContact O-N 3.16Å; E17-E20 PolarHBondContact O-N 3.17Å; E17-K21 WeakPolarHBondContact O-CB 3.13Å; E17-K21 PolarHBondContact O-N 3.27Å
18E82.4Confident74.3Confident132 Ų13281 Ų8162%0.61742%0.422SS*.Hα-helixtrans-61.4-48.1172-74.7179.1171.600111.4T14 F16 E20 K21 D22T14-E18 WeakPolarHBondContact O-CG 3.44Å; T14-E18 PolarHBondContact O-N 2.62Å; T14-E18 VanDerWaalsContact O-N 3.12Å; F16-E18 VanDerWaalsContact C-N 3.33Å; F16-E18 PolarHBondContact O-N 3.05Å; E18-E20 PolarHBondContact O-N 3.08Å; E18-K21 WeakPolarHBondContact O-CB 3.18Å; E18-K21 PolarHBondContact O-N 3.29Å; E18-D22 PolarHBondContact O-N 2.67Å
19I83.7Confident76.1Confident79 Ų7979.1 Ų79.141%0.40542%0.417SS..Hα-helixtrans-63-40.1178.2-66165000111.6A15 F16 K21 D22 F23 M50A15-I19 WeakPolarHBondContact O-CD1 3.47Å; A15-I19 WeakPolarHBondContact O-CG1 3.06Å; A15-I19 PolarHBondContact O-N 2.81Å; A15-I19 VanDerWaalsContact O-N 3.11Å; F16-I19 PolarHBondContact O-N 3.14Å; I19-K21 VanDerWaalsContact C-N 3.31Å; I19-K21 PolarHBondContact O-N 3.24Å; I19-D22 PolarHBondContact O-N 2.77Å; I19-F23 WeakPolarHBondContact O-CB 3.42Å; I19-F23 PolarHBondContact O-N 2.82Å; I19-M50 HydrophobicContact CG2-CE 3.55Å; I19-M50 HydrophobicContact CG2-SD 3.81Å
20E84.5Confident77.7Confident36 Ų3677.5 Ų77.517%0.16841%0.408CS..Hα-helixtrans-66.1-35.6178.8-173.7161.3-156.800111.3F16 E17 E18 Q24 H47 K51F16-E20 HydrophobicContact CE1-CB 4.29Å; F16-E20 WeakPolarHBondContact CE1-OE2 3.41Å; F16-E20 WeakPolarHBondContact O-CB 3.45Å; F16-E20 PolarHBondContact O-N 3.37Å; E17-E20 PolarHBondContact O-N 3.17Å; E18-E20 PolarHBondContact O-N 3.08Å; E20-Q24 WeakPolarHBondContact O-CG 3.37Å; E20-Q24 PolarHBondContact O-N 3.1Å; E20-Q24 VanDerWaalsContact O-N 3.15Å; E20-H47 IonicContact OE1-NE2 2.69Å; E20-K51 IonicContact OE1-NZ 3.54Å; E20-K51 PolarHBondContact OE1-NZ 3.39Å
21K85.9Confident79Confident130 Ų13077.6 Ų77.657%0.56541%0.405SS*.Hα-helixtrans-67.1-49.3173.8-169.6-174173.4-162.80111.7E17 E18 I19 F23 Q24 E25E17-K21 WeakPolarHBondContact O-CB 3.13Å; E17-K21 PolarHBondContact O-N 3.27Å; E18-K21 WeakPolarHBondContact O-CB 3.18Å; E18-K21 PolarHBondContact O-N 3.29Å; I19-K21 VanDerWaalsContact C-N 3.31Å; I19-K21 PolarHBondContact O-N 3.24Å; K21-F23 PolarHBondContact O-N 2.93Å; K21-Q24 PolarHBondContact O-N 3.39Å; K21-Q24 VanDerWaalsContact O-N 3.12Å; K21-E25 WeakPolarHBondContact CE-OE1 3.37Å; K21-E25 PolarHBondContact O-N 3.34Å
22D86.1Confident80.2Confident95 Ų9577.3 Ų77.351%0.50842%0.416SS..Hα-helixtrans-57.5-40176.6-72.1-5.4000111E18 I19 Q24 E25 V26E18-D22 PolarHBondContact O-N 2.67Å; I19-D22 PolarHBondContact O-N 2.77Å; D22-Q24 PolarHBondContact O-N 3.31Å; D22-E25 PolarHBondContact O-N 3.4Å; D22-V26 WeakPolarHBondContact O-CG2 3.33Å; D22-V26 PolarHBondContact O-N 2.93Å; D22-V26 VanDerWaalsContact O-N 3.07Å
23F86.7Confident81.4Confident10 Ų1076 Ų764%0.04441%0.412CS..Hα-helixtrans-63.4-41.4177.9-148.2-76.2000112.6I19 K21 L27 Y43 H47I19-F23 WeakPolarHBondContact O-CB 3.42Å; I19-F23 PolarHBondContact O-N 2.82Å; K21-F23 PolarHBondContact O-N 2.93Å; F23-L27 HydrophobicContact CD1-CD1 3.69Å; F23-L27 HydrophobicContact CD1-CG 3.91Å; F23-L27 HydrophobicContact CE1-CD1 3.86Å; F23-L27 HydrophobicContact CE1-CD2 4.29Å; F23-L27 HydrophobicContact CE1-CG 3.94Å; F23-L27 WeakPolarHBondContact O-CG 3.3Å; F23-L27 PolarHBondContact O-N 3.47Å; F23-Y43 AromaticContact CD1-CD1 3.9Å; F23-Y43 HydrophobicContact CD1-CD1 3.9Å; F23-Y43 AromaticContact CD1-CE1 3.57Å; F23-Y43 HydrophobicContact CD1-CE1 3.57Å; F23-Y43 AromaticContact CD2-CE1 3.83Å; F23-Y43 HydrophobicContact CD2-CE1 3.83Å; F23-Y43 AromaticContact CD2-CZ 3.77Å; F23-Y43 AromaticContact CE1-CD1 3.06Å; F23-Y43 HydrophobicContact CE1-CD1 3.06Å; F23-Y43 HydrophobicContact CE1-CD2 4.46Å; F23-Y43 AromaticContact CE1-CE1 3.15Å; F23-Y43 HydrophobicContact CE1-CE1 3.15Å; F23-Y43 AromaticContact CE1-CG 3.76Å; F23-Y43 HydrophobicContact CE1-CG 3.76Å; F23-Y43 AromaticContact CE1-CZ 3.93Å; F23-Y43 WeakPolarHBondContact CE1-O 3.08Å; F23-Y43 AromaticContact CE2-CD1 3.98Å; F23-Y43 HydrophobicContact CE2-CD1 3.98Å; F23-Y43 HydrophobicContact CE2-CD2 4.17Å; F23-Y43 AromaticContact CE2-CE1 3.46Å; F23-Y43 HydrophobicContact CE2-CE1 3.46Å; F23-Y43 VanDerWaalsContact CE2-CE1 3.46Å; F23-Y43 AromaticContact CE2-CE2 3.7Å; F23-Y43 HydrophobicContact CE2-CE2 3.7Å; F23-Y43 HydrophobicContact CE2-CG 4.28Å; F23-Y43 AromaticContact CE2-CZ 3.29Å; F23-Y43 AromaticContact CG-CE1 3.86Å; F23-Y43 HydrophobicContact CG-CE1 3.86Å; F23-Y43 AromaticContact CZ-CD1 3.11Å; F23-Y43 HydrophobicContact CZ-CD1 3.11Å; F23-Y43 AromaticContact CZ-CD2 3.66Å; F23-Y43 HydrophobicContact CZ-CD2 3.66Å; F23-Y43 AromaticContact CZ-CE1 3.07Å; F23-Y43 HydrophobicContact CZ-CE1 3.07Å; F23-Y43 AromaticContact CZ-CE2 3.65Å; F23-Y43 HydrophobicContact CZ-CE2 3.65Å; F23-Y43 AromaticContact CZ-CG 3.38Å; F23-Y43 HydrophobicContact CZ-CG 3.38Å; F23-Y43 AromaticContact CZ-CZ 3.35Å; F23-Y43 WeakPolarHBondContact CZ-O 3.28Å; F23-H47 HydrophobicContact CD1-CB 3.47Å; F23-H47 VanDerWaalsContact CD1-CB 3.47Å; F23-H47 AromaticContact CD1-CD2 3.69Å; F23-H47 AromaticContact CD1-CG 3.65Å; F23-H47 HydrophobicContact CD2-CB 4.07Å; F23-H47 HydrophobicContact CE1-CB 3.17Å; F23-H47 AromaticContact CE1-CG 3.9Å; F23-H47 HydrophobicContact CE2-CB 3.79Å; F23-H47 HydrophobicContact CG-CB 3.93Å; F23-H47 AromaticContact CG-CD2 3.57Å; F23-H47 AromaticContact CG-CG 3.98Å; F23-H47 HydrophobicContact CZ-CB 3.36Å
24Q86.1Confident82.2Confident115 Ų11581.3 Ų81.354%0.53743%0.434SS..Hα-helixtrans-68.1-38.7178.1-73.6-179.923.300112.1E20 K21 D22 L27 S28E20-Q24 WeakPolarHBondContact O-CG 3.37Å; E20-Q24 PolarHBondContact O-N 3.1Å; E20-Q24 VanDerWaalsContact O-N 3.15Å; K21-Q24 PolarHBondContact O-N 3.39Å; K21-Q24 VanDerWaalsContact O-N 3.12Å; D22-Q24 PolarHBondContact O-N 3.31Å; Q24-L27 PolarHBondContact O-N 2.97Å; Q24-S28 WeakPolarHBondContact O-CB 3.46Å; Q24-S28 PolarHBondContact O-N 2.89Å
25E85.8Confident82.9Confident95 Ų9582 Ų8244%0.44444%0.442SS..Hα-helixtrans-60.3-49.1174.7-72.5-178-171.100110.5K21 D22 L27 S28 E29K21-E25 WeakPolarHBondContact CE-OE1 3.37Å; K21-E25 PolarHBondContact O-N 3.34Å; D22-E25 PolarHBondContact O-N 3.4Å; E25-L27 PolarHBondContact O-N 3.36Å; E25-S28 WeakPolarHBondContact O-CB 3.17Å; E25-S28 PolarHBondContact O-N 3.34Å; E25-S28 VanDerWaalsContact O-N 3.09Å; E25-S28 PolarHBondContact O-OG 3.32Å; E25-E29 PolarHBondContact O-N 3.05Å
26V85.4Confident83.2Confident50 Ų5083.2 Ų83.230%0.30344%0.443SS..Hα-helixtrans-61.3-41.3176.7174.70000112.2D22 S28 E29 L30 Y43D22-V26 WeakPolarHBondContact O-CG2 3.33Å; D22-V26 PolarHBondContact O-N 2.93Å; D22-V26 VanDerWaalsContact O-N 3.07Å; V26-S28 VanDerWaalsContact C-N 3.28Å; V26-S28 PolarHBondContact O-N 3.41Å; V26-E29 PolarHBondContact O-N 3.13Å; V26-L30 HydrophobicContact CG1-CD1 3.87Å; V26-L30 HydrophobicContact CG1-CG 4.29Å; V26-L30 WeakPolarHBondContact O-CB 3.39Å; V26-L30 VanDerWaalsContact O-CG 3.22Å; V26-L30 WeakPolarHBondContact O-CG 3.47Å; V26-L30 PolarHBondContact O-N 3.2Å; V26-Y43 HydrophobicContact CB-CE1 3.78Å; V26-Y43 HydrophobicContact CG1-CD1 4.02Å; V26-Y43 HydrophobicContact CG1-CE1 3.41Å; V26-Y43 VanDerWaalsContact CG1-CE1 3.41Å
27L84Confident83.3Confident30 Ų3086 Ų8616%0.15746%0.456CS..Hα-helixtrans-63.1-35.8175.7-77.9176000112.5F23 Q24 E25 S31 R40 Y43 E44F23-L27 HydrophobicContact CD1-CD1 3.69Å; F23-L27 HydrophobicContact CD1-CG 3.91Å; F23-L27 HydrophobicContact CE1-CD1 3.86Å; F23-L27 HydrophobicContact CE1-CD2 4.29Å; F23-L27 HydrophobicContact CE1-CG 3.94Å; F23-L27 WeakPolarHBondContact O-CG 3.3Å; F23-L27 PolarHBondContact O-N 3.47Å; Q24-L27 PolarHBondContact O-N 2.97Å; E25-L27 PolarHBondContact O-N 3.36Å; L27-S31 PolarHBondContact O-N 3.07Å; L27-S31 VanDerWaalsContact O-N 3.15Å; L27-R40 HydrophobicContact CD2-CG 3.86Å; L27-Y43 HydrophobicContact CD2-CD1 3.85Å; L27-Y43 HydrophobicContact CG-CD1 4.1Å; L27-E44 HydrophobicContact CD1-CG 4.02Å; L27-E44 HydrophobicContact CD2-CG 3.51Å; L27-E44 HydrophobicContact CG-CG 4.45Å
28S83.9Confident83.4Confident72 Ų7288.5 Ų88.550%0.50347%0.465SS..Hα-helixtrans-67.3-41.9177.180.80000111.6Q24 E25 V26 S31Q24-S28 WeakPolarHBondContact O-CB 3.46Å; Q24-S28 PolarHBondContact O-N 2.89Å; E25-S28 WeakPolarHBondContact O-CB 3.17Å; E25-S28 PolarHBondContact O-N 3.34Å; E25-S28 VanDerWaalsContact O-N 3.09Å; E25-S28 PolarHBondContact O-OG 3.32Å; V26-S28 VanDerWaalsContact C-N 3.28Å; V26-S28 PolarHBondContact O-N 3.41Å; S28-S31 PolarHBondContact O-N 3.35Å; S28-S31 PolarHBondContact O-OG 2.9Å
29E83.5Confident83.6Confident149 Ų14989.8 Ų89.870%0.69647%0.468SS*.Hα-helixtrans-64.9-43175.6-68.6-175.3168.900111.7E25 V26 S31 G32E25-E29 PolarHBondContact O-N 3.05Å; V26-E29 PolarHBondContact O-N 3.13Å; E29-S31 PolarHBondContact O-N 3.19Å; E29-G32 PolarHBondContact O-N 2.87Å
30L82.8Confident83.7Confident28 Ų2889.1 Ų89.115%0.14746%0.461CS..Hα-helixtrans-63.4-26.9177.5-71.1171.5000112.9V26 G32 L36 R40 Y43V26-L30 HydrophobicContact CG1-CD1 3.87Å; V26-L30 HydrophobicContact CG1-CG 4.29Å; V26-L30 WeakPolarHBondContact O-CB 3.39Å; V26-L30 VanDerWaalsContact O-CG 3.22Å; V26-L30 WeakPolarHBondContact O-CG 3.47Å; V26-L30 PolarHBondContact O-N 3.2Å; L30-G32 VanDerWaalsContact C-N 3.26Å; L30-G32 PolarHBondContact O-N 3.46Å; L30-L36 HydrophobicContact CD2-CB 4.02Å; L30-L36 HydrophobicContact CD2-CD1 3.79Å; L30-L36 HydrophobicContact CD2-CG 4.5Å; L30-R40 HydrophobicContact CB-CB 4.17Å; L30-R40 HydrophobicContact CB-CG 4.15Å; L30-R40 HydrophobicContact CD1-CB 4.44Å; L30-Y43 HydrophobicContact CD1-CD1 4.16Å; L30-Y43 HydrophobicContact CD1-CG 4.47Å
31S77.9Confident83.9Confident74 Ų7490.1 Ų90.152%0.51747%0.469SS..Hα-helixtrans-70.8-20.6178.977.50000113.7L27 S28 E29L27-S31 PolarHBondContact O-N 3.07Å; L27-S31 VanDerWaalsContact O-N 3.15Å; S28-S31 PolarHBondContact O-N 3.35Å; S28-S31 PolarHBondContact O-OG 2.9Å; E29-S31 PolarHBondContact O-N 3.19Å
32G78.9Confident83.9Confident71 Ų7189.1 Ų89.173%0.73247%0.467SS*.THydrogen-bonded Turntrans-74.9-20.7179.400000114.3E29 L30E29-G32 PolarHBondContact O-N 2.87Å; L30-G32 VanDerWaalsContact C-N 3.26Å; L30-G32 PolarHBondContact O-N 3.46Å
33D81.6Confident84Confident74 Ų7488 Ų8840%0.39646%0.456SS..  trans-119.3107-175.8-168.3-18.6000111.9S35 L36D33-S35 PolarHBondContact O-N 3.02Å; D33-S35 WeakPolarHBondContact OD1-CB 3.37Å; D33-S35 PolarHBondContact OD1-N 3.21Å; D33-S35 PolarHBondContact OD1-OG 3.5Å; D33-S35 PolarHBondContact OD2-OG 3.17Å; D33-L36 HydrophobicContact CB-CD1 4.12Å; D33-L36 HydrophobicContact CB-CG 4.25Å; D33-L36 PolarHBondContact O-N 3.43Å
34K77Confident84.2Confident198 Ų19890.8 Ų90.886%0.86147%0.469SS*.G310 helixtrans-58.3-23.3178.8-74.7-175.6178.4176.90113.6L36K34-L36 PolarHBondContact O-N 3.39Å
35S83.3Confident84.3Confident94 Ų9490.1 Ų90.166%0.65746%0.464SS*.G310 helixtrans-69.9-21.9177.872.70000112.7D33D33-S35 PolarHBondContact O-N 3.02Å; D33-S35 WeakPolarHBondContact OD1-CB 3.37Å; D33-S35 PolarHBondContact OD1-N 3.21Å; D33-S35 PolarHBondContact OD1-OG 3.5Å; D33-S35 PolarHBondContact OD2-OG 3.17Å
36L84.3Confident84.4Confident64 Ų6490.6 Ų90.634%0.33547%0.469SS..G310 helixtrans-97.93.4-176-61.1179.3000114.5L30 D33 K34 K38 F39 R40L30-L36 HydrophobicContact CD2-CB 4.02Å; L30-L36 HydrophobicContact CD2-CD1 3.79Å; L30-L36 HydrophobicContact CD2-CG 4.5Å; D33-L36 HydrophobicContact CB-CD1 4.12Å; D33-L36 HydrophobicContact CB-CG 4.25Å; D33-L36 PolarHBondContact O-N 3.43Å; K34-L36 PolarHBondContact O-N 3.39Å; L36-K38 VanDerWaalsContact C-N 3.26Å; L36-K38 PolarHBondContact O-N 3.19Å; L36-K38 VanDerWaalsContact O-N 3.12Å; L36-F39 WeakPolarHBondContact O-CA 3.23Å; L36-F39 WeakPolarHBondContact O-CB 3.28Å; L36-F39 PolarHBondContact O-N 3.11Å; L36-R40 PolarHBondContact O-N 3.38Å
37E84.3Confident84.6Confident78 Ų7889.4 Ų89.436%0.36446%0.46SS..Hα-helixtrans-57-35-174.3-173.463.5-166.800113.5F39 R40 V41E37-F39 PolarHBondContact O-N 3.42Å; E37-R40 WeakPolarHBondContact O-CB 3.25Å; E37-R40 PolarHBondContact O-N 3Å; E37-R40 IonicContact OE1-CZ 3.97Å; E37-R40 IonicContact OE1-NH1 3.74Å; E37-R40 PolarHBondContact OE1-NH1 3.32Å; E37-R40 VanDerWaalsContact OE1-NH1 3.07Å; E37-R40 IonicContact OE2-CZ 2.9Å; E37-R40 IonicContact OE2-NH1 3.54Å; E37-R40 PolarHBondContact OE2-NH1 3.32Å; E37-V41 WeakPolarHBondContact O-CG2 3.43Å; E37-V41 PolarHBondContact O-N 3.14Å
38K83.8Confident84.8Confident185 Ų18591.2 Ų91.280%0.80447%0.473SS*.Hα-helixtrans-64.6-40.1174.9-72.6-175.4-179.8176.60112.5L36 E42L36-K38 VanDerWaalsContact C-N 3.26Å; L36-K38 PolarHBondContact O-N 3.19Å; L36-K38 VanDerWaalsContact O-N 3.12Å; K38-E42 PolarHBondContact O-N 3.37Å
39F85.2Confident85.1Confident158 Ų15893.2 Ų93.269%0.69348%0.477SS*.Hα-helixtrans-65.9-43175.9-106.2-84.6000110.4L36 E37 V41 E42 Y43L36-F39 WeakPolarHBondContact O-CA 3.23Å; L36-F39 WeakPolarHBondContact O-CB 3.28Å; L36-F39 PolarHBondContact O-N 3.11Å; E37-F39 PolarHBondContact O-N 3.42Å; F39-V41 VanDerWaalsContact C-N 3.34Å; F39-V41 PolarHBondContact O-N 3.02Å; F39-E42 PolarHBondContact O-N 3.34Å; F39-Y43 WeakPolarHBondContact O-CB 3.23Å; F39-Y43 PolarHBondContact O-N 2.83Å
40R87.1Confident85.3Confident65 Ų6588.8 Ų88.825%0.24546%0.457CS..Hα-helixtrans-55.2-46.8175.7-170.1-171.4135.5-153.6-1.1112.2L27 L30 L36 E37 E42 Y43 E44L27-R40 HydrophobicContact CD2-CG 3.86Å; L30-R40 HydrophobicContact CB-CB 4.17Å; L30-R40 HydrophobicContact CB-CG 4.15Å; L30-R40 HydrophobicContact CD1-CB 4.44Å; L36-R40 PolarHBondContact O-N 3.38Å; E37-R40 WeakPolarHBondContact O-CB 3.25Å; E37-R40 PolarHBondContact O-N 3Å; E37-R40 IonicContact OE1-CZ 3.97Å; E37-R40 IonicContact OE1-NH1 3.74Å; E37-R40 PolarHBondContact OE1-NH1 3.32Å; E37-R40 VanDerWaalsContact OE1-NH1 3.07Å; E37-R40 IonicContact OE2-CZ 2.9Å; E37-R40 IonicContact OE2-NH1 3.54Å; E37-R40 PolarHBondContact OE2-NH1 3.32Å; R40-E42 PolarHBondContact O-N 3.43Å; R40-Y43 PolarHBondContact O-N 3.36Å; R40-E44 IonicContact CZ-OE1 2.86Å; R40-E44 IonicContact NE-OE1 3.95Å; R40-E44 PolarHBondContact NE-OE1 3.41Å; R40-E44 IonicContact NH2-OE1 3.31Å; R40-E44 PolarHBondContact NH2-OE1 3.23Å; R40-E44 WeakPolarHBondContact O-CG 3.47Å; R40-E44 PolarHBondContact O-N 3.34Å
41V87.2Confident85.6Confident57 Ų5791 Ų9135%0.34547%0.465SS..Hα-helixtrans-63.2-42179.1172.70000112.4E37 F39 K45E37-V41 WeakPolarHBondContact O-CG2 3.43Å; E37-V41 PolarHBondContact O-N 3.14Å; F39-V41 VanDerWaalsContact C-N 3.34Å; F39-V41 PolarHBondContact O-N 3.02Å; V41-K45 WeakPolarHBondContact O-CG 3.31Å; V41-K45 PolarHBondContact O-N 3.33Å; V41-K45 VanDerWaalsContact O-N 3.15Å
42E87Confident86.1Confident110 Ų11093.6 Ų93.651%0.51447%0.467SS..Hα-helixtrans-69.8-35.1176.5-67.9-56.8143.200112K38 F39 R40 K45 L46K38-E42 PolarHBondContact O-N 3.37Å; F39-E42 PolarHBondContact O-N 3.34Å; R40-E42 PolarHBondContact O-N 3.43Å; E42-K45 WeakPolarHBondContact O-CB 3.17Å; E42-K45 PolarHBondContact O-N 2.64Å; E42-K45 IonicContact OE1-NZ 3.44Å; E42-K45 PolarHBondContact OE1-NZ 3.23Å; E42-K45 IonicContact OE2-NZ 2.66Å; E42-L46 PolarHBondContact O-N 3.16Å
43Y89Confident86.5Confident72 Ų7293.7 Ų93.728%0.28246%0.457SS..Hα-helixtrans-64.7-47.4173.9-155.9-115.5000110.7F23 V26 L27 L30 F39 R40 K45 L46 H47F23-Y43 AromaticContact CD1-CD1 3.9Å; F23-Y43 HydrophobicContact CD1-CD1 3.9Å; F23-Y43 AromaticContact CD1-CE1 3.57Å; F23-Y43 HydrophobicContact CD1-CE1 3.57Å; F23-Y43 AromaticContact CD2-CE1 3.83Å; F23-Y43 HydrophobicContact CD2-CE1 3.83Å; F23-Y43 AromaticContact CD2-CZ 3.77Å; F23-Y43 AromaticContact CE1-CD1 3.06Å; F23-Y43 HydrophobicContact CE1-CD1 3.06Å; F23-Y43 HydrophobicContact CE1-CD2 4.46Å; F23-Y43 AromaticContact CE1-CE1 3.15Å; F23-Y43 HydrophobicContact CE1-CE1 3.15Å; F23-Y43 AromaticContact CE1-CG 3.76Å; F23-Y43 HydrophobicContact CE1-CG 3.76Å; F23-Y43 AromaticContact CE1-CZ 3.93Å; F23-Y43 WeakPolarHBondContact CE1-O 3.08Å; F23-Y43 AromaticContact CE2-CD1 3.98Å; F23-Y43 HydrophobicContact CE2-CD1 3.98Å; F23-Y43 HydrophobicContact CE2-CD2 4.17Å; F23-Y43 AromaticContact CE2-CE1 3.46Å; F23-Y43 HydrophobicContact CE2-CE1 3.46Å; F23-Y43 VanDerWaalsContact CE2-CE1 3.46Å; F23-Y43 AromaticContact CE2-CE2 3.7Å; F23-Y43 HydrophobicContact CE2-CE2 3.7Å; F23-Y43 HydrophobicContact CE2-CG 4.28Å; F23-Y43 AromaticContact CE2-CZ 3.29Å; F23-Y43 AromaticContact CG-CE1 3.86Å; F23-Y43 HydrophobicContact CG-CE1 3.86Å; F23-Y43 AromaticContact CZ-CD1 3.11Å; F23-Y43 HydrophobicContact CZ-CD1 3.11Å; F23-Y43 AromaticContact CZ-CD2 3.66Å; F23-Y43 HydrophobicContact CZ-CD2 3.66Å; F23-Y43 AromaticContact CZ-CE1 3.07Å; F23-Y43 HydrophobicContact CZ-CE1 3.07Å; F23-Y43 AromaticContact CZ-CE2 3.65Å; F23-Y43 HydrophobicContact CZ-CE2 3.65Å; F23-Y43 AromaticContact CZ-CG 3.38Å; F23-Y43 HydrophobicContact CZ-CG 3.38Å; F23-Y43 AromaticContact CZ-CZ 3.35Å; F23-Y43 WeakPolarHBondContact CZ-O 3.28Å; V26-Y43 HydrophobicContact CB-CE1 3.78Å; V26-Y43 HydrophobicContact CG1-CD1 4.02Å; V26-Y43 HydrophobicContact CG1-CE1 3.41Å; V26-Y43 VanDerWaalsContact CG1-CE1 3.41Å; L27-Y43 HydrophobicContact CD2-CD1 3.85Å; L27-Y43 HydrophobicContact CG-CD1 4.1Å; L30-Y43 HydrophobicContact CD1-CD1 4.16Å; L30-Y43 HydrophobicContact CD1-CG 4.47Å; F39-Y43 WeakPolarHBondContact O-CB 3.23Å; F39-Y43 PolarHBondContact O-N 2.83Å; R40-Y43 PolarHBondContact O-N 3.36Å; Y43-K45 VanDerWaalsContact C-N 3.27Å; Y43-K45 PolarHBondContact O-N 2.76Å; Y43-L46 WeakPolarHBondContact O-CB 3.46Å; Y43-L46 PolarHBondContact O-N 2.68Å; Y43-H47 PolarHBondContact O-N 2.83Å
44E89.2Confident86.8Confident67 Ų6792.2 Ų92.231%0.31345%0.446SS..Hα-helixtrans-56-38.9174-76.2179.4-173.700112.6L27 R40 T48L27-E44 HydrophobicContact CD1-CG 4.02Å; L27-E44 HydrophobicContact CD2-CG 3.51Å; L27-E44 HydrophobicContact CG-CG 4.45Å; R40-E44 IonicContact CZ-OE1 2.86Å; R40-E44 IonicContact NE-OE1 3.95Å; R40-E44 PolarHBondContact NE-OE1 3.41Å; R40-E44 IonicContact NH2-OE1 3.31Å; R40-E44 PolarHBondContact NH2-OE1 3.23Å; R40-E44 WeakPolarHBondContact O-CG 3.47Å; R40-E44 PolarHBondContact O-N 3.34Å; E44-T48 WeakPolarHBondContact O-CB 2.98Å; E44-T48 PolarHBondContact O-N 2.6Å; E44-T48 PolarHBondContact O-OG1 3.3Å
45K89.2Confident87.4Confident101 Ų10186.8 Ų86.844%0.43942%0.423SS..Hα-helixtrans-63.9-44.1174.2-73.3172.6-172.4169.40111.9V41 E42 Y43 T48 I49V41-K45 WeakPolarHBondContact O-CG 3.31Å; V41-K45 PolarHBondContact O-N 3.33Å; V41-K45 VanDerWaalsContact O-N 3.15Å; E42-K45 WeakPolarHBondContact O-CB 3.17Å; E42-K45 PolarHBondContact O-N 2.64Å; E42-K45 IonicContact OE1-NZ 3.44Å; E42-K45 PolarHBondContact OE1-NZ 3.23Å; E42-K45 IonicContact OE2-NZ 2.66Å; Y43-K45 VanDerWaalsContact C-N 3.27Å; Y43-K45 PolarHBondContact O-N 2.76Å; K45-T48 WeakPolarHBondContact O-CB 3.09Å; K45-T48 PolarHBondContact O-N 3.48Å; K45-I49 WeakPolarHBondContact O-CG1 3.43Å; K45-I49 PolarHBondContact O-N 3.36Å
46L88.4Confident87.5Confident105 Ų10586.9 Ų86.955%0.5542%0.417SS..Hα-helixtrans-60.6-45.5179-170.869.6000111E42 Y43 T48 I49 M50E42-L46 PolarHBondContact O-N 3.16Å; Y43-L46 WeakPolarHBondContact O-CB 3.46Å; Y43-L46 PolarHBondContact O-N 2.68Å; L46-T48 PolarHBondContact O-N 3.29Å; L46-I49 PolarHBondContact O-N 3.26Å; L46-M50 WeakPolarHBondContact O-CB 3.34Å; L46-M50 PolarHBondContact O-N 2.92Å
47H89.3Confident87.7Confident25 Ų2588.7 Ų88.712%0.11642%0.424CS..Hα-helixtrans-62.3-42.1174.7173.2-104.6000112.9E20 F23 Y43 I49 M50 K51E20-H47 IonicContact OE1-NE2 2.69Å; F23-H47 HydrophobicContact CD1-CB 3.47Å; F23-H47 VanDerWaalsContact CD1-CB 3.47Å; F23-H47 AromaticContact CD1-CD2 3.69Å; F23-H47 AromaticContact CD1-CG 3.65Å; F23-H47 HydrophobicContact CD2-CB 4.07Å; F23-H47 HydrophobicContact CE1-CB 3.17Å; F23-H47 AromaticContact CE1-CG 3.9Å; F23-H47 HydrophobicContact CE2-CB 3.79Å; F23-H47 HydrophobicContact CG-CB 3.93Å; F23-H47 AromaticContact CG-CD2 3.57Å; F23-H47 AromaticContact CG-CG 3.98Å; F23-H47 HydrophobicContact CZ-CB 3.36Å; Y43-H47 PolarHBondContact O-N 2.83Å; H47-I49 PolarHBondContact O-N 3.22Å; H47-M50 PolarHBondContact O-N 3.25Å; H47-K51 VanDerWaalsContact O-CB 3.28Å; H47-K51 WeakPolarHBondContact O-CB 3.34Å; H47-K51 PolarHBondContact O-N 3.48Å
48T88.8Confident87.8Confident69 Ų6990.3 Ų90.342%0.42343%0.429SS..Hα-helixtrans-59.5-38.4176.2-55.20000111.5E44 K45 L46 K52E44-T48 WeakPolarHBondContact O-CB 2.98Å; E44-T48 PolarHBondContact O-N 2.6Å; E44-T48 PolarHBondContact O-OG1 3.3Å; K45-T48 WeakPolarHBondContact O-CB 3.09Å; K45-T48 PolarHBondContact O-N 3.48Å; L46-T48 PolarHBondContact O-N 3.29Å; T48-K52 WeakPolarHBondContact O-CB 3.28Å; T48-K52 VanDerWaalsContact O-CG 3.32Å; T48-K52 WeakPolarHBondContact O-CG 3.27Å; T48-K52 PolarHBondContact O-N 3.28Å; T48-K52 VanDerWaalsContact O-N 3.16Å
49I88.7Confident88Confident113 Ų11389.6 Ų89.658%0.57942%0.422SS*.Hα-helixtrans-70.9-46.5176.9-66.9167000110.8K45 L46 H47 K51 K52 S53K45-I49 WeakPolarHBondContact O-CG1 3.43Å; K45-I49 PolarHBondContact O-N 3.36Å; L46-I49 PolarHBondContact O-N 3.26Å; H47-I49 PolarHBondContact O-N 3.22Å; I49-K51 PolarHBondContact O-N 3.48Å; I49-K52 PolarHBondContact O-N 2.9Å; I49-S53 PolarHBondContact O-N 3.37Å
50M87.8Confident88Confident57 Ų5787.8 Ų87.828%0.28142%0.418SS..Hα-helixtrans-59.3-45.9178.4-173.8-173.177.400111.5F16 I19 L46 H47 K52 S53 Y54F16-M50 HydrophobicContact CE2-CE 3.87Å; F16-M50 HydrophobicContact CE2-CG 4.25Å; F16-M50 HydrophobicContact CZ-CE 4.29Å; I19-M50 HydrophobicContact CG2-CE 3.55Å; I19-M50 HydrophobicContact CG2-SD 3.81Å; L46-M50 WeakPolarHBondContact O-CB 3.34Å; L46-M50 PolarHBondContact O-N 2.92Å; H47-M50 PolarHBondContact O-N 3.25Å; M50-K52 PolarHBondContact O-N 2.74Å; M50-S53 WeakPolarHBondContact O-CB 3.39Å; M50-S53 PolarHBondContact O-N 3.34Å; M50-S53 VanDerWaalsContact O-N 3.11Å; M50-Y54 PolarHBondContact O-N 3.39Å
51K89.2Confident88Confident73 Ų7387.5 Ų87.532%0.31742%0.42SS..Hα-helixtrans-61-44.3176-173.8166.5-174.6151.80112.4F16 E20 H47 I49 S53 Y54 E55F16-K51 HydrophobicContact CZ-CB 4.32Å; F16-K51 HydrophobicContact CZ-CG 4.39Å; E20-K51 IonicContact OE1-NZ 3.54Å; E20-K51 PolarHBondContact OE1-NZ 3.39Å; H47-K51 VanDerWaalsContact O-CB 3.28Å; H47-K51 WeakPolarHBondContact O-CB 3.34Å; H47-K51 PolarHBondContact O-N 3.48Å; I49-K51 PolarHBondContact O-N 3.48Å; K51-S53 VanDerWaalsContact C-N 3.29Å; K51-S53 PolarHBondContact O-N 3.07Å; K51-Y54 PolarHBondContact O-N 2.84Å; K51-E55 WeakPolarHBondContact O-CB 3.38Å; K51-E55 WeakPolarHBondContact O-CG 3.27Å; K51-E55 PolarHBondContact O-N 3.04Å
52K89.3Confident88.1Confident129 Ų12987 Ų8756%0.56142%0.423SS*.Hα-helixtrans-61.5-37.2173.1-78.6178.3179.6179.10112.6T48 I49 M50 N56T48-K52 WeakPolarHBondContact O-CB 3.28Å; T48-K52 VanDerWaalsContact O-CG 3.32Å; T48-K52 WeakPolarHBondContact O-CG 3.27Å; T48-K52 PolarHBondContact O-N 3.28Å; T48-K52 VanDerWaalsContact O-N 3.16Å; I49-K52 PolarHBondContact O-N 2.9Å; M50-K52 PolarHBondContact O-N 2.74Å; K52-N56 WeakPolarHBondContact O-CB 3.22Å; K52-N56 PolarHBondContact O-N 3.05Å; K52-N56 VanDerWaalsContact O-N 3.08Å; K52-N56 PolarHBondContact O-ND2 3.45Å
53S86.7Confident88.2Confident73 Ų7388 Ų8851%0.5143%0.426SS..Hα-helixtrans-64.1-48.6176.9-166.40000111I49 M50 K51 N56 E57I49-S53 PolarHBondContact O-N 3.37Å; M50-S53 WeakPolarHBondContact O-CB 3.39Å; M50-S53 PolarHBondContact O-N 3.34Å; M50-S53 VanDerWaalsContact O-N 3.11Å; K51-S53 VanDerWaalsContact C-N 3.29Å; K51-S53 PolarHBondContact O-N 3.07Å; S53-N56 WeakPolarHBondContact O-CB 3.4Å; S53-N56 PolarHBondContact O-N 3.01Å; S53-E57 PolarHBondContact O-N 2.84Å
54Y88.3Confident88Confident44 Ų4488.2 Ų88.217%0.17344%0.437CS..Hα-helixtrans-64.3-41.7178.5-179.4-107.4000112.6E13 F16 M50 K51 N56 E57 K58E13-Y54 WeakPolarHBondContact CA-OH 2.9Å; E13-Y54 WeakPolarHBondContact CG-OH 3.37Å; F16-Y54 HydrophobicContact CB-CD1 4.36Å; F16-Y54 HydrophobicContact CB-CD2 3.96Å; F16-Y54 HydrophobicContact CB-CE1 4Å; F16-Y54 HydrophobicContact CB-CE2 3.57Å; F16-Y54 HydrophobicContact CB-CG 4.33Å; F16-Y54 AromaticContact CD1-CD1 3.42Å; F16-Y54 HydrophobicContact CD1-CD1 3.42Å; F16-Y54 VanDerWaalsContact CD1-CD1 3.42Å; F16-Y54 HydrophobicContact CD1-CD2 4.43Å; F16-Y54 AromaticContact CD1-CE1 3.39Å; F16-Y54 HydrophobicContact CD1-CE1 3.39Å; F16-Y54 HydrophobicContact CD1-CE2 4.42Å; F16-Y54 AromaticContact CD1-CG 3.95Å; F16-Y54 HydrophobicContact CD1-CG 3.95Å; F16-Y54 AromaticContact CD1-CZ 3.92Å; F16-Y54 AromaticContact CD2-CD1 3.82Å; F16-Y54 HydrophobicContact CD2-CD1 3.82Å; F16-Y54 AromaticContact CD2-CD2 3.62Å; F16-Y54 HydrophobicContact CD2-CD2 3.62Å; F16-Y54 HydrophobicContact CD2-CE1 4.31Å; F16-Y54 HydrophobicContact CD2-CE2 4.15Å; F16-Y54 AromaticContact CD2-CG 3.43Å; F16-Y54 HydrophobicContact CD2-CG 3.43Å; F16-Y54 VanDerWaalsContact CD2-CG 3.43Å; F16-Y54 AromaticContact CE1-CD1 3.53Å; F16-Y54 HydrophobicContact CE1-CD1 3.53Å; F16-Y54 AromaticContact CE1-CE1 3.92Å; F16-Y54 HydrophobicContact CE1-CE1 3.92Å; F16-Y54 HydrophobicContact CE1-CG 4.12Å; F16-Y54 VanDerWaalsContact CE2-CB 3.42Å; F16-Y54 AromaticContact CE2-CD1 3.92Å; F16-Y54 HydrophobicContact CE2-CD1 3.92Å; F16-Y54 HydrophobicContact CE2-CD2 4.26Å; F16-Y54 AromaticContact CE2-CG 3.62Å; F16-Y54 HydrophobicContact CE2-CG 3.62Å; F16-Y54 AromaticContact CG-CD1 3.57Å; F16-Y54 HydrophobicContact CG-CD1 3.57Å; F16-Y54 AromaticContact CG-CD2 3.73Å; F16-Y54 HydrophobicContact CG-CD2 3.73Å; F16-Y54 AromaticContact CG-CE1 3.61Å; F16-Y54 HydrophobicContact CG-CE1 3.61Å; F16-Y54 AromaticContact CG-CE2 3.79Å; F16-Y54 HydrophobicContact CG-CE2 3.79Å; F16-Y54 AromaticContact CG-CG 3.61Å; F16-Y54 HydrophobicContact CG-CG 3.61Å; F16-Y54 AromaticContact CG-CZ 3.72Å; F16-Y54 AromaticContact CZ-CD1 3.79Å; F16-Y54 HydrophobicContact CZ-CD1 3.79Å; F16-Y54 AromaticContact CZ-CG 3.97Å; F16-Y54 HydrophobicContact CZ-CG 3.97Å; M50-Y54 PolarHBondContact O-N 3.39Å; K51-Y54 PolarHBondContact O-N 2.84Å; Y54-N56 VanDerWaalsContact C-N 3.3Å; Y54-N56 PolarHBondContact O-N 2.94Å; Y54-E57 PolarHBondContact O-N 3.35Å; Y54-K58 WeakPolarHBondContact O-CB 3.31Å; Y54-K58 PolarHBondContact O-N 3.47Å
55E89Confident88Confident83 Ų8391.8 Ų91.839%0.38845%0.447SS..Hα-helixtrans-60.9-38.7173.9-75.3176.1-172.900112.3K51 R59K51-E55 WeakPolarHBondContact O-CB 3.38Å; K51-E55 WeakPolarHBondContact O-CG 3.27Å; K51-E55 PolarHBondContact O-N 3.04Å; E55-R59 WeakPolarHBondContact O-CG 3.37Å; E55-R59 PolarHBondContact O-N 3.38Å; E55-R59 VanDerWaalsContact O-N 3.11Å
56N86.8Confident87.9Confident97 Ų9793 Ų9352%0.51945%0.454SS..Hα-helixtrans-68.2-41.4176-75.2-24.9000111.9K52 S53 Y54 R59 L60K52-N56 WeakPolarHBondContact O-CB 3.22Å; K52-N56 PolarHBondContact O-N 3.05Å; K52-N56 VanDerWaalsContact O-N 3.08Å; K52-N56 PolarHBondContact O-ND2 3.45Å; S53-N56 WeakPolarHBondContact O-CB 3.4Å; S53-N56 PolarHBondContact O-N 3.01Å; Y54-N56 VanDerWaalsContact C-N 3.3Å; Y54-N56 PolarHBondContact O-N 2.94Å; N56-R59 PolarHBondContact O-N 3.42Å; N56-L60 PolarHBondContact O-N 3.22Å
57E87.1Confident87.9Confident102 Ų10292.1 Ų92.148%0.47745%0.45SS..Hα-helixtrans-63.5-44.5176-175.7167.5-160.100111.7S53 Y54 R59 L60 M61S53-E57 PolarHBondContact O-N 2.84Å; Y54-E57 PolarHBondContact O-N 3.35Å; E57-R59 VanDerWaalsContact C-N 3.32Å; E57-R59 PolarHBondContact O-N 2.99Å; E57-L60 WeakPolarHBondContact O-CB 3.44Å; E57-L60 PolarHBondContact O-N 3.18Å; E57-M61 WeakPolarHBondContact O-CB 3.42Å; E57-M61 PolarHBondContact O-N 3.31Å
58K87.2Confident87.9Confident111 Ų11196 Ų9648%0.48347%0.472SS..Hα-helixtrans-58.8-41.9174.7-170.9167.1-178.2147.20112.2E13 Y54 A62E13-K58 WeakPolarHBondContact OE1-CE 3.3Å; E13-K58 IonicContact OE1-NZ 3.29Å; E13-K58 PolarHBondContact OE1-NZ 3.43Å; Y54-K58 WeakPolarHBondContact O-CB 3.31Å; Y54-K58 PolarHBondContact O-N 3.47Å; K58-A62 WeakPolarHBondContact O-CB 3.38Å; K58-A62 PolarHBondContact O-N 3Å
59R87.3Confident87.9Confident171 Ų17195.4 Ų95.465%0.64547%0.473SS*.Hα-helixtrans-64-40.2173.6-75.6176.7-177.21664.4112.3E55 N56 E57 A62 K63E55-R59 WeakPolarHBondContact O-CG 3.37Å; E55-R59 PolarHBondContact O-N 3.38Å; E55-R59 VanDerWaalsContact O-N 3.11Å; N56-R59 PolarHBondContact O-N 3.42Å; E57-R59 VanDerWaalsContact C-N 3.32Å; E57-R59 PolarHBondContact O-N 2.99Å; R59-A62 PolarHBondContact O-N 2.93Å; R59-K63 WeakPolarHBondContact O-CB 3.43Å; R59-K63 PolarHBondContact O-N 3.31Å
60L86.1Confident88Confident119 Ų11995.5 Ų95.562%0.62347%0.471SS*.Hα-helixtrans-66.3-45.5178.8-160.778.8000111.1N56 E57 A62 K63 C64N56-L60 PolarHBondContact O-N 3.22Å; E57-L60 WeakPolarHBondContact O-CB 3.44Å; E57-L60 PolarHBondContact O-N 3.18Å; L60-A62 PolarHBondContact O-N 3.48Å; L60-K63 PolarHBondContact O-N 3.16Å; L60-C64 PolarHBondContact O-N 3.1Å; L60-C64 PolarHBondContact O-SG 3.42Å; L60-C64 VanDerWaalsContact O-SG 3.42Å
61M87.4Confident88Confident59 Ų5997.8 Ų97.829%0.29148%0.484SS..Hα-helixtrans-58.8-44.3174.4-86.4-92.1-112.600112.3I9 E12 E57 K63 C64 R65I9-M61 HydrophobicContact CD1-CE 4.38Å; I9-M61 HydrophobicContact CG1-CE 4.39Å; I9-M61 HydrophobicContact CG2-CE 3.59Å; E12-M61 WeakPolarHBondContact OE2-CE 3.49Å; E57-M61 WeakPolarHBondContact O-CB 3.42Å; E57-M61 PolarHBondContact O-N 3.31Å; M61-K63 VanDerWaalsContact C-N 3.34Å; M61-K63 PolarHBondContact O-N 2.65Å; M61-C64 PolarHBondContact O-N 3.13Å; M61-R65 WeakPolarHBondContact O-CG 3.08Å; M61-R65 PolarHBondContact O-N 2.63Å
62A87.5Confident88.2Confident48 Ų4899 Ų9940%0.39750%0.496SS..Hα-helixtrans-59.6-45.2174.700000111.4K58 R59 L60 C64 R65 E66K58-A62 WeakPolarHBondContact O-CB 3.38Å; K58-A62 PolarHBondContact O-N 3Å; R59-A62 PolarHBondContact O-N 2.93Å; L60-A62 PolarHBondContact O-N 3.48Å; A62-C64 PolarHBondContact O-N 2.75Å; A62-R65 WeakPolarHBondContact O-CB 3.43Å; A62-R65 PolarHBondContact O-N 2.84Å; A62-R65 VanDerWaalsContact O-N 3.16Å; A62-E66 PolarHBondContact O-N 3.13Å
63K89.9Confident88.3Confident131 Ų13196.4 Ų96.457%0.5749%0.491SS*.Hα-helixtrans-65.7-37.5178.4-166.9146.8-172.8164.70113R59 L60 M61 R65 E66 L67R59-K63 WeakPolarHBondContact O-CB 3.43Å; R59-K63 PolarHBondContact O-N 3.31Å; L60-K63 PolarHBondContact O-N 3.16Å; M61-K63 VanDerWaalsContact C-N 3.34Å; M61-K63 PolarHBondContact O-N 2.65Å; K63-R65 VanDerWaalsContact C-N 3.33Å; K63-E66 PolarHBondContact O-N 3.38Å; K63-L67 HydrophobicContact CG-CD1 4.37Å; K63-L67 WeakPolarHBondContact O-CB 3.43Å; K63-L67 WeakPolarHBondContact O-CG 3.25Å; K63-L67 PolarHBondContact O-N 3.15Å
64C84.7Confident88.4Confident76 Ų7697 Ų9751%0.51449%0.489SS..Hα-helixtrans-62.7-40172.4-73.70000111.7L60 M61 A62 N68L60-C64 PolarHBondContact O-N 3.1Å; L60-C64 PolarHBondContact O-SG 3.42Å; L60-C64 VanDerWaalsContact O-SG 3.42Å; M61-C64 PolarHBondContact O-N 3.13Å; A62-C64 PolarHBondContact O-N 2.75Å; C64-N68 WeakPolarHBondContact O-CB 3.44Å; C64-N68 PolarHBondContact O-N 3Å
65R88.8Confident88.4Confident142 Ų14298.6 Ų98.654%0.53651%0.507SS..Hα-helixtrans-66.5-42.7175.7-71.2176.8-176.3169.20.8112.3I9 M61 A62 K63 N68 A69I9-R65 VanDerWaalsContact CG2-NH2 3.33Å; M61-R65 WeakPolarHBondContact O-CG 3.08Å; M61-R65 PolarHBondContact O-N 2.63Å; A62-R65 WeakPolarHBondContact O-CB 3.43Å; A62-R65 PolarHBondContact O-N 2.84Å; A62-R65 VanDerWaalsContact O-N 3.16Å; K63-R65 VanDerWaalsContact C-N 3.33Å; R65-N68 PolarHBondContact O-N 3.01Å; R65-A69 WeakPolarHBondContact O-CB 3.26Å; R65-A69 PolarHBondContact O-N 3.25Å
66E87.5Confident88.5Confident126 Ų12697.3 Ų97.359%0.58951%0.51SS*.Hα-helixtrans-58.5-49.9174.4-76.1176.8171.300111.2A62 K63 N68 A69 E70A62-E66 PolarHBondContact O-N 3.13Å; K63-E66 PolarHBondContact O-N 3.38Å; E66-N68 VanDerWaalsContact C-N 3.32Å; E66-N68 PolarHBondContact O-N 3.26Å; E66-A69 PolarHBondContact O-N 3.39Å; E66-E70 PolarHBondContact O-N 3.13Å
67L88.6Confident88.6Confident87 Ų8798.8 Ų98.846%0.45551%0.512SS..Hα-helixtrans-62.2-39.6178.4-73.3170.1000112.1K63 E70 I71K63-L67 HydrophobicContact CG-CD1 4.37Å; K63-L67 WeakPolarHBondContact O-CB 3.43Å; K63-L67 WeakPolarHBondContact O-CG 3.25Å; K63-L67 PolarHBondContact O-N 3.15Å; L67-E70 PolarHBondContact O-N 3.15Å; L67-I71 VanDerWaalsContact O-CG1 3.27Å; L67-I71 WeakPolarHBondContact O-CG1 3.39Å; L67-I71 PolarHBondContact O-N 3.45Å
68N88.9Confident88.8Confident107 Ų10798.1 Ų98.157%0.57252%0.515SS*.Hα-helixtrans-67.5-38.2177.7-136.313.6000111.5C64 R65 E66 I71 V72C64-N68 WeakPolarHBondContact O-CB 3.44Å; C64-N68 PolarHBondContact O-N 3Å; R65-N68 PolarHBondContact O-N 3.01Å; E66-N68 VanDerWaalsContact C-N 3.32Å; E66-N68 PolarHBondContact O-N 3.26Å; N68-I71 PolarHBondContact O-N 3.37Å; N68-V72 WeakPolarHBondContact O-CG2 3.45Å; N68-V72 PolarHBondContact O-N 3.42Å
69A90.2Very high88.8Confident55 Ų5595.7 Ų95.746%0.45552%0.515SS..Hα-helixtrans-64.3-42.1173.400000111.7R65 E66 I71 V72 V73R65-A69 WeakPolarHBondContact O-CB 3.26Å; R65-A69 PolarHBondContact O-N 3.25Å; E66-A69 PolarHBondContact O-N 3.39Å; A69-I71 VanDerWaalsContact C-N 3.34Å; A69-I71 PolarHBondContact O-N 3.46Å; A69-V72 PolarHBondContact O-N 3.13Å; A69-V73 WeakPolarHBondContact O-CG2 3.48Å; A69-V73 PolarHBondContact O-N 2.98Å
70E89.4Confident89Confident115 Ų11591.5 Ų91.554%0.53751%0.509SS..Hα-helixtrans-61.2-40.9174.3-76.1-176.117900112.3E66 L67 V73 N74E66-E70 PolarHBondContact O-N 3.13Å; L67-E70 PolarHBondContact O-N 3.15Å; E70-V73 PolarHBondContact O-N 3.36Å; E70-N74 WeakPolarHBondContact O-CB 3.34Å; E70-N74 PolarHBondContact O-N 3.47Å; E70-N74 PolarHBondContact O-ND2 3.31Å
71I88.8Confident89Confident106 Ų10688.6 Ų88.654%0.54450%0.502SS..Hα-helixtrans-61.8-44.7176-71.3166.9000110.7L67 N68 A69 N74 S75L67-I71 VanDerWaalsContact O-CG1 3.27Å; L67-I71 WeakPolarHBondContact O-CG1 3.39Å; L67-I71 PolarHBondContact O-N 3.45Å; N68-I71 PolarHBondContact O-N 3.37Å; A69-I71 VanDerWaalsContact C-N 3.34Å; A69-I71 PolarHBondContact O-N 3.46Å; I71-N74 PolarHBondContact O-N 2.98Å; I71-S75 VanDerWaalsContact O-CB 3.3Å; I71-S75 WeakPolarHBondContact O-CB 3.41Å; I71-S75 PolarHBondContact O-N 2.93Å
72V92Very high89.1Confident97 Ų9790.9 Ų90.959%0.58852%0.515SS*.Hα-helixtrans-64.2-43.3177.7172.90000111.4N68 A69 S75 A76N68-V72 WeakPolarHBondContact O-CG2 3.45Å; N68-V72 PolarHBondContact O-N 3.42Å; A69-V72 PolarHBondContact O-N 3.13Å; V72-S75 WeakPolarHBondContact O-CB 3.32Å; V72-S75 PolarHBondContact O-N 3.48Å; V72-A76 PolarHBondContact O-N 3.45Å
73V91.5Very high89.2Confident75 Ų7595.1 Ų95.146%0.45552%0.524SS..Hα-helixtrans-63.4-43.3176.7170.50000111.3A69 E70 A76 K77A69-V73 WeakPolarHBondContact O-CG2 3.48Å; A69-V73 PolarHBondContact O-N 2.98Å; E70-V73 PolarHBondContact O-N 3.36Å; V73-A76 PolarHBondContact O-N 3.42Å; V73-K77 HydrophobicContact CG1-CD 4.32Å; V73-K77 WeakPolarHBondContact O-CG 3.32Å; V73-K77 PolarHBondContact O-N 3.4Å
74N89.2Confident89.2Confident85 Ų8594 Ų9446%0.45552%0.524SS..Hα-helixtrans-68.1-38.3178.4-76.6-21.9000112E70 I71 A76 K77 V78E70-N74 WeakPolarHBondContact O-CB 3.34Å; E70-N74 PolarHBondContact O-N 3.47Å; E70-N74 PolarHBondContact O-ND2 3.31Å; I71-N74 PolarHBondContact O-N 2.98Å; N74-A76 VanDerWaalsContact C-N 3.34Å; N74-A76 PolarHBondContact O-N 2.96Å; N74-K77 PolarHBondContact O-N 3.09Å; N74-V78 WeakPolarHBondContact O-CG2 3.33Å; N74-V78 PolarHBondContact O-N 3.34Å
75S89.2Confident89.3Confident79 Ų7993.5 Ų93.555%0.55252%0.522SS*.Hα-helixtrans-56.6-47.1171.2169.70000111.6I71 V72 K77 V78 A79I71-S75 VanDerWaalsContact O-CB 3.3Å; I71-S75 WeakPolarHBondContact O-CB 3.41Å; I71-S75 PolarHBondContact O-N 2.93Å; V72-S75 WeakPolarHBondContact O-CB 3.32Å; V72-S75 PolarHBondContact O-N 3.48Å; S75-K77 PolarHBondContact O-N 3.41Å; S75-V78 PolarHBondContact O-N 3.47Å; S75-A79 PolarHBondContact O-N 2.98Å
76A89.8Confident89.3Confident56 Ų5692.9 Ų92.946%0.46353%0.525SS..Hα-helixtrans-63.9-39.1176.900000112.8V72 V73 N74 A79 T80V72-A76 PolarHBondContact O-N 3.45Å; V73-A76 PolarHBondContact O-N 3.42Å; N74-A76 VanDerWaalsContact C-N 3.34Å; N74-A76 PolarHBondContact O-N 2.96Å; A76-A79 PolarHBondContact O-N 2.95Å; A76-T80 PolarHBondContact O-N 3.34Å; A76-T80 PolarHBondContact O-OG1 2.88Å
77K90.3Very high89.4Confident127 Ų12790.7 Ų90.755%0.55252%0.517SS*.Hα-helixtrans-63.7-41.7174.4-74.6176.6-178.3175.30112.4V73 N74 S75 T80 A81V73-K77 HydrophobicContact CG1-CD 4.32Å; V73-K77 WeakPolarHBondContact O-CG 3.32Å; V73-K77 PolarHBondContact O-N 3.4Å; N74-K77 PolarHBondContact O-N 3.09Å; S75-K77 PolarHBondContact O-N 3.41Å; K77-T80 VanDerWaalsContact CA-OG1 3.3Å; K77-T80 WeakPolarHBondContact CA-OG1 3.45Å; K77-T80 PolarHBondContact O-N 3.46Å; K77-T80 PolarHBondContact O-OG1 3.02Å; K77-A81 WeakPolarHBondContact O-CB 3.46Å; K77-A81 PolarHBondContact O-N 2.88Å
78V89.7Confident89.4Confident89 Ų8991 Ų9154%0.53952%0.519SS..Hα-helixtrans-66.5-42.1177.1171.20000110.7N74 S75 T80 A81 L82N74-V78 WeakPolarHBondContact O-CG2 3.33Å; N74-V78 PolarHBondContact O-N 3.34Å; S75-V78 PolarHBondContact O-N 3.47Å; V78-T80 VanDerWaalsContact C-N 3.35Å; V78-T80 PolarHBondContact O-N 3.32Å; V78-A81 PolarHBondContact O-N 2.87Å; V78-L82 HydrophobicContact CG1-CD1 4.03Å; V78-L82 WeakPolarHBondContact O-CB 3.5Å; V78-L82 PolarHBondContact O-N 3.4Å
79A89Confident89.3Confident59 Ų5992.7 Ų92.749%0.48852%0.524SS..Hα-helixtrans-62.5-40176.500000112.6S75 A76 K83S75-A79 PolarHBondContact O-N 2.98Å; A76-A79 PolarHBondContact O-N 2.95Å; A79-K83 PolarHBondContact O-N 3.46Å; A79-K83 VanDerWaalsContact O-N 3.09Å
80T89.5Confident89.2Confident84 Ų8494.4 Ų94.452%0.51553%0.529SS..Hα-helixtrans-69-40.9175.432.20000112.5A76 K77 V78 L82 K83 L84A76-T80 PolarHBondContact O-N 3.34Å; A76-T80 PolarHBondContact O-OG1 2.88Å; K77-T80 VanDerWaalsContact CA-OG1 3.3Å; K77-T80 WeakPolarHBondContact CA-OG1 3.45Å; K77-T80 PolarHBondContact O-N 3.46Å; K77-T80 PolarHBondContact O-OG1 3.02Å; V78-T80 VanDerWaalsContact C-N 3.35Å; V78-T80 PolarHBondContact O-N 3.32Å; T80-L82 PolarHBondContact O-N 2.98Å; T80-K83 PolarHBondContact O-N 3.35Å; T80-L84 PolarHBondContact O-N 3.49Å
81A88.1Confident89.2Confident58 Ų5892.1 Ų92.148%0.47952%0.523SS..Hα-helixtrans-63-40.2174.900000112.5K77 V78 K83 L84 S85K77-A81 WeakPolarHBondContact O-CB 3.46Å; K77-A81 PolarHBondContact O-N 2.88Å; V78-A81 PolarHBondContact O-N 2.87Å; A81-K83 VanDerWaalsContact C-N 3.35Å; A81-L84 PolarHBondContact O-N 3.41Å; A81-S85 WeakPolarHBondContact O-CB 3.23Å; A81-S85 PolarHBondContact O-N 3.38Å
82L88Confident89.2Confident107 Ų10791.5 Ų91.556%0.5652%0.52SS*.Hα-helixtrans-62.4-41.4174-87.6161.3000112V78 T80 S85 Q86V78-L82 HydrophobicContact CG1-CD1 4.03Å; V78-L82 WeakPolarHBondContact O-CB 3.5Å; V78-L82 PolarHBondContact O-N 3.4Å; T80-L82 PolarHBondContact O-N 2.98Å; L82-S85 PolarHBondContact O-N 2.89Å; L82-Q86 WeakPolarHBondContact O-CG 3.18Å; L82-Q86 PolarHBondContact O-N 3.43Å; L82-Q86 VanDerWaalsContact O-N 3.09Å
83K90.3Very high89Confident136 Ų13689.6 Ų89.659%0.59151%0.514SS*.Hα-helixtrans-65.9-45.5177.8-162.7177.4-178.5-1750111.8A79 T80 A81 S85 Q86 D87A79-K83 PolarHBondContact O-N 3.46Å; A79-K83 VanDerWaalsContact O-N 3.09Å; T80-K83 PolarHBondContact O-N 3.35Å; A81-K83 VanDerWaalsContact C-N 3.35Å; K83-S85 VanDerWaalsContact C-N 3.32Å; K83-S85 PolarHBondContact O-N 3.02Å; K83-Q86 WeakPolarHBondContact O-CB 3.28Å; K83-Q86 PolarHBondContact O-N 3.38Å; K83-Q86 VanDerWaalsContact O-N 3.13Å; K83-D87 PolarHBondContact O-N 3.27Å
84L89.5Confident88.8Confident107 Ų10788.7 Ų88.756%0.5651%0.511SS*.Hα-helixtrans-58.5-43.2174.1-77.4165.1000111.8T80 A81 Q86 D87 D88T80-L84 PolarHBondContact O-N 3.49Å; A81-L84 PolarHBondContact O-N 3.41Å; L84-Q86 VanDerWaalsContact C-N 3.29Å; L84-Q86 PolarHBondContact O-N 2.78Å; L84-D87 PolarHBondContact O-N 3.2Å; L84-D88 WeakPolarHBondContact O-CB 3.31Å; L84-D88 VanDerWaalsContact O-CG 3.32Å; L84-D88 PolarHBondContact O-N 2.71Å
85S87.6Confident88.8Confident67 Ų6788.8 Ų88.847%0.46951%0.511SS..Hα-helixtrans-64.3-32.2177-179.70000113.2A81 L82 K83 Q89A81-S85 WeakPolarHBondContact O-CB 3.23Å; A81-S85 PolarHBondContact O-N 3.38Å; L82-S85 PolarHBondContact O-N 2.89Å; K83-S85 VanDerWaalsContact C-N 3.32Å; K83-S85 PolarHBondContact O-N 3.02Å; S85-Q89 WeakPolarHBondContact O-CG 3.49Å; S85-Q89 PolarHBondContact O-N 3.34Å; S85-Q89 VanDerWaalsContact O-N 3.14Å
86Q87.6Confident88.7Confident128 Ų12891.8 Ų91.860%0.59851%0.514SS*.Hα-helixtrans-71.1-43.6173.8-75.5179.3-9.100111L82 K83 L84 D88 Q89 T90L82-Q86 WeakPolarHBondContact O-CG 3.18Å; L82-Q86 PolarHBondContact O-N 3.43Å; L82-Q86 VanDerWaalsContact O-N 3.09Å; K83-Q86 WeakPolarHBondContact O-CB 3.28Å; K83-Q86 PolarHBondContact O-N 3.38Å; K83-Q86 VanDerWaalsContact O-N 3.13Å; L84-Q86 VanDerWaalsContact C-N 3.29Å; L84-Q86 PolarHBondContact O-N 2.78Å; Q86-D88 PolarHBondContact O-N 3.07Å; Q86-Q89 WeakPolarHBondContact O-CB 3.24Å; Q86-Q89 PolarHBondContact O-N 2.95Å; Q86-T90 WeakPolarHBondContact O-CG2 3.44Å; Q86-T90 PolarHBondContact O-N 3.05Å
87D89.2Confident88.6Confident80 Ų8096.2 Ų96.243%0.42852%0.523SS..Hα-helixtrans-63-41.7176.9-66.6-20000111K83 L84 Q89 T90 T91K83-D87 PolarHBondContact O-N 3.27Å; L84-D87 PolarHBondContact O-N 3.2Å; D87-Q89 PolarHBondContact O-N 3.26Å; D87-T90 PolarHBondContact O-N 2.87Å; D87-T90 PolarHBondContact O-OG1 3.49Å; D87-T91 PolarHBondContact O-N 3.16Å; D87-T91 PolarHBondContact O-OG1 3.29Å
88D89.9Confident88.4Confident95 Ų9596 Ų9651%0.50852%0.524SS..Hα-helixtrans-61-43.5174-75-18.2000111.8L84 Q86 T90 T91 I92L84-D88 WeakPolarHBondContact O-CB 3.31Å; L84-D88 VanDerWaalsContact O-CG 3.32Å; L84-D88 PolarHBondContact O-N 2.71Å; Q86-D88 PolarHBondContact O-N 3.07Å; D88-T90 VanDerWaalsContact C-N 3.32Å; D88-T90 PolarHBondContact O-N 3.46Å; D88-T91 PolarHBondContact O-N 2.86Å; D88-I92 WeakPolarHBondContact O-CB 3.46Å; D88-I92 WeakPolarHBondContact O-CG1 3.48Å; D88-I92 PolarHBondContact O-N 2.95Å
89Q86.6Confident88.2Confident141 Ų14196.5 Ų96.566%0.65952%0.522SS*.Hα-helixtrans-58.8-42.7174.8-84.5-102.1-9.100111.8S85 Q86 D87 A93S85-Q89 WeakPolarHBondContact O-CG 3.49Å; S85-Q89 PolarHBondContact O-N 3.34Å; S85-Q89 VanDerWaalsContact O-N 3.14Å; Q86-Q89 WeakPolarHBondContact O-CB 3.24Å; Q86-Q89 PolarHBondContact O-N 2.95Å; D87-Q89 PolarHBondContact O-N 3.26Å; Q89-A93 WeakPolarHBondContact O-CB 3.47Å; Q89-A93 PolarHBondContact O-N 3.43Å
90T88.4Confident88.1Confident92 Ų9299.4 Ų99.456%0.56453%0.526SS*.Hα-helixtrans-66.5-38.6176.764.40000112.4Q86 D87 D88 A93 S94Q86-T90 WeakPolarHBondContact O-CG2 3.44Å; Q86-T90 PolarHBondContact O-N 3.05Å; D87-T90 PolarHBondContact O-N 2.87Å; D87-T90 PolarHBondContact O-OG1 3.49Å; D88-T90 VanDerWaalsContact C-N 3.32Å; D88-T90 PolarHBondContact O-N 3.46Å; T90-A93 PolarHBondContact O-N 3.05Å; T90-S94 PolarHBondContact O-N 3.36Å
91T88.6Confident88Confident67 Ų67102.3 Ų102.341%0.41153%0.531SS..Hα-helixtrans-69.8-40.3178.6-51.70000111.7D87 D88 A93 S94 L95D87-T91 PolarHBondContact O-N 3.16Å; D87-T91 PolarHBondContact O-OG1 3.29Å; D88-T91 PolarHBondContact O-N 2.86Å; T91-A93 VanDerWaalsContact C-N 3.29Å; T91-A93 PolarHBondContact O-N 3.28Å; T91-S94 PolarHBondContact O-N 3.16Å; T91-S94 PolarHBondContact O-OG 3.3Å; T91-L95 HydrophobicContact CG2-CD1 4.19Å; T91-L95 WeakPolarHBondContact O-CB 3.4Å; T91-L95 WeakPolarHBondContact O-CG 3.47Å; T91-L95 PolarHBondContact O-N 3Å
92I88.4Confident87.9Confident93 Ų93101.5 Ų101.548%0.47753%0.525SS..Hα-helixtrans-63.4-39.1174.2-69.7164.9000110.3D88 K96D88-I92 WeakPolarHBondContact O-CB 3.46Å; D88-I92 WeakPolarHBondContact O-CG1 3.48Å; D88-I92 PolarHBondContact O-N 2.95Å; I92-K96 HydrophobicContact CG2-CD 4.28Å; I92-K96 WeakPolarHBondContact O-CB 3.48Å; I92-K96 WeakPolarHBondContact O-CG 3.45Å; I92-K96 PolarHBondContact O-N 3.49Å
93A87.7Confident87.8Confident57 Ų57104.7 Ų104.747%0.47153%0.529SS..Hα-helixtrans-66.8-37.9177.700000112.8Q89 T90 T91 K97Q89-A93 WeakPolarHBondContact O-CB 3.47Å; Q89-A93 PolarHBondContact O-N 3.43Å; T90-A93 PolarHBondContact O-N 3.05Å; T91-A93 VanDerWaalsContact C-N 3.29Å; T91-A93 PolarHBondContact O-N 3.28Å; A93-K97 PolarHBondContact O-N 3.15Å
94S88.9Confident87.5Confident55 Ų55105 Ų10539%0.38553%0.531SS..Hα-helixtrans-68.7-45.817561.90000111.8T90 T91 K96 K97 E98T90-S94 PolarHBondContact O-N 3.36Å; T91-S94 PolarHBondContact O-N 3.16Å; T91-S94 PolarHBondContact O-OG 3.3Å; S94-K96 VanDerWaalsContact C-N 3.33Å; S94-K96 PolarHBondContact O-N 3.07Å; S94-K97 WeakPolarHBondContact O-CB 3.27Å; S94-K97 PolarHBondContact O-N 3.41Å; S94-K97 VanDerWaalsContact O-N 3.09Å; S94-E98 PolarHBondContact O-N 2.86Å
95L88.4Confident87.3Confident87 Ų87106.2 Ų106.246%0.45554%0.535SS..Hα-helixtrans-61.4-38.8177.4-72.2172000112.3T91 K97 E98 I99T91-L95 HydrophobicContact CG2-CD1 4.19Å; T91-L95 WeakPolarHBondContact O-CB 3.4Å; T91-L95 WeakPolarHBondContact O-CG 3.47Å; T91-L95 PolarHBondContact O-N 3Å; L95-K97 VanDerWaalsContact C-N 3.33Å; L95-K97 PolarHBondContact O-N 3Å; L95-E98 PolarHBondContact O-N 3.14Å; L95-E98 VanDerWaalsContact O-N 3.16Å; L95-I99 WeakPolarHBondContact O-CG1 3.49Å; L95-I99 PolarHBondContact O-N 3.38Å
96K87.7Confident87.2Confident142 Ų142107.4 Ų107.462%0.61754%0.539SS*.Hα-helixtrans-59.9-42173.5-80-179.1177.1-176.10112.2I92 S94 E98 I99 E100I92-K96 HydrophobicContact CG2-CD 4.28Å; I92-K96 WeakPolarHBondContact O-CB 3.48Å; I92-K96 WeakPolarHBondContact O-CG 3.45Å; I92-K96 PolarHBondContact O-N 3.49Å; S94-K96 VanDerWaalsContact C-N 3.33Å; S94-K96 PolarHBondContact O-N 3.07Å; K96-E98 VanDerWaalsContact C-N 3.33Å; K96-I99 PolarHBondContact O-N 3.41Å; K96-E100 WeakPolarHBondContact O-CB 3.43Å; K96-E100 PolarHBondContact O-N 3.34Å
97K87.2Confident87.3Confident150 Ų150105.4 Ų105.465%0.65253%0.533SS*.Hα-helixtrans-65.1-35.9174.5-87.8-177.1175.6176.60112.5A93 S94 L95 K101A93-K97 PolarHBondContact O-N 3.15Å; S94-K97 WeakPolarHBondContact O-CB 3.27Å; S94-K97 PolarHBondContact O-N 3.41Å; S94-K97 VanDerWaalsContact O-N 3.09Å; L95-K97 VanDerWaalsContact C-N 3.33Å; L95-K97 PolarHBondContact O-N 3Å; K97-K101 WeakPolarHBondContact O-CG 3.33Å; K97-K101 PolarHBondContact O-N 3.2Å; K97-K101 VanDerWaalsContact O-N 3.08Å
98E85.7Confident87.1Confident122 Ų122104.2 Ų104.257%0.5753%0.531SS*.Hα-helixtrans-70-42.2177.1-72.3-177.3176.900112.1S94 L95 K96 E100 K101 A102S94-E98 PolarHBondContact O-N 2.86Å; L95-E98 PolarHBondContact O-N 3.14Å; L95-E98 VanDerWaalsContact O-N 3.16Å; K96-E98 VanDerWaalsContact C-N 3.33Å; E98-E100 VanDerWaalsContact C-N 3.33Å; E98-E100 PolarHBondContact O-N 3.02Å; E98-K101 WeakPolarHBondContact O-CB 3.46Å; E98-K101 PolarHBondContact O-N 3.49Å; E98-A102 PolarHBondContact O-N 3.49Å
99I86.5Confident87Confident99 Ų99102.3 Ų102.351%0.50853%0.528SS..Hα-helixtrans-60-45.5173.5-68.8169.2000110.1L95 K96 K101 A102 W103L95-I99 WeakPolarHBondContact O-CG1 3.49Å; L95-I99 PolarHBondContact O-N 3.38Å; K96-I99 PolarHBondContact O-N 3.41Å; I99-K101 VanDerWaalsContact C-N 3.29Å; I99-K101 PolarHBondContact O-N 3.14Å; I99-A102 WeakPolarHBondContact O-CB 3.29Å; I99-A102 PolarHBondContact O-N 2.92Å; I99-A102 VanDerWaalsContact O-N 3.09Å; I99-W103 VanDerWaalsContact O-CD1 3.27Å; I99-W103 PolarHBondContact O-N 3.1Å
100E86.9Confident87Confident121 Ų121101.8 Ų101.857%0.56552%0.521SS*.Hα-helixtrans-63.3-35.1179.2-158.7177.7-163.400112.4K96 E98 K104K96-E100 WeakPolarHBondContact O-CB 3.43Å; K96-E100 PolarHBondContact O-N 3.34Å; E98-E100 VanDerWaalsContact C-N 3.33Å; E98-E100 PolarHBondContact O-N 3.02Å; E100-K104 WeakPolarHBondContact O-CG 3.2Å; E100-K104 PolarHBondContact O-N 3.28Å
101K87.2Confident86.8Confident145 Ų145102.1 Ų102.163%0.6352%0.519SS*.Hα-helixtrans-67.3-42.2170.6-76.6177.3179.3-179.30112.3K97 E98 I99 K104 M105K97-K101 WeakPolarHBondContact O-CG 3.33Å; K97-K101 PolarHBondContact O-N 3.2Å; K97-K101 VanDerWaalsContact O-N 3.08Å; E98-K101 WeakPolarHBondContact O-CB 3.46Å; E98-K101 PolarHBondContact O-N 3.49Å; I99-K101 VanDerWaalsContact C-N 3.29Å; I99-K101 PolarHBondContact O-N 3.14Å; K101-K104 PolarHBondContact O-N 2.83Å; K101-M105 WeakPolarHBondContact O-CG 3.25Å; K101-M105 PolarHBondContact O-N 2.6Å
102A86.8Confident86.7Confident41 Ų41105.7 Ų105.734%0.33953%0.529SS..Hα-helixtrans-63-42.9178.200000111.6E98 I99 M105 V106E98-A102 PolarHBondContact O-N 3.49Å; I99-A102 WeakPolarHBondContact O-CB 3.29Å; I99-A102 PolarHBondContact O-N 2.92Å; I99-A102 VanDerWaalsContact O-N 3.09Å; A102-M105 HydrophobicContact CB-CE 4.43Å; A102-M105 WeakPolarHBondContact O-CB 3.39Å; A102-M105 PolarHBondContact O-N 2.76Å; A102-M105 VanDerWaalsContact O-N 3.13Å; A102-V106 WeakPolarHBondContact O-CG2 3.48Å; A102-V106 PolarHBondContact O-N 2.86Å
103W84.2Confident86.6Confident173 Ų173105.7 Ų105.766%0.65553%0.527SS*.Hα-helixtrans-59.7-46.3174.3-86.976.8000112.1I99 M105 V106 D107I99-W103 VanDerWaalsContact O-CD1 3.27Å; I99-W103 PolarHBondContact O-N 3.1Å; W103-M105 PolarHBondContact O-N 3.22Å; W103-V106 PolarHBondContact O-N 2.86Å; W103-V106 VanDerWaalsContact O-N 3.08Å; W103-D107 PolarHBondContact O-N 2.86Å
104K85.8Confident86.6Confident143 Ų143106.7 Ų106.762%0.62252%0.522SS*.Hα-helixtrans-60.6-32.6174.3-75-179.2-179.4176.80113.4E100 K101 S108E100-K104 WeakPolarHBondContact O-CG 3.2Å; E100-K104 PolarHBondContact O-N 3.28Å; K101-K104 PolarHBondContact O-N 2.83Å; K104-S108 WeakPolarHBondContact O-CB 3.47Å; K104-S108 PolarHBondContact O-N 3.4Å
105M84.5Confident86.5Confident132 Ų132110.8 Ų110.865%0.6553%0.533SS*.Hα-helixtrans-71.1-38.9174.3-72.3-170.5-6300112.1K101 A102 W103 S108 A109K101-M105 WeakPolarHBondContact O-CG 3.25Å; K101-M105 PolarHBondContact O-N 2.6Å; A102-M105 HydrophobicContact CB-CE 4.43Å; A102-M105 WeakPolarHBondContact O-CB 3.39Å; A102-M105 PolarHBondContact O-N 2.76Å; A102-M105 VanDerWaalsContact O-N 3.13Å; W103-M105 PolarHBondContact O-N 3.22Å; M105-S108 PolarHBondContact O-N 3.23Å; M105-A109 WeakPolarHBondContact O-CB 3.33Å; M105-A109 PolarHBondContact O-N 2.84Å
106V86.3Confident86.3Confident93 Ų93108.9 Ų108.956%0.56453%0.53SS*.Hα-helixtrans-64.1-46.2175.11730000110.5A102 W103 S108 A109 Y110A102-V106 WeakPolarHBondContact O-CG2 3.48Å; A102-V106 PolarHBondContact O-N 2.86Å; W103-V106 PolarHBondContact O-N 2.86Å; W103-V106 VanDerWaalsContact O-N 3.08Å; V106-S108 VanDerWaalsContact C-N 3.32Å; V106-S108 PolarHBondContact O-N 3.4Å; V106-A109 PolarHBondContact O-N 3.46Å; V106-A109 VanDerWaalsContact O-N 3.13Å; V106-Y110 WeakPolarHBondContact O-CB 3.35Å; V106-Y110 PolarHBondContact O-N 3.28Å
107D87.9Confident86.2Confident86 Ų86107.1 Ų107.146%0.4652%0.522SS..Hα-helixtrans-60.1-43.4176.2-66.2-23.6000111.2W103 A109 Y110 D111W103-D107 PolarHBondContact O-N 2.86Å; D107-A109 VanDerWaalsContact C-N 3.34Å; D107-A109 PolarHBondContact O-N 3.46Å; D107-Y110 PolarHBondContact O-N 3.15Å; D107-D111 PolarHBondContact O-N 2.85Å
108S86.6Confident86.1Confident55 Ų55105.8 Ų105.839%0.38552%0.518SS..Hα-helixtrans-65-35.4175.6-176.30000113.2K104 M105 V106 K112K104-S108 WeakPolarHBondContact O-CB 3.47Å; K104-S108 PolarHBondContact O-N 3.4Å; M105-S108 PolarHBondContact O-N 3.23Å; V106-S108 VanDerWaalsContact C-N 3.32Å; V106-S108 PolarHBondContact O-N 3.4Å; S108-K112 VanDerWaalsContact O-CG 3.32Å; S108-K112 WeakPolarHBondContact O-CG 3.33Å; S108-K112 PolarHBondContact O-N 3.3Å
109A85.9Confident86Confident55 Ų55103.9 Ų103.946%0.45552%0.515SS..Hα-helixtrans-69.7-40.4175.200000111.1M105 V106 D107 K112 E113M105-A109 WeakPolarHBondContact O-CB 3.33Å; M105-A109 PolarHBondContact O-N 2.84Å; V106-A109 PolarHBondContact O-N 3.46Å; V106-A109 VanDerWaalsContact O-N 3.13Å; D107-A109 VanDerWaalsContact C-N 3.34Å; D107-A109 PolarHBondContact O-N 3.46Å; A109-K112 PolarHBondContact O-N 2.79Å; A109-E113 PolarHBondContact O-N 2.79Å
110Y86.9Confident85.9Confident130 Ų130103.4 Ų103.451%0.5151%0.512SS..Hα-helixtrans-63-45.3175.8-173.1-97.8000111.7V106 D107 K112 E113 Q114V106-Y110 WeakPolarHBondContact O-CB 3.35Å; V106-Y110 PolarHBondContact O-N 3.28Å; D107-Y110 PolarHBondContact O-N 3.15Å; Y110-K112 VanDerWaalsContact C-N 3.3Å; Y110-K112 PolarHBondContact O-N 3.42Å; Y110-E113 WeakPolarHBondContact O-CB 3.47Å; Y110-E113 PolarHBondContact O-N 3.28Å; Y110-E113 VanDerWaalsContact O-N 3.15Å; Y110-Q114 WeakPolarHBondContact O-CB 3.4Å; Y110-Q114 PolarHBondContact O-N 3.34Å
111D85.3Confident85.7Confident98 Ų98103.1 Ų103.152%0.52451%0.514SS..Hα-helixtrans-61.1-36.9174.8-81.6-13.2000112.6D107 K115D107-D111 PolarHBondContact O-N 2.85Å; D111-K115 WeakPolarHBondContact O-CG 3.49Å; D111-K115 PolarHBondContact O-N 3.42Å; D111-K115 VanDerWaalsContact O-N 3.13Å
112K86.2Confident85.5Confident143 Ų14398.7 Ų98.762%0.62251%0.505SS*.Hα-helixtrans-68.6-40.4174.3-75.1174-1761760111.7S108 A109 Y110 K115 A116S108-K112 VanDerWaalsContact O-CG 3.32Å; S108-K112 WeakPolarHBondContact O-CG 3.33Å; S108-K112 PolarHBondContact O-N 3.3Å; A109-K112 PolarHBondContact O-N 2.79Å; Y110-K112 VanDerWaalsContact C-N 3.3Å; Y110-K112 PolarHBondContact O-N 3.42Å; K112-K115 PolarHBondContact O-N 3.05Å; K112-A116 WeakPolarHBondContact O-CB 3.48Å; K112-A116 PolarHBondContact O-N 3.16Å
113E87Confident85.2Confident93 Ų93100.8 Ų100.844%0.43551%0.51SS..Hα-helixtrans-63.1-42.9175.6-167.7-164.8152.400111.1A109 Y110 A116 K117A109-E113 PolarHBondContact O-N 2.79Å; Y110-E113 WeakPolarHBondContact O-CB 3.47Å; Y110-E113 PolarHBondContact O-N 3.28Å; Y110-E113 VanDerWaalsContact O-N 3.15Å; E113-A116 PolarHBondContact O-N 3.23Å; E113-K117 WeakPolarHBondContact O-CB 3.45Å; E113-K117 PolarHBondContact O-N 3.41Å; E113-K117 VanDerWaalsContact OE1-CE 3.26Å; E113-K117 WeakPolarHBondContact OE1-CE 3.42Å; E113-K117 IonicContact OE1-NZ 2.6Å; E113-K117 PolarHBondContact OE1-NZ 3.49Å
114Q85.9Confident85Confident77 Ų7798.8 Ų98.836%0.3651%0.505SS..Hα-helixtrans-59.6-48.6177.2-156.486.4-3.100110.9Y110 A116 K117 E118Y110-Q114 WeakPolarHBondContact O-CB 3.4Å; Y110-Q114 PolarHBondContact O-N 3.34Å; Q114-A116 PolarHBondContact O-N 2.98Å; Q114-K117 WeakPolarHBondContact O-CB 3.4Å; Q114-K117 PolarHBondContact O-N 2.94Å; Q114-E118 WeakPolarHBondContact O-CG 3.28Å; Q114-E118 PolarHBondContact O-N 3.38Å
115K87Confident84.7Confident142 Ų14298.4 Ų98.462%0.61751%0.506SS*.Hα-helixtrans-62.1-40.6175.2-72.5176.1-178178.60112.4D111 K112 E118 T119D111-K115 WeakPolarHBondContact O-CG 3.49Å; D111-K115 PolarHBondContact O-N 3.42Å; D111-K115 VanDerWaalsContact O-N 3.13Å; K112-K115 PolarHBondContact O-N 3.05Å; K115-E118 PolarHBondContact O-N 3.36Å; K115-T119 WeakPolarHBondContact O-CB 3.43Å; K115-T119 PolarHBondContact O-N 3.23Å; K115-T119 PolarHBondContact O-OG1 2.89Å
116A85.2Confident84.4Confident46 Ų4697.5 Ų97.538%0.3850%0.5SS..Hα-helixtrans-64.5-40.5176.300000111.5K112 E113 Q114 T119 I120K112-A116 WeakPolarHBondContact O-CB 3.48Å; K112-A116 PolarHBondContact O-N 3.16Å; E113-A116 PolarHBondContact O-N 3.23Å; Q114-A116 PolarHBondContact O-N 2.98Å; A116-T119 PolarHBondContact O-N 3.46Å; A116-I120 WeakPolarHBondContact O-CB 3.43Å; A116-I120 WeakPolarHBondContact O-CG1 3.45Å; A116-I120 PolarHBondContact O-N 3.22Å
117K85.4Confident83.9Confident106 Ų10697.8 Ų97.846%0.46150%0.497SS..Hα-helixtrans-61.9-44.3174.1-83.4171.7169.3161.30112.1E113 Q114 T119 I120 L121E113-K117 WeakPolarHBondContact O-CB 3.45Å; E113-K117 PolarHBondContact O-N 3.41Å; E113-K117 VanDerWaalsContact OE1-CE 3.26Å; E113-K117 WeakPolarHBondContact OE1-CE 3.42Å; E113-K117 IonicContact OE1-NZ 2.6Å; E113-K117 PolarHBondContact OE1-NZ 3.49Å; Q114-K117 WeakPolarHBondContact O-CB 3.4Å; Q114-K117 PolarHBondContact O-N 2.94Å; K117-T119 VanDerWaalsContact C-N 3.35Å; K117-I120 PolarHBondContact O-N 3.26Å; K117-L121 WeakPolarHBondContact O-CG 3.44Å; K117-L121 PolarHBondContact O-N 3.14Å
118E84.8Confident83.4Confident122 Ų12297.8 Ų97.857%0.5750%0.501SS*.Hα-helixtrans-61.2-43.1174.3-71.7171.9-177.700111.6Q114 K115 L121 A122Q114-E118 WeakPolarHBondContact O-CG 3.28Å; Q114-E118 PolarHBondContact O-N 3.38Å; K115-E118 PolarHBondContact O-N 3.36Å; E118-L121 PolarHBondContact O-N 3.48Å; E118-A122 PolarHBondContact O-N 3.07Å
119T84.1Confident82.8Confident81 Ų8199.8 Ų99.850%0.49751%0.507SS..Hα-helixtrans-64.6-41.5177-46.10000111.6K115 A116 K117 L121 A122 L123K115-T119 WeakPolarHBondContact O-CB 3.43Å; K115-T119 PolarHBondContact O-N 3.23Å; K115-T119 PolarHBondContact O-OG1 2.89Å; A116-T119 PolarHBondContact O-N 3.46Å; K117-T119 VanDerWaalsContact C-N 3.35Å; T119-L121 VanDerWaalsContact C-N 3.32Å; T119-L121 PolarHBondContact O-N 3.42Å; T119-A122 PolarHBondContact O-N 3Å; T119-L123 HydrophobicContact CG2-CD1 4.2Å; T119-L123 WeakPolarHBondContact O-CB 3.28Å; T119-L123 VanDerWaalsContact O-CG 3.31Å; T119-L123 WeakPolarHBondContact O-CG 3.41Å; T119-L123 PolarHBondContact O-N 3.28Å
120I84Confident82Confident89 Ų89101.7 Ų101.746%0.45651%0.509SS..Hα-helixtrans-64.7-38.2176.1-71.2164.8000110.8A116 K117 K124A116-I120 WeakPolarHBondContact O-CB 3.43Å; A116-I120 WeakPolarHBondContact O-CG1 3.45Å; A116-I120 PolarHBondContact O-N 3.22Å; K117-I120 PolarHBondContact O-N 3.26Å; I120-K124 HydrophobicContact CG2-CD 4.17Å; I120-K124 HydrophobicContact CG2-CG 4.39Å; I120-K124 WeakPolarHBondContact O-CB 3.38Å; I120-K124 VanDerWaalsContact O-CG 3.27Å; I120-K124 WeakPolarHBondContact O-CG 3.36Å; I120-K124 PolarHBondContact O-N 3.21Å
121L83.3Confident81.1Confident116 Ų11698.6 Ų98.661%0.60750%0.503SS*.Hα-helixtrans-64.5-46175.7-78.6166.6000111.2K117 E118 T119 L123 K124 E125K117-L121 WeakPolarHBondContact O-CG 3.44Å; K117-L121 PolarHBondContact O-N 3.14Å; E118-L121 PolarHBondContact O-N 3.48Å; T119-L121 VanDerWaalsContact C-N 3.32Å; T119-L121 PolarHBondContact O-N 3.42Å; L121-L123 PolarHBondContact O-N 3.03Å; L121-K124 PolarHBondContact O-N 3.32Å; L121-E125 PolarHBondContact O-N 2.93Å
122A82Confident80Confident52 Ų52100.8 Ų100.843%0.4351%0.508SS..Hα-helixtrans-60.3-45.3175.400000112E118 T119 K124 E125 E126E118-A122 PolarHBondContact O-N 3.07Å; T119-A122 PolarHBondContact O-N 3Å; A122-K124 PolarHBondContact O-N 2.98Å; A122-E125 WeakPolarHBondContact O-CB 3.3Å; A122-E125 PolarHBondContact O-N 3.07Å; A122-E126 PolarHBondContact O-N 2.96Å
123L81.2Confident78.6Confident85 Ų85100 Ų10045%0.44551%0.51SS..Hα-helixtrans-65.9-35.6176.7-73.5171.4000112.5T119 L121 E125 E126 I127T119-L123 HydrophobicContact CG2-CD1 4.2Å; T119-L123 WeakPolarHBondContact O-CB 3.28Å; T119-L123 VanDerWaalsContact O-CG 3.31Å; T119-L123 WeakPolarHBondContact O-CG 3.41Å; T119-L123 PolarHBondContact O-N 3.28Å; L121-L123 PolarHBondContact O-N 3.03Å; L123-E125 VanDerWaalsContact C-N 3.3Å; L123-E126 PolarHBondContact O-N 3.35Å; L123-I127 WeakPolarHBondContact O-CB 3.46Å; L123-I127 WeakPolarHBondContact O-CG1 3.42Å; L123-I127 PolarHBondContact O-N 2.86Å
124K80.6Confident77.2Confident130 Ų130101.2 Ų101.257%0.56552%0.519SS*.Hα-helixtrans-64.3-38.6173.5-81.6179.4177-173.80111.2I120 L121 A122 I127 V128I120-K124 HydrophobicContact CG2-CD 4.17Å; I120-K124 HydrophobicContact CG2-CG 4.39Å; I120-K124 WeakPolarHBondContact O-CB 3.38Å; I120-K124 VanDerWaalsContact O-CG 3.27Å; I120-K124 WeakPolarHBondContact O-CG 3.36Å; I120-K124 PolarHBondContact O-N 3.21Å; L121-K124 PolarHBondContact O-N 3.32Å; A122-K124 PolarHBondContact O-N 2.98Å; K124-I127 PolarHBondContact O-N 3.35Å; K124-V128 VanDerWaalsContact O-CG2 3.28Å; K124-V128 WeakPolarHBondContact O-CG2 3.38Å; K124-V128 PolarHBondContact O-N 3.3Å
125E79.2Confident75.7Confident136 Ų136104.9 Ų104.964%0.63654%0.536SS*.Hα-helixtrans-68-40.9176.4-152.5169.8-159.200111.3L121 A122 L123 V128 N129L121-E125 PolarHBondContact O-N 2.93Å; A122-E125 WeakPolarHBondContact O-CB 3.3Å; A122-E125 PolarHBondContact O-N 3.07Å; L123-E125 VanDerWaalsContact C-N 3.3Å; E125-V128 PolarHBondContact O-N 3.37Å; E125-N129 PolarHBondContact O-N 3.46Å; E125-N129 PolarHBondContact O-ND2 3.43Å
126E77.2Confident73.5Confident112 Ų112106.5 Ų106.552%0.52355%0.546SS..Hα-helixtrans-63.2-42.7171.2-78.9-17516800112.8A122 L123 V128 N129 L130A122-E126 PolarHBondContact O-N 2.96Å; L123-E126 PolarHBondContact O-N 3.35Å; E126-V128 VanDerWaalsContact C-N 3.31Å; E126-V128 PolarHBondContact O-N 2.96Å; E126-N129 CarbonylContact O-C 3.58Å; E126-N129 PolarHBondContact O-N 2.9Å; E126-N129 VanDerWaalsContact O-N 3.16Å; E126-L130 WeakPolarHBondContact O-CB 3.27Å; E126-L130 WeakPolarHBondContact O-CG 3.41Å; E126-L130 PolarHBondContact O-N 3.16Å
127I76.2Confident71Confident99 Ų99107.2 Ų107.251%0.50856%0.557SS.*Hα-helixtrans-61.2-42.9175.4-72.7165.7000109.8L123 K124 N129 L130 T131L123-I127 WeakPolarHBondContact O-CB 3.46Å; L123-I127 WeakPolarHBondContact O-CG1 3.42Å; L123-I127 PolarHBondContact O-N 2.86Å; K124-I127 PolarHBondContact O-N 3.35Å; I127-N129 VanDerWaalsContact C-N 3.3Å; I127-N129 PolarHBondContact O-N 2.96Å; I127-L130 PolarHBondContact O-N 2.77Å; I127-T131 WeakPolarHBondContact O-CB 3.32Å; I127-T131 PolarHBondContact O-N 3.05Å; I127-T131 PolarHBondContact O-OG1 2.96Å
128V76.7Confident68.4Low87 Ų87107.7 Ų107.753%0.52757%0.574SS.*Hα-helixtrans-62.2-40.5176.1169.80000110.9K124 E125 E126 K132K124-V128 VanDerWaalsContact O-CG2 3.28Å; K124-V128 WeakPolarHBondContact O-CG2 3.38Å; K124-V128 PolarHBondContact O-N 3.3Å; E125-V128 PolarHBondContact O-N 3.37Å; E126-V128 VanDerWaalsContact C-N 3.31Å; E126-V128 PolarHBondContact O-N 2.96Å; V128-K132 PolarHBondContact O-N 2.96Å; V128-K132 VanDerWaalsContact O-N 3.1Å
129N74.5Confident65.7Low97 Ų97104.9 Ų104.952%0.51958%0.578SS.*Hα-helixtrans-68.1-42177.3-69.2-25.5000112.7E125 E126 I127 K132 L133E125-N129 PolarHBondContact O-N 3.46Å; E125-N129 PolarHBondContact O-ND2 3.43Å; E126-N129 CarbonylContact O-C 3.58Å; E126-N129 PolarHBondContact O-N 2.9Å; E126-N129 VanDerWaalsContact O-N 3.16Å; I127-N129 VanDerWaalsContact C-N 3.3Å; I127-N129 PolarHBondContact O-N 2.96Å; N129-K132 WeakPolarHBondContact O-CB 3.3Å; N129-K132 PolarHBondContact O-N 3.45Å; N129-L133 PolarHBondContact O-N 2.81Å
130L69.5Low63Low95 Ų95109.4 Ų109.450%0.49760%0.598SS.*Hα-helixtrans-71.9-36.7177.4-74.8167.9000112.1E126 I127 K132 L133 I134E126-L130 WeakPolarHBondContact O-CB 3.27Å; E126-L130 WeakPolarHBondContact O-CG 3.41Å; E126-L130 PolarHBondContact O-N 3.16Å; I127-L130 PolarHBondContact O-N 2.77Å; L130-K132 VanDerWaalsContact C-N 3.31Å; L130-K132 PolarHBondContact O-N 3.44Å; L130-L133 CarbonylContact O-C 3.58Å; L130-L133 WeakPolarHBondContact O-CA 3.44Å; L130-L133 WeakPolarHBondContact O-CB 3.34Å; L130-L133 PolarHBondContact O-N 2.91Å; L130-I134 VanDerWaalsContact O-CG1 3.29Å; L130-I134 WeakPolarHBondContact O-CG1 3.21Å; L130-I134 PolarHBondContact O-N 3.39Å
131T67.3Low60.2Low64 Ų64109.6 Ų109.639%0.39361%0.607SS.*Hα-helixtrans-64.8-39.5175.5-52.70000110I127 L133 I134 E135I127-T131 WeakPolarHBondContact O-CB 3.32Å; I127-T131 PolarHBondContact O-N 3.05Å; I127-T131 PolarHBondContact O-OG1 2.96Å; T131-L133 PolarHBondContact O-N 3.4Å; T131-I134 PolarHBondContact O-N 3.33Å; T131-E135 WeakPolarHBondContact O-CB 3.34Å; T131-E135 PolarHBondContact O-N 3.19Å
132K63.3Low57.5Low144 Ų144111.5 Ų111.563%0.62662%0.615SS**Hα-helixtrans-59.9-32.9169.2-98.5-178.6176176.10113.3V128 N129 L130V128-K132 PolarHBondContact O-N 2.96Å; V128-K132 VanDerWaalsContact O-N 3.1Å; N129-K132 WeakPolarHBondContact O-CB 3.3Å; N129-K132 PolarHBondContact O-N 3.45Å; L130-K132 VanDerWaalsContact C-N 3.31Å; L130-K132 PolarHBondContact O-N 3.44Å
133L56.4Low55Low126 Ų126116 Ų11666%0.6663%0.632SS**Hα-helixtrans-76.4-37.7177.7-141.186.8000112N129 L130 T131 Q136N129-L133 PolarHBondContact O-N 2.81Å; L130-L133 CarbonylContact O-C 3.58Å; L130-L133 WeakPolarHBondContact O-CA 3.44Å; L130-L133 WeakPolarHBondContact O-CB 3.34Å; L130-L133 PolarHBondContact O-N 2.91Å; T131-L133 PolarHBondContact O-N 3.4Å; L133-Q136 PolarHBondContact O-N 3.01Å
134I58.2Low52.6Low120 Ų120119.4 Ų119.462%0.61565%0.645SS**Hα-helixtrans-77.2-33.8-178.2-67.6166.1000111.5L130 T131 Q136 G137L130-I134 VanDerWaalsContact O-CG1 3.29Å; L130-I134 WeakPolarHBondContact O-CG1 3.21Å; L130-I134 PolarHBondContact O-N 3.39Å; T131-I134 PolarHBondContact O-N 3.33Å; I134-Q136 PolarHBondContact O-N 3.06Å; I134-Q136 VanDerWaalsContact O-N 3.14Å; I134-G137 CarbonylContact O-C 3.59Å; I134-G137 PolarHBondContact O-N 3.37Å
135E53.9Low50.5Low153 Ų153119.3 Ų119.372%0.71565%0.651SS**THydrogen-bonded Turntrans-62.5-17.4172.3-80.6-176.816200113T131T131-E135 WeakPolarHBondContact O-CB 3.34Å; T131-E135 PolarHBondContact O-N 3.19Å
136Q41Very low48.8Very low177 Ų177118.2 Ų118.283%0.82766%0.658SS**THydrogen-bonded Turntrans-92.83.9173.3-67-172.9-11.800114L133 I134L133-Q136 PolarHBondContact O-N 3.01Å; I134-Q136 PolarHBondContact O-N 3.06Å; I134-Q136 VanDerWaalsContact O-N 3.14Å
137G32.3Very low47.5Very low60 Ų60117.3 Ų117.362%0.61966%0.657SS**  trans-146.356-173.200000114.2I134I134-G137 CarbonylContact O-C 3.59Å; I134-G137 PolarHBondContact O-N 3.37Å
138S31.3Very low46.1Very low117 Ų117117.3 Ų117.382%0.81866%0.657SS**  trans-97.5121.7170.468.10000111.4
139G26.8Very low44.8Very low63 Ų63123.3 Ų123.365%0.64967%0.67SS**  trans175.3129.1164.800000114.9
140L27.9Very low44Very low176 Ų176124 Ų12492%0.92167%0.673SS**  trans95.2114.7159.8-55.1153000114.8
141S25Very low43.3Very low92 Ų92124.1 Ų124.164%0.64367%0.674SS**  cis111124.623.5-1750000111.6
142M26.9Very low43.1Very low156 Ų156126.2 Ų126.277%0.76868%0.682SS**  trans50.1123.9144.5-67.8174.562.700120.7
143D30.3Very low43.4Very low147 Ų147127.1 Ų127.179%0.78669%0.687SS**  -175.512196.6-106-13.4000110.8
144Q30.4Very low44Very low156 Ų156127.5 Ų127.573%0.72968%0.683SS**  trans-119.4131.3178.5-70175.4-2900106.3
145D36.9Very low44.8Very low129 Ų129128.5 Ų128.569%0.6968%0.683SS**SBendtrans-174.2-7.9141.5-97-17.7000115.1N147 I148D145-N147 VanDerWaalsContact C-N 3.32Å; D145-I148 VanDerWaalsContact OD1-CD1 3.3Å; D145-I148 WeakPolarHBondContact OD1-CD1 3.21Å
146S42.5Very low45.9Very low112 Ų112128.3 Ų128.378%0.78368%0.682SS**THydrogen-bonded Turntrans-80-14.2165.9-167.70000113.5I148S146-I148 PolarHBondContact O-N 3.35Å
147N49.6Very low47.5Very low94 Ų94125.7 Ų125.750%0.50367%0.67SS.*Hα-helixtrans-68.4-15.8-179.8-95-17.2000114D145 R149 D150 L151D145-N147 VanDerWaalsContact C-N 3.32Å; N147-R149 VanDerWaalsContact C-N 3.3Å; N147-R149 PolarHBondContact O-N 2.91Å; N147-D150 PolarHBondContact O-N 2.83Å; N147-L151 HydrophobicContact CB-CD1 4.18Å; N147-L151 VanDerWaalsContact O-CB 3.28Å; N147-L151 WeakPolarHBondContact O-CB 3.41Å; N147-L151 WeakPolarHBondContact O-CD1 3.43Å; N147-L151 VanDerWaalsContact O-CG 3.23Å; N147-L151 WeakPolarHBondContact O-CG 2.92Å; N147-L151 PolarHBondContact O-N 3.34Å
148I46.8Very low49.4Very low98 Ų98125.8 Ų125.850%0.50366%0.658SS.*Hα-helixtrans-68.5-27.8-170.1-66.5174.3000112.7D145 S146D145-I148 VanDerWaalsContact OD1-CD1 3.3Å; D145-I148 WeakPolarHBondContact OD1-CD1 3.21Å; S146-I148 PolarHBondContact O-N 3.35Å
149R50.7Low51.8Low214 Ų214122.7 Ų122.781%0.80863%0.634SS**Hα-helixtrans-80.5-38.5176.5-79.8-175.6-177.3170.52.6113.2N147 L151 L152N147-R149 VanDerWaalsContact C-N 3.3Å; N147-R149 PolarHBondContact O-N 2.91Å; R149-L151 VanDerWaalsContact C-N 3.28Å; R149-L152 PolarHBondContact O-N 2.82Å
150D57Low54.4Low110 Ų110127.3 Ų127.359%0.58863%0.632SS**Hα-helixtrans-68.2-33.4174.3-66.6-28.4000110.9N147 L152 K153 F154N147-D150 PolarHBondContact O-N 2.83Å; D150-L152 PolarHBondContact O-N 2.85Å; D150-K153 PolarHBondContact O-N 3.25Å; D150-F154 VanDerWaalsContact O-CB 3.28Å; D150-F154 WeakPolarHBondContact O-CB 3.44Å; D150-F154 PolarHBondContact O-N 2.85Å
151L54.8Low56.9Low98 Ų98124.4 Ų124.451%0.51361%0.614SS.*Hα-helixtrans-58.6-29.3173.1-85.3162.8000113.9N147 R149 K155N147-L151 HydrophobicContact CB-CD1 4.18Å; N147-L151 VanDerWaalsContact O-CB 3.28Å; N147-L151 WeakPolarHBondContact O-CB 3.41Å; N147-L151 WeakPolarHBondContact O-CD1 3.43Å; N147-L151 VanDerWaalsContact O-CG 3.23Å; N147-L151 WeakPolarHBondContact O-CG 2.92Å; N147-L151 PolarHBondContact O-N 3.34Å; R149-L151 VanDerWaalsContact C-N 3.28Å; L151-K155 VanDerWaalsContact O-CB 3.25Å; L151-K155 WeakPolarHBondContact O-CB 3.24Å; L151-K155 PolarHBondContact O-N 3.02Å
152L62.8Low59.6Low108 Ų108126.2 Ų126.257%0.56561%0.607SS**Hα-helixtrans-77.1-39.6-180-80.3168.1000113R149 D150 K155 E156R149-L152 PolarHBondContact O-N 2.82Å; D150-L152 PolarHBondContact O-N 2.85Å; L152-K155 WeakPolarHBondContact O-CB 3.46Å; L152-K155 PolarHBondContact O-N 3.35Å; L152-E156 PolarHBondContact O-N 3.47Å
153K69.2Low62.4Low164 Ų164122.7 Ų122.771%0.71359%0.591SS**Hα-helixtrans-68.9-42.1172.1-77.4-173175.8-178.60111.2D150 K155 E156 E157D150-K153 PolarHBondContact O-N 3.25Å; K153-K155 PolarHBondContact O-N 3.05Å; K153-E156 PolarHBondContact O-N 3.41Å; K153-E156 VanDerWaalsContact O-N 3.17Å; K153-E157 PolarHBondContact O-N 3.36Å
154F69.2Low65Low133 Ų133121 Ų12158%0.58358%0.578SS**Hα-helixtrans-59-38.5174.2-165.3-104000111.2D150 E156 V158D150-F154 VanDerWaalsContact O-CB 3.28Å; D150-F154 WeakPolarHBondContact O-CB 3.44Å; D150-F154 PolarHBondContact O-N 2.85Å; F154-E156 PolarHBondContact O-N 2.91Å; F154-V158 HydrophobicContact CD1-CG2 3.73Å; F154-V158 HydrophobicContact CE1-CG2 3.53Å; F154-V158 HydrophobicContact CE2-CG2 4.41Å; F154-V158 HydrophobicContact CG-CG2 4.25Å; F154-V158 HydrophobicContact CZ-CG2 3.9Å; F154-V158 VanDerWaalsContact O-CB 3.23Å; F154-V158 WeakPolarHBondContact O-CB 3.34Å; F154-V158 WeakPolarHBondContact O-CG2 3.49Å; F154-V158 PolarHBondContact O-N 3.45Å
155K75.9Confident67.5Low141 Ų141118.3 Ų118.361%0.61357%0.568SS**Hα-helixtrans-57.7-49174.6-174.7-173.4177.1-172.10111.8L151 L152 K153 V158 T159L151-K155 VanDerWaalsContact O-CB 3.25Å; L151-K155 WeakPolarHBondContact O-CB 3.24Å; L151-K155 PolarHBondContact O-N 3.02Å; L152-K155 WeakPolarHBondContact O-CB 3.46Å; L152-K155 PolarHBondContact O-N 3.35Å; K153-K155 PolarHBondContact O-N 3.05Å; K155-V158 PolarHBondContact O-N 3.22Å; K155-T159 PolarHBondContact O-N 3.11Å; K155-T159 PolarHBondContact O-OG1 3.37Å
156E76.1Confident69.8Low149 Ų149116.6 Ų116.670%0.69656%0.559SS**Hα-helixtrans-62.7-46.9-178.3-76.9-17716900112.5L152 K153 F154 V158 T159 R160L152-E156 PolarHBondContact O-N 3.47Å; K153-E156 PolarHBondContact O-N 3.41Å; K153-E156 VanDerWaalsContact O-N 3.17Å; F154-E156 PolarHBondContact O-N 2.91Å; E156-V158 PolarHBondContact O-N 3.25Å; E156-T159 WeakPolarHBondContact CA-OG1 3.49Å; E156-T159 PolarHBondContact O-N 3.43Å; E156-T159 PolarHBondContact O-OG1 2.97Å; E156-R160 PolarHBondContact O-N 3.17Å
157E75.2Confident71.9Confident123 Ų123115.4 Ų115.458%0.57555%0.547SS*.Hα-helixtrans-59.7-46175-100.3171.5162.900112.1K153 T159 R160 E161K153-E157 PolarHBondContact O-N 3.36Å; E157-T159 VanDerWaalsContact C-N 3.28Å; E157-T159 PolarHBondContact O-N 2.93Å; E157-R160 PolarHBondContact O-N 3.12Å; E157-R160 VanDerWaalsContact O-N 3.13Å; E157-E161 PolarHBondContact O-N 3.06Å
158V73.2Confident73.7Confident62 Ų62116.7 Ų116.738%0.37655%0.55SS..Hα-helixtrans-61.9-35.3176.6170.40000111.5F154 K155 E156 R162F154-V158 HydrophobicContact CD1-CG2 3.73Å; F154-V158 HydrophobicContact CE1-CG2 3.53Å; F154-V158 HydrophobicContact CE2-CG2 4.41Å; F154-V158 HydrophobicContact CG-CG2 4.25Å; F154-V158 HydrophobicContact CZ-CG2 3.9Å; F154-V158 VanDerWaalsContact O-CB 3.23Å; F154-V158 WeakPolarHBondContact O-CB 3.34Å; F154-V158 WeakPolarHBondContact O-CG2 3.49Å; F154-V158 PolarHBondContact O-N 3.45Å; K155-V158 PolarHBondContact O-N 3.22Å; E156-V158 PolarHBondContact O-N 3.25Å; V158-R162 WeakPolarHBondContact O-CB 3.14Å; V158-R162 PolarHBondContact O-N 3.36Å
159T80.8Confident75.5Confident51 Ų51115.1 Ų115.131%0.31355%0.545SS..Hα-helixtrans-64.7-40.4175.4-8.90000112.1K155 E156 E157 R162 D163K155-T159 PolarHBondContact O-N 3.11Å; K155-T159 PolarHBondContact O-OG1 3.37Å; E156-T159 WeakPolarHBondContact CA-OG1 3.49Å; E156-T159 PolarHBondContact O-N 3.43Å; E156-T159 PolarHBondContact O-OG1 2.97Å; E157-T159 VanDerWaalsContact C-N 3.28Å; E157-T159 PolarHBondContact O-N 2.93Å; T159-R162 WeakPolarHBondContact O-CB 3.49Å; T159-R162 PolarHBondContact O-N 2.91Å; T159-D163 PolarHBondContact O-N 3.37Å
160R82Confident77.3Confident161 Ų161108.4 Ų108.461%0.60853%0.527SS*.Hα-helixtrans-69.5-43.4179.8-166.3-173.972.2158.90.9111.7E156 E157 R162 D163 Q164E156-R160 PolarHBondContact O-N 3.17Å; E157-R160 PolarHBondContact O-N 3.12Å; E157-R160 VanDerWaalsContact O-N 3.13Å; R160-R162 VanDerWaalsContact C-N 3.34Å; R160-D163 PolarHBondContact O-N 3.4Å; R160-Q164 PolarHBondContact O-N 3.49Å; R160-Q164 VanDerWaalsContact O-N 3.14Å
161E79.2Confident78.7Confident114 Ų114109.8 Ų109.853%0.53353%0.528SS..Hα-helixtrans-62.7-42.2174-75-173.3163.400111.6E157 D163 Q164 L165E157-E161 PolarHBondContact O-N 3.06Å; E161-D163 VanDerWaalsContact C-N 3.3Å; E161-D163 PolarHBondContact O-N 2.93Å; E161-Q164 PolarHBondContact O-N 3.3Å; E161-L165 WeakPolarHBondContact O-CB 3.39Å; E161-L165 VanDerWaalsContact O-CG 3.3Å; E161-L165 WeakPolarHBondContact O-CG 3.3Å; E161-L165 PolarHBondContact O-N 3.29Å
162R82.9Confident80.2Confident131 Ų131110.2 Ų110.249%0.49453%0.53SS..Hα-helixtrans-54.4-48.3174.3-178.9-154.673-177.2-1.4111V158 T159 R160 L165 L166V158-R162 WeakPolarHBondContact O-CB 3.14Å; V158-R162 PolarHBondContact O-N 3.36Å; T159-R162 WeakPolarHBondContact O-CB 3.49Å; T159-R162 PolarHBondContact O-N 2.91Å; R160-R162 VanDerWaalsContact C-N 3.34Å; R162-L165 PolarHBondContact O-N 2.9Å; R162-L166 HydrophobicContact CG-CD1 4.2Å; R162-L166 WeakPolarHBondContact O-CB 3.49Å; R162-L166 PolarHBondContact O-N 3.39Å
163D86.2Confident81.3Confident81 Ų81113.9 Ų113.943%0.43354%0.537SS..Hα-helixtrans-67.5-39.2-176.3-71-12.7000112.2T159 R160 E161 L166 T167T159-D163 PolarHBondContact O-N 3.37Å; R160-D163 PolarHBondContact O-N 3.4Å; E161-D163 VanDerWaalsContact C-N 3.3Å; E161-D163 PolarHBondContact O-N 2.93Å; D163-L166 WeakPolarHBondContact O-CB 3.45Å; D163-L166 PolarHBondContact O-N 3.38Å; D163-T167 PolarHBondContact O-N 2.86Å; D163-T167 VanDerWaalsContact O-N 3.11Å; D163-T167 PolarHBondContact O-OG1 2.93Å
164Q84.3Confident82.2Confident112 Ų112111.7 Ų111.752%0.52353%0.529SS..Hα-helixtrans-63.6-47.6173.8-72.3-180-6.500112R160 E161 L166 T167 E168R160-Q164 PolarHBondContact O-N 3.49Å; R160-Q164 VanDerWaalsContact O-N 3.14Å; E161-Q164 PolarHBondContact O-N 3.3Å; Q164-L166 VanDerWaalsContact C-N 3.27Å; Q164-L166 PolarHBondContact O-N 2.99Å; Q164-T167 WeakPolarHBondContact CA-OG1 3.36Å; Q164-T167 PolarHBondContact O-N 3.27Å; Q164-T167 PolarHBondContact O-OG1 3.47Å; Q164-E168 PolarHBondContact O-N 2.9Å
165L81.8Confident83.2Confident99 Ų99109.4 Ų109.452%0.51852%0.523SS..Hα-helixtrans-62-35.8175.7-71.7170.2000111.6E161 R162 E168 V169E161-L165 WeakPolarHBondContact O-CB 3.39Å; E161-L165 VanDerWaalsContact O-CG 3.3Å; E161-L165 WeakPolarHBondContact O-CG 3.3Å; E161-L165 PolarHBondContact O-N 3.29Å; R162-L165 PolarHBondContact O-N 2.9Å; L165-E168 PolarHBondContact O-N 3.44Å; L165-V169 WeakPolarHBondContact O-CB 3.35Å; L165-V169 WeakPolarHBondContact O-CG2 3.49Å; L165-V169 PolarHBondContact O-N 3.04Å
166L86.2Confident83.6Confident94 Ų94108.3 Ų108.349%0.49252%0.523SS..Hα-helixtrans-61.6-45.1175.1-121.2144.6000111.2R162 D163 Q164 V169 V170R162-L166 HydrophobicContact CG-CD1 4.2Å; R162-L166 WeakPolarHBondContact O-CB 3.49Å; R162-L166 PolarHBondContact O-N 3.39Å; D163-L166 WeakPolarHBondContact O-CB 3.45Å; D163-L166 PolarHBondContact O-N 3.38Å; Q164-L166 VanDerWaalsContact C-N 3.27Å; Q164-L166 PolarHBondContact O-N 2.99Å; L166-V169 PolarHBondContact O-N 3.45Å; L166-V170 VanDerWaalsContact O-CG2 3.31Å; L166-V170 WeakPolarHBondContact O-CG2 3.27Å; L166-V170 PolarHBondContact O-N 3.39Å
167T86.6Confident84.3Confident86 Ų86104 Ų10453%0.52851%0.513SS..Hα-helixtrans-63.6-38.2174.325.40000113.5D163 Q164 K171D163-T167 PolarHBondContact O-N 2.86Å; D163-T167 VanDerWaalsContact O-N 3.11Å; D163-T167 PolarHBondContact O-OG1 2.93Å; Q164-T167 WeakPolarHBondContact CA-OG1 3.36Å; Q164-T167 PolarHBondContact O-N 3.27Å; Q164-T167 PolarHBondContact O-OG1 3.47Å; T167-K171 PolarHBondContact O-N 2.93Å
168E86.5Confident85Confident121 Ų121103.5 Ų103.557%0.56551%0.511SS*.Hα-helixtrans-67.1-42.5174.3-84.4-169.8157.500112.3Q164 L165 V170 K171 L172Q164-E168 PolarHBondContact O-N 2.9Å; L165-E168 PolarHBondContact O-N 3.44Å; E168-V170 VanDerWaalsContact C-N 3.29Å; E168-V170 PolarHBondContact O-N 2.75Å; E168-K171 PolarHBondContact O-N 3.24Å; E168-L172 WeakPolarHBondContact O-CB 3.37Å; E168-L172 WeakPolarHBondContact O-CG 3.24Å; E168-L172 PolarHBondContact O-N 3.46Å
169V84.2Confident85.7Confident66 Ų66105.8 Ų105.840%0.452%0.52SS..Hα-helixtrans-61.2-39.5176.9168.30000111L165 L166 L172 R173L165-V169 WeakPolarHBondContact O-CB 3.35Å; L165-V169 WeakPolarHBondContact O-CG2 3.49Å; L165-V169 PolarHBondContact O-N 3.04Å; L166-V169 PolarHBondContact O-N 3.45Å; V169-L172 PolarHBondContact O-N 3.24Å; V169-R173 HydrophobicContact CG1-CG 4.45Å; V169-R173 WeakPolarHBondContact O-CB 3.48Å; V169-R173 VanDerWaalsContact O-CG 3.27Å; V169-R173 WeakPolarHBondContact O-CG 3.49Å; V169-R173 PolarHBondContact O-N 3.46Å
170V88.5Confident86.1Confident72 Ų72105.9 Ų105.944%0.43652%0.52SS..Hα-helixtrans-62.2-48.5175.1171.80000110.8L166 E168 L172 R173 E174L166-V170 VanDerWaalsContact O-CG2 3.31Å; L166-V170 WeakPolarHBondContact O-CG2 3.27Å; L166-V170 PolarHBondContact O-N 3.39Å; E168-V170 VanDerWaalsContact C-N 3.29Å; E168-V170 PolarHBondContact O-N 2.75Å; V170-L172 PolarHBondContact O-N 3.02Å; V170-R173 PolarHBondContact O-N 3.38Å; V170-E174 PolarHBondContact O-N 3.49Å
171K87.6Confident86.5Confident139 Ų139104.8 Ų104.860%0.60452%0.522SS*.Hα-helixtrans-62.2-41.6177.1-74.1-179.9177.8177.30112.9T167 E168 R173 E174 N175T167-K171 PolarHBondContact O-N 2.93Å; E168-K171 PolarHBondContact O-N 3.24Å; K171-R173 VanDerWaalsContact C-N 3.34Å; K171-E174 PolarHBondContact O-N 3.26Å; K171-N175 PolarHBondContact O-N 2.91Å; K171-N175 PolarHBondContact O-ND2 2.8Å
172L85.8Confident87Confident108 Ų108106.7 Ų106.757%0.56553%0.529SS*.Hα-helixtrans-64.8-39.8177.2-74.8172.3000111.3E168 V169 V170 N175 L176E168-L172 WeakPolarHBondContact O-CB 3.37Å; E168-L172 WeakPolarHBondContact O-CG 3.24Å; E168-L172 PolarHBondContact O-N 3.46Å; V169-L172 PolarHBondContact O-N 3.24Å; V170-L172 PolarHBondContact O-N 3.02Å; L172-N175 PolarHBondContact O-N 2.87Å; L172-L176 VanDerWaalsContact O-CB 3.25Å; L172-L176 WeakPolarHBondContact O-CB 3.31Å; L172-L176 PolarHBondContact O-N 3.28Å
173R86.9Confident87.3Confident185 Ų185105.6 Ų105.670%0.69853%0.529SS*.Hα-helixtrans-64.1-41.7175.1-77.6179.6176.3-162.7-0.3112.4V169 V170 K171 L176 A177V169-R173 HydrophobicContact CG1-CG 4.45Å; V169-R173 WeakPolarHBondContact O-CB 3.48Å; V169-R173 VanDerWaalsContact O-CG 3.27Å; V169-R173 WeakPolarHBondContact O-CG 3.49Å; V169-R173 PolarHBondContact O-N 3.46Å; V170-R173 PolarHBondContact O-N 3.38Å; K171-R173 VanDerWaalsContact C-N 3.34Å; R173-L176 PolarHBondContact O-N 2.98Å; R173-A177 WeakPolarHBondContact O-CB 3.5Å; R173-A177 PolarHBondContact O-N 3.37Å
174E88.1Confident87.5Confident118 Ų118106 Ų10655%0.55153%0.528SS*.Hα-helixtrans-62.2-45.7174.6-74.7179.3166.200111.8V170 K171 L176 A177 Q178V170-E174 PolarHBondContact O-N 3.49Å; K171-E174 PolarHBondContact O-N 3.26Å; E174-L176 PolarHBondContact O-N 2.95Å; E174-A177 PolarHBondContact O-N 3.49Å; E174-Q178 WeakPolarHBondContact O-CG 3.4Å; E174-Q178 PolarHBondContact O-N 2.89Å
175N88.7Confident87.7Confident85 Ų85103.4 Ų103.446%0.45553%0.526SS..Hα-helixtrans-62.9-41.8176.6-73.7-22.3000112.3K171 L172 A177 Q178 I179K171-N175 PolarHBondContact O-N 2.91Å; K171-N175 PolarHBondContact O-ND2 2.8Å; L172-N175 PolarHBondContact O-N 2.87Å; N175-A177 VanDerWaalsContact C-N 3.35Å; N175-Q178 PolarHBondContact O-N 2.95Å; N175-I179 WeakPolarHBondContact O-CG1 3.43Å; N175-I179 PolarHBondContact O-N 3.35Å
176L85.9Confident88Confident117 Ų117101.6 Ų101.661%0.61353%0.525SS*.Hα-helixtrans-66.3-39.5179.4-150.9154.7000110.5L172 R173 E174 I179 T180L172-L176 VanDerWaalsContact O-CB 3.25Å; L172-L176 WeakPolarHBondContact O-CB 3.31Å; L172-L176 PolarHBondContact O-N 3.28Å; R173-L176 PolarHBondContact O-N 2.98Å; E174-L176 PolarHBondContact O-N 2.95Å; L176-I179 PolarHBondContact O-N 2.84Å; L176-T180 WeakPolarHBondContact O-CB 3.46Å; L176-T180 PolarHBondContact O-N 3.39Å; L176-T180 PolarHBondContact O-OG1 2.66Å
177A90.1Very high88.2Confident60 Ų60101.5 Ų101.550%0.49652%0.522SS..Hα-helixtrans-61.3-46.7173.300000111.9R173 E174 N175 I179 T180 E181R173-A177 WeakPolarHBondContact O-CB 3.5Å; R173-A177 PolarHBondContact O-N 3.37Å; E174-A177 PolarHBondContact O-N 3.49Å; N175-A177 VanDerWaalsContact C-N 3.35Å; A177-I179 PolarHBondContact O-N 3.3Å; A177-T180 PolarHBondContact O-N 2.97Å; A177-E181 PolarHBondContact O-N 3.24Å
178Q89.4Confident88.4Confident111 Ų111104.5 Ų104.552%0.51952%0.524SS..Hα-helixtrans-63.4-40.7177.8-72.5-178.512.700113.3E174 N175 K182E174-Q178 WeakPolarHBondContact O-CG 3.4Å; E174-Q178 PolarHBondContact O-N 2.89Å; N175-Q178 PolarHBondContact O-N 2.95Å; Q178-K182 WeakPolarHBondContact O-CG 3.49Å; Q178-K182 PolarHBondContact O-N 3.2Å; Q178-K182 VanDerWaalsContact O-N 3.09Å
179I88.6Confident88.6Confident111 Ų111101.3 Ų101.357%0.56952%0.518SS*.Hα-helixtrans-67.2-41.2177.3-69.5170000110.3N175 L176 A177 E181 K182 Q183N175-I179 WeakPolarHBondContact O-CG1 3.43Å; N175-I179 PolarHBondContact O-N 3.35Å; L176-I179 PolarHBondContact O-N 2.84Å; A177-I179 PolarHBondContact O-N 3.3Å; I179-E181 VanDerWaalsContact C-N 3.33Å; I179-E181 PolarHBondContact O-N 2.91Å; I179-K182 PolarHBondContact O-N 2.92Å; I179-Q183 WeakPolarHBondContact O-CB 3.26Å; I179-Q183 PolarHBondContact O-N 3.02Å
180T89.3Confident88.9Confident52 Ų52104.3 Ų104.332%0.31953%0.526SS..Hα-helixtrans-62.9-41.3178.2-52.70000111.2L176 A177 Q183 Q184L176-T180 WeakPolarHBondContact O-CB 3.46Å; L176-T180 PolarHBondContact O-N 3.39Å; L176-T180 PolarHBondContact O-OG1 2.66Å; A177-T180 PolarHBondContact O-N 2.97Å; T180-Q183 PolarHBondContact O-N 3.24Å; T180-Q184 WeakPolarHBondContact O-CG 3.45Å; T180-Q184 PolarHBondContact O-N 2.84Å
181E90.8Very high88.9Confident139 Ų139106.9 Ų106.965%0.6553%0.533SS*.Hα-helixtrans-64.7-42.1176.2-167175.4-166.900111.9A177 I179 Q184 A185A177-E181 PolarHBondContact O-N 3.24Å; I179-E181 VanDerWaalsContact C-N 3.33Å; I179-E181 PolarHBondContact O-N 2.91Å; E181-Q184 PolarHBondContact O-N 3.13Å; E181-A185 WeakPolarHBondContact O-CB 3.48Å; E181-A185 PolarHBondContact O-N 3.33Å
182K89.4Confident89.1Confident154 Ų154107 Ų10767%0.6754%0.536SS*.Hα-helixtrans-63.6-40.2173.6-75.7179.3179.7176.10112.7Q178 I179 A185 A186Q178-K182 WeakPolarHBondContact O-CG 3.49Å; Q178-K182 PolarHBondContact O-N 3.2Å; Q178-K182 VanDerWaalsContact O-N 3.09Å; I179-K182 PolarHBondContact O-N 2.92Å; K182-A185 PolarHBondContact O-N 3.06Å; K182-A186 WeakPolarHBondContact O-CB 3.37Å; K182-A186 PolarHBondContact O-N 2.97Å
183Q87.8Confident89.3Confident108 Ų108104.2 Ų104.251%0.50553%0.528SS..Hα-helixtrans-62.5-48.6176.1-178.7-176.3-15.700110.8I179 T180 A185 A186 E187I179-Q183 WeakPolarHBondContact O-CB 3.26Å; I179-Q183 PolarHBondContact O-N 3.02Å; T180-Q183 PolarHBondContact O-N 3.24Å; Q183-A185 VanDerWaalsContact C-N 3.3Å; Q183-A185 PolarHBondContact O-N 2.82Å; Q183-A186 PolarHBondContact O-N 3.48Å; Q183-A186 VanDerWaalsContact O-N 3.16Å; Q183-E187 PolarHBondContact NE2-OE1 3.45Å; Q183-E187 WeakPolarHBondContact O-CG 3.42Å; Q183-E187 PolarHBondContact O-N 3.38Å
184Q90.3Very high89.4Confident90 Ų90100.4 Ų100.442%0.42152%0.518SS..Hα-helixtrans-62-37.2178-73.2-179.73.900112.5T180 E181 R188T180-Q184 WeakPolarHBondContact O-CG 3.45Å; T180-Q184 PolarHBondContact O-N 2.84Å; E181-Q184 PolarHBondContact O-N 3.13Å; Q184-R188 WeakPolarHBondContact O-CG 3.31Å; Q184-R188 PolarHBondContact O-N 3.47Å
185A90.1Very high89.4Confident56 Ų56100.9 Ų100.946%0.46352%0.521SS..Hα-helixtrans-65.4-41.1174.900000112E181 K182 Q183 A189E181-A185 WeakPolarHBondContact O-CB 3.48Å; E181-A185 PolarHBondContact O-N 3.33Å; K182-A185 PolarHBondContact O-N 3.06Å; Q183-A185 VanDerWaalsContact C-N 3.3Å; Q183-A185 PolarHBondContact O-N 2.82Å; A185-A189 PolarHBondContact O-N 3.1Å
186A88.2Confident89.5Confident62 Ų6298.5 Ų98.551%0.51251%0.513SS..Hα-helixtrans-67.9-38.5176.400000112.5K182 Q183 A189 K190K182-A186 WeakPolarHBondContact O-CB 3.37Å; K182-A186 PolarHBondContact O-N 2.97Å; Q183-A186 PolarHBondContact O-N 3.48Å; Q183-A186 VanDerWaalsContact O-N 3.16Å; A186-A189 PolarHBondContact O-N 2.9Å; A186-K190 WeakPolarHBondContact O-CB 3.45Å; A186-K190 PolarHBondContact O-N 3.34Å
187E88.7Confident89.6Confident91 Ų9197.5 Ų97.543%0.42551%0.507SS..Hα-helixtrans-62.6-45174.6-76.9171.3-177.500111.3Q183 K190 E191Q183-E187 PolarHBondContact NE2-OE1 3.45Å; Q183-E187 WeakPolarHBondContact O-CG 3.42Å; Q183-E187 PolarHBondContact O-N 3.38Å; E187-K190 WeakPolarHBondContact O-CB 3.45Å; E187-K190 PolarHBondContact O-N 3.14Å; E187-E191 WeakPolarHBondContact O-CG 3.5Å; E187-E191 PolarHBondContact O-N 3.19Å
188R91.4Very high89.6Confident149 Ų14997.2 Ų97.256%0.56250%0.501SS*.Hα-helixtrans-61.3-45.7174.5-72.4-177.1-135.4161.34.8112.6Q184 K190 E191 E192Q184-R188 WeakPolarHBondContact O-CG 3.31Å; Q184-R188 PolarHBondContact O-N 3.47Å; R188-K190 VanDerWaalsContact C-N 3.26Å; R188-K190 PolarHBondContact O-N 3.24Å; R188-E191 PolarHBondContact O-N 3.03Å; R188-E192 WeakPolarHBondContact O-CG 3.48Å; R188-E192 PolarHBondContact O-N 2.94Å
189A90.2Very high89.6Confident55 Ų5597.2 Ų97.246%0.45550%0.501SS..Hα-helixtrans-62.9-35178.200000112.3A185 A186 A193A185-A189 PolarHBondContact O-N 3.1Å; A186-A189 PolarHBondContact O-N 2.9Å; A189-A193 WeakPolarHBondContact O-CB 3.5Å; A189-A193 PolarHBondContact O-N 2.88Å; A189-A193 VanDerWaalsContact O-N 3.07Å
190K91.2Very high89.6Confident128 Ų12898 Ų9856%0.55750%0.501SS*.Hα-helixtrans-66-47.5173.6-178-165.9162.6-163.30111.3A186 E187 R188 E192 A193 E194A186-K190 WeakPolarHBondContact O-CB 3.45Å; A186-K190 PolarHBondContact O-N 3.34Å; E187-K190 WeakPolarHBondContact O-CB 3.45Å; E187-K190 PolarHBondContact O-N 3.14Å; R188-K190 VanDerWaalsContact C-N 3.26Å; R188-K190 PolarHBondContact O-N 3.24Å; K190-E192 VanDerWaalsContact C-N 3.33Å; K190-E192 PolarHBondContact O-N 3.03Å; K190-A193 PolarHBondContact O-N 3.45Å; K190-E194 WeakPolarHBondContact CE-OE1 3.46Å; K190-E194 IonicContact NZ-OE1 2.85Å; K190-E194 WeakPolarHBondContact O-CG 3.37Å; K190-E194 PolarHBondContact O-N 3.49Å
191E89.7Confident89.6Confident127 Ų127101.5 Ų101.559%0.59351%0.513SS*.Hα-helixtrans-60.3-42.2177.9-73.5177.6173.900111.8E187 R188 E194 H195E187-E191 WeakPolarHBondContact O-CG 3.5Å; E187-E191 PolarHBondContact O-N 3.19Å; R188-E191 PolarHBondContact O-N 3.03Å; E191-E194 PolarHBondContact O-N 2.83Å; E191-H195 WeakPolarHBondContact O-CB 3.37Å; E191-H195 PolarHBondContact O-N 2.83Å
192E91Very high89.5Confident141 Ų141100.9 Ų100.966%0.65951%0.511SS*.Hα-helixtrans-61.3-43.3174.7-73.6174.8-177.700112R188 K190 H195 A196R188-E192 WeakPolarHBondContact O-CG 3.48Å; R188-E192 PolarHBondContact O-N 2.94Å; K190-E192 VanDerWaalsContact C-N 3.33Å; K190-E192 PolarHBondContact O-N 3.03Å; E192-H195 PolarHBondContact O-N 3.44Å; E192-A196 PolarHBondContact O-N 2.89Å
193A88.8Confident89.4Confident49 Ų4999.2 Ų99.241%0.40551%0.505SS..Hα-helixtrans-66.2-41176.700000112.4A189 K190 H195 A196 I197A189-A193 WeakPolarHBondContact O-CB 3.5Å; A189-A193 PolarHBondContact O-N 2.88Å; A189-A193 VanDerWaalsContact O-N 3.07Å; K190-A193 PolarHBondContact O-N 3.45Å; A193-H195 VanDerWaalsContact C-N 3.33Å; A193-H195 PolarHBondContact O-N 3.24Å; A193-A196 PolarHBondContact O-N 2.89Å; A193-I197 VanDerWaalsContact O-CG1 3.28Å; A193-I197 WeakPolarHBondContact O-CG1 3.45Å; A193-I197 PolarHBondContact O-N 2.95Å
194E90.2Very high89.3Confident105 Ų10598.7 Ų98.749%0.49151%0.505SS..Hα-helixtrans-63.1-39.5175-75.6-179.6170.600111.5K190 E191 I197 S198K190-E194 WeakPolarHBondContact CE-OE1 3.46Å; K190-E194 IonicContact NZ-OE1 2.85Å; K190-E194 WeakPolarHBondContact O-CG 3.37Å; K190-E194 PolarHBondContact O-N 3.49Å; E191-E194 PolarHBondContact O-N 2.83Å; E194-I197 PolarHBondContact O-N 3.32Å; E194-S198 PolarHBondContact O-N 3.36Å
195H88.9Confident89.2Confident129 Ų129100.1 Ų100.160%0.59751%0.512SS*.Hα-helixtrans-63.6-44.8174.4-127.364.5000112E191 E192 A193 S198 Q199E191-H195 WeakPolarHBondContact O-CB 3.37Å; E191-H195 PolarHBondContact O-N 2.83Å; E192-H195 PolarHBondContact O-N 3.44Å; A193-H195 VanDerWaalsContact C-N 3.33Å; A193-H195 PolarHBondContact O-N 3.24Å; H195-S198 PolarHBondContact O-N 2.99Å; H195-Q199 WeakPolarHBondContact O-CG 3.36Å; H195-Q199 PolarHBondContact O-N 3.04Å
196A90Very high89.2Confident35 Ų35102.9 Ų102.929%0.28951%0.514SS..Hα-helixtrans-63.1-41.617700000112.2E192 A193 S198 Q199 F200E192-A196 PolarHBondContact O-N 2.89Å; A193-A196 PolarHBondContact O-N 2.89Å; A196-S198 VanDerWaalsContact C-N 3.34Å; A196-S198 PolarHBondContact O-N 3.46Å; A196-Q199 PolarHBondContact O-N 3.42Å; A196-F200 HydrophobicContact CB-CE2 4.41Å; A196-F200 WeakPolarHBondContact O-CD2 3.44Å; A196-F200 WeakPolarHBondContact O-CG 3.48Å; A196-F200 PolarHBondContact O-N 3.36Å
197I88.3Confident89.1Confident96 Ų96108.1 Ų108.149%0.49252%0.521SS..Hα-helixtrans-61.6-43.3175.6-70.5166.4000110.7A193 E194 Q199 F200 Q201A193-I197 VanDerWaalsContact O-CG1 3.28Å; A193-I197 WeakPolarHBondContact O-CG1 3.45Å; A193-I197 PolarHBondContact O-N 2.95Å; E194-I197 PolarHBondContact O-N 3.32Å; I197-Q199 PolarHBondContact O-N 3.35Å; I197-F200 PolarHBondContact O-N 3.44Å; I197-Q201 HydrophobicContact CG2-CG 4.47Å; I197-Q201 WeakPolarHBondContact O-CB 3.32Å; I197-Q201 WeakPolarHBondContact O-CG 3.48Å; I197-Q201 PolarHBondContact O-N 2.92Å
198S90.1Very high89Confident53 Ų53109.9 Ų109.937%0.37153%0.529SS..Hα-helixtrans-62.2-42.4177.3-1680000112E194 H195 A196 Q201 Q202E194-S198 PolarHBondContact O-N 3.36Å; H195-S198 PolarHBondContact O-N 2.99Å; A196-S198 VanDerWaalsContact C-N 3.34Å; A196-S198 PolarHBondContact O-N 3.46Å; S198-Q201 PolarHBondContact O-N 2.91Å; S198-Q202 WeakPolarHBondContact O-CG 3.45Å; S198-Q202 PolarHBondContact O-N 3.27Å; S198-Q202 VanDerWaalsContact O-N 3.12Å
199Q89.3Confident88.9Confident112 Ų112106.7 Ų106.752%0.52352%0.523SS..Hα-helixtrans-62.1-47.9175.4-72.1178.11.400111.8H195 A196 I197 Q201 Q202 E203H195-Q199 WeakPolarHBondContact O-CG 3.36Å; H195-Q199 PolarHBondContact O-N 3.04Å; A196-Q199 PolarHBondContact O-N 3.42Å; I197-Q199 PolarHBondContact O-N 3.35Å; Q199-Q201 VanDerWaalsContact C-N 3.33Å; Q199-Q201 PolarHBondContact O-N 2.88Å; Q199-Q202 PolarHBondContact O-N 2.9Å; Q199-E203 PolarHBondContact O-N 3.13Å
200F88.9Confident88.6Confident128 Ų128107.9 Ų107.956%0.56152%0.52SS*.Hα-helixtrans-64.2-35.3178-70.8-48.1000113A196 I197 E203 I204A196-F200 HydrophobicContact CB-CE2 4.41Å; A196-F200 WeakPolarHBondContact O-CD2 3.44Å; A196-F200 WeakPolarHBondContact O-CG 3.48Å; A196-F200 PolarHBondContact O-N 3.36Å; I197-F200 PolarHBondContact O-N 3.44Å; F200-E203 PolarHBondContact O-N 3.46Å; F200-I204 WeakPolarHBondContact O-CB 3.43Å; F200-I204 VanDerWaalsContact O-CG1 3.24Å; F200-I204 WeakPolarHBondContact O-CG1 3.48Å; F200-I204 PolarHBondContact O-N 3.43Å
201Q87.7Confident88.3Confident124 Ų124104.9 Ų104.958%0.57952%0.518SS*.Hα-helixtrans-62.8-41.7173.7-77.4178-4.800112I197 S198 Q199 I204 Q205I197-Q201 HydrophobicContact CG2-CG 4.47Å; I197-Q201 WeakPolarHBondContact O-CB 3.32Å; I197-Q201 WeakPolarHBondContact O-CG 3.48Å; I197-Q201 PolarHBondContact O-N 2.92Å; S198-Q201 PolarHBondContact O-N 2.91Å; Q199-Q201 VanDerWaalsContact C-N 3.33Å; Q199-Q201 PolarHBondContact O-N 2.88Å; Q201-I204 PolarHBondContact O-N 2.86Å; Q201-Q205 WeakPolarHBondContact O-CB 3.42Å; Q201-Q205 PolarHBondContact O-N 3.35Å
202Q88.5Confident88.1Confident127 Ų127101.1 Ų101.159%0.59351%0.506SS*.Hα-helixtrans-65.5-41.6175.7-68.917823.600111.8S198 Q199 Q205 H206S198-Q202 WeakPolarHBondContact O-CG 3.45Å; S198-Q202 PolarHBondContact O-N 3.27Å; S198-Q202 VanDerWaalsContact O-N 3.12Å; Q199-Q202 PolarHBondContact O-N 2.9Å; Q202-Q205 PolarHBondContact O-N 3.45Å; Q202-H206 WeakPolarHBondContact O-CB 3.46Å; Q202-H206 PolarHBondContact O-N 2.69Å
203E87.5Confident87.9Confident118 Ų118102.8 Ų102.855%0.55151%0.507SS*.Hα-helixtrans-63.5-44175.7-73.9-172.9169.700112.5Q199 F200 Q205 H206 R207Q199-E203 PolarHBondContact O-N 3.13Å; F200-E203 PolarHBondContact O-N 3.46Å; E203-Q205 VanDerWaalsContact C-N 3.33Å; E203-Q205 PolarHBondContact O-N 2.92Å; E203-H206 WeakPolarHBondContact O-CB 3.45Å; E203-H206 PolarHBondContact O-N 3.44Å; E203-R207 WeakPolarHBondContact O-CB 3.46Å; E203-R207 VanDerWaalsContact O-CG 3.32Å; E203-R207 WeakPolarHBondContact O-CG 3.37Å; E203-R207 PolarHBondContact O-N 3.27Å
204I86.9Confident87.6Confident98 Ų98105.6 Ų105.650%0.50351%0.511SS..Hα-helixtrans-60.3-45176.2-71.3166.6000110.3F200 Q201 H206 R207 Q208F200-I204 WeakPolarHBondContact O-CB 3.43Å; F200-I204 VanDerWaalsContact O-CG1 3.24Å; F200-I204 WeakPolarHBondContact O-CG1 3.48Å; F200-I204 PolarHBondContact O-N 3.43Å; Q201-I204 PolarHBondContact O-N 2.86Å; I204-H206 VanDerWaalsContact C-N 3.33Å; I204-H206 PolarHBondContact O-N 3.41Å; I204-R207 PolarHBondContact O-N 3.15Å; I204-Q208 HydrophobicContact CG2-CG 4.46Å; I204-Q208 WeakPolarHBondContact O-CB 3.49Å; I204-Q208 WeakPolarHBondContact O-CG 3.28Å; I204-Q208 PolarHBondContact O-N 2.89Å
205Q88.5Confident87.4Confident120 Ų120103.7 Ų103.756%0.56151%0.51SS*.Hα-helixtrans-64.2-39.3178.3-165.9177.220.600111.6Q201 Q202 E203 N209Q201-Q205 WeakPolarHBondContact O-CB 3.42Å; Q201-Q205 PolarHBondContact O-N 3.35Å; Q202-Q205 PolarHBondContact O-N 3.45Å; E203-Q205 VanDerWaalsContact C-N 3.33Å; E203-Q205 PolarHBondContact O-N 2.92Å; Q205-N209 WeakPolarHBondContact O-CB 3.43Å; Q205-N209 VanDerWaalsContact O-CG 3.3Å; Q205-N209 PolarHBondContact O-N 3.29Å; Q205-N209 VanDerWaalsContact O-N 3.1Å; Q205-N209 PolarHBondContact O-ND2 3.08Å; Q205-N209 VanDerWaalsContact O-ND2 3.14Å
206H88.5Confident87.2Confident113 Ų113106 Ų10652%0.52351%0.513SS..Hα-helixtrans-61.8-49.1174.2-172.571.4000111.6Q202 E203 I204 Q208 N209 E210Q202-H206 WeakPolarHBondContact O-CB 3.46Å; Q202-H206 PolarHBondContact O-N 2.69Å; E203-H206 WeakPolarHBondContact O-CB 3.45Å; E203-H206 PolarHBondContact O-N 3.44Å; I204-H206 VanDerWaalsContact C-N 3.33Å; I204-H206 PolarHBondContact O-N 3.41Å; H206-Q208 PolarHBondContact O-N 2.83Å; H206-N209 WeakPolarHBondContact O-CB 3.32Å; H206-N209 PolarHBondContact O-N 3.13Å; H206-E210 IonicContact NE2-OE1 3.57Å; H206-E210 PolarHBondContact O-N 2.95Å
207R86.7Confident87Confident172 Ų172109.9 Ų109.965%0.64952%0.523SS*.Hα-helixtrans-63.1-38.9178.5-70.3-63.3-165.4171.65.6113.2E203 I204 N209 E210 A211E203-R207 WeakPolarHBondContact O-CB 3.46Å; E203-R207 VanDerWaalsContact O-CG 3.32Å; E203-R207 WeakPolarHBondContact O-CG 3.37Å; E203-R207 PolarHBondContact O-N 3.27Å; I204-R207 PolarHBondContact O-N 3.15Å; R207-N209 VanDerWaalsContact C-N 3.35Å; R207-E210 IonicContact NH1-OE2 3.96Å; R207-E210 PolarHBondContact NH1-OE2 3.21Å; R207-E210 PolarHBondContact O-N 2.88Å; R207-A211 WeakPolarHBondContact O-CB 3.5Å; R207-A211 PolarHBondContact O-N 3.19Å
208Q86.7Confident86.9Confident128 Ų128111.4 Ų111.460%0.59853%0.526SS*.Hα-helixtrans-63.1-41.8174.2-77.8180-9.400111.8I204 H206 A211 S212I204-Q208 HydrophobicContact CG2-CG 4.46Å; I204-Q208 WeakPolarHBondContact O-CB 3.49Å; I204-Q208 WeakPolarHBondContact O-CG 3.28Å; I204-Q208 PolarHBondContact O-N 2.89Å; H206-Q208 PolarHBondContact O-N 2.83Å; Q208-A211 PolarHBondContact O-N 3.41Å; Q208-S212 WeakPolarHBondContact O-CB 3.36Å; Q208-S212 PolarHBondContact O-N 3.44Å
209N88.9Confident86.6Confident82 Ų82114 Ų11444%0.43953%0.533SS..Hα-helixtrans-64.5-42.2176.1-74.5-32.8000111.8Q205 H206 R207 S212 R213Q205-N209 WeakPolarHBondContact O-CB 3.43Å; Q205-N209 VanDerWaalsContact O-CG 3.3Å; Q205-N209 PolarHBondContact O-N 3.29Å; Q205-N209 VanDerWaalsContact O-N 3.1Å; Q205-N209 PolarHBondContact O-ND2 3.08Å; Q205-N209 VanDerWaalsContact O-ND2 3.14Å; H206-N209 WeakPolarHBondContact O-CB 3.32Å; H206-N209 PolarHBondContact O-N 3.13Å; R207-N209 VanDerWaalsContact C-N 3.35Å; N209-S212 PolarHBondContact O-N 2.88Å; N209-S212 PolarHBondContact O-OG 3.43Å; N209-R213 WeakPolarHBondContact O-CG 3.45Å; N209-R213 PolarHBondContact O-N 2.9Å; N209-R213 VanDerWaalsContact O-N 3.09Å
210E84.8Confident86.5Confident81 Ų81115.6 Ų115.638%0.37954%0.538SS..Hα-helixtrans-60-48.9173.7-71.2-169.5138.200112.2H206 R207 S212 R213 E214H206-E210 IonicContact NE2-OE1 3.57Å; H206-E210 PolarHBondContact O-N 2.95Å; R207-E210 IonicContact NH1-OE2 3.96Å; R207-E210 PolarHBondContact NH1-OE2 3.21Å; R207-E210 PolarHBondContact O-N 2.88Å; E210-S212 VanDerWaalsContact C-N 3.32Å; E210-S212 PolarHBondContact O-N 3.04Å; E210-R213 PolarHBondContact O-N 2.95Å; E210-R213 VanDerWaalsContact O-N 3.13Å; E210-E214 PolarHBondContact O-N 2.83Å
211A84.3Confident86.2Confident64 Ų64114.8 Ų114.853%0.52954%0.539SS..Hα-helixtrans-60.5-40178.500000112.2R207 Q208 R213 E214 S215R207-A211 WeakPolarHBondContact O-CB 3.5Å; R207-A211 PolarHBondContact O-N 3.19Å; Q208-A211 PolarHBondContact O-N 3.41Å; A211-R213 VanDerWaalsContact C-N 3.34Å; A211-R213 PolarHBondContact O-N 3.42Å; A211-E214 PolarHBondContact O-N 3.42Å; A211-S215 WeakPolarHBondContact O-CB 3.43Å; A211-S215 PolarHBondContact O-N 3.23Å
212S86.4Confident86.1Confident49 Ų49113.7 Ų113.734%0.34353%0.534SS..Hα-helixtrans-65-36.9176.182.60000112.6Q208 N209 E210 R216Q208-S212 WeakPolarHBondContact O-CB 3.36Å; Q208-S212 PolarHBondContact O-N 3.44Å; N209-S212 PolarHBondContact O-N 2.88Å; N209-S212 PolarHBondContact O-OG 3.43Å; E210-S212 VanDerWaalsContact C-N 3.32Å; E210-S212 PolarHBondContact O-N 3.04Å; S212-R216 WeakPolarHBondContact O-CG 3.31Å; S212-R216 PolarHBondContact O-N 3.04Å; S212-R216 VanDerWaalsContact O-N 3.12Å
213R85.5Confident85.9Confident175 Ų175114.8 Ų114.866%0.6654%0.537SS*.Hα-helixtrans-69.8-43.8178-74.5174.7-178.1-172.91.4111.1N209 E210 A211 R216 K217N209-R213 WeakPolarHBondContact O-CG 3.45Å; N209-R213 PolarHBondContact O-N 2.9Å; N209-R213 VanDerWaalsContact O-N 3.09Å; E210-R213 PolarHBondContact O-N 2.95Å; E210-R213 VanDerWaalsContact O-N 3.13Å; A211-R213 VanDerWaalsContact C-N 3.34Å; A211-R213 PolarHBondContact O-N 3.42Å; R213-R216 PolarHBondContact O-N 3.44Å; R213-K217 PolarHBondContact O-N 3.44Å
214E83.1Confident85.8Confident108 Ų108114.4 Ų114.451%0.50554%0.535SS..Hα-helixtrans-66.8-39.1176.3-79.8-54.7139.800112.4E210 A211 R216 K217 K218E210-E214 PolarHBondContact O-N 2.83Å; A211-E214 PolarHBondContact O-N 3.42Å; E214-R216 PolarHBondContact O-N 3.09Å; E214-K217 PolarHBondContact O-N 2.89Å; E214-K217 WeakPolarHBondContact OE1-CD 3.46Å; E214-K217 IonicContact OE1-NZ 3.56Å; E214-K217 PolarHBondContact OE1-NZ 3.41Å; E214-K218 WeakPolarHBondContact O-CB 3.49Å; E214-K218 PolarHBondContact O-N 3.45Å
215S85.1Confident85.7Confident65 Ų65115 Ų11546%0.45554%0.538SS..Hα-helixtrans-58.9-45.6173.4-175.20000112.2A211 K217 K218 E219A211-S215 WeakPolarHBondContact O-CB 3.43Å; A211-S215 PolarHBondContact O-N 3.23Å; S215-K217 PolarHBondContact O-N 2.96Å; S215-K218 WeakPolarHBondContact O-CB 3.34Å; S215-K218 PolarHBondContact O-N 3.02Å; S215-E219 PolarHBondContact O-N 2.93Å
216R85.6Confident85.5Confident178 Ų178116.3 Ų116.367%0.67254%0.542SS*.Hα-helixtrans-65.1-35.9176.2-72.6176-178.1-178.42.7113.3S212 R213 E214 K220S212-R216 WeakPolarHBondContact O-CG 3.31Å; S212-R216 PolarHBondContact O-N 3.04Å; S212-R216 VanDerWaalsContact O-N 3.12Å; R213-R216 PolarHBondContact O-N 3.44Å; E214-R216 PolarHBondContact O-N 3.09Å; R216-K220 PolarHBondContact O-N 3.48Å
217K85.6Confident85.4Confident116 Ų116115.9 Ų115.950%0.50454%0.54SS..Hα-helixtrans-65.7-44.3173.7-78.6178.8-175.5171.10111.2R213 E214 S215 K220 L221R213-K217 PolarHBondContact O-N 3.44Å; E214-K217 PolarHBondContact O-N 2.89Å; E214-K217 WeakPolarHBondContact OE1-CD 3.46Å; E214-K217 IonicContact OE1-NZ 3.56Å; E214-K217 PolarHBondContact OE1-NZ 3.41Å; S215-K217 PolarHBondContact O-N 2.96Å; K217-K220 PolarHBondContact O-N 3.12Å; K217-L221 WeakPolarHBondContact O-CG 3.34Å; K217-L221 PolarHBondContact O-N 3.48Å
218K86.6Confident85.3Confident128 Ų128113 Ų11356%0.55754%0.537SS*.Hα-helixtrans-58.2-48.9177-176.9-174.3168.5-172.70111.5E214 S215 K220 L221 E222E214-K218 WeakPolarHBondContact O-CB 3.49Å; E214-K218 PolarHBondContact O-N 3.45Å; S215-K218 WeakPolarHBondContact O-CB 3.34Å; S215-K218 PolarHBondContact O-N 3.02Å; K218-K220 VanDerWaalsContact C-N 3.3Å; K218-K220 PolarHBondContact O-N 3.37Å; K218-L221 PolarHBondContact O-N 2.91Å; K218-E222 WeakPolarHBondContact CE-OE1 3.46Å; K218-E222 IonicContact NZ-OE1 3.59Å; K218-E222 WeakPolarHBondContact O-CG 3.48Å; K218-E222 PolarHBondContact O-N 3.26Å
219E84.4Confident85.1Confident109 Ų109112 Ų11251%0.50953%0.532SS..Hα-helixtrans-61.1-36.6177.8-76.9-173.8168.400113.2S215 K223S215-E219 PolarHBondContact O-N 2.93Å; E219-K223 WeakPolarHBondContact O-CG 3.36Å; E219-K223 PolarHBondContact O-N 3.13Å
220K85.3Confident84.9Confident145 Ų145113.4 Ų113.463%0.6354%0.539SS*.Hα-helixtrans-64.9-48.5174.3-80.8-174.4175-1720111.6R216 K217 K218 E222 K223 E224R216-K220 PolarHBondContact O-N 3.48Å; K217-K220 PolarHBondContact O-N 3.12Å; K218-K220 VanDerWaalsContact C-N 3.3Å; K218-K220 PolarHBondContact O-N 3.37Å; K220-E222 VanDerWaalsContact C-N 3.33Å; K220-E222 PolarHBondContact O-N 2.98Å; K220-K223 PolarHBondContact O-N 3.43Å; K220-E224 WeakPolarHBondContact O-CG 3.26Å; K220-E224 PolarHBondContact O-N 3.42Å
221L84.4Confident85Confident111 Ų111113.7 Ų113.758%0.58154%0.543SS*.Hα-helixtrans-63.8-37.2179.3-70.9171.2000112.3K217 K218 K223 E224 L225K217-L221 WeakPolarHBondContact O-CG 3.34Å; K217-L221 PolarHBondContact O-N 3.48Å; K218-L221 PolarHBondContact O-N 2.91Å; L221-K223 VanDerWaalsContact C-N 3.35Å; L221-E224 PolarHBondContact O-N 2.96Å; L221-L225 WeakPolarHBondContact O-CB 3.49Å; L221-L225 PolarHBondContact O-N 3.47Å
222E84.5Confident84.9Confident100 Ų100116.1 Ų116.147%0.46755%0.545SS..Hα-helixtrans-65.7-36.2175.2-75.8179.8172.500112.6K218 K220 K226K218-E222 WeakPolarHBondContact CE-OE1 3.46Å; K218-E222 IonicContact NZ-OE1 3.59Å; K218-E222 WeakPolarHBondContact O-CG 3.48Å; K218-E222 PolarHBondContact O-N 3.26Å; K220-E222 VanDerWaalsContact C-N 3.33Å; K220-E222 PolarHBondContact O-N 2.98Å; E222-K226 WeakPolarHBondContact O-CG 3.34Å; E222-K226 PolarHBondContact O-N 2.81Å; E222-K226 VanDerWaalsContact O-N 3.15Å
223K85.2Confident84.9Confident151 Ų151118.6 Ų118.666%0.65756%0.555SS**Hα-helixtrans-68.9-43.6173.7-74.1176.8-177.4176.70111.8E219 K220 L221 K226 Q227E219-K223 WeakPolarHBondContact O-CG 3.36Å; E219-K223 PolarHBondContact O-N 3.13Å; K220-K223 PolarHBondContact O-N 3.43Å; L221-K223 VanDerWaalsContact C-N 3.35Å; K223-K226 PolarHBondContact O-N 3.22Å; K223-Q227 PolarHBondContact O-N 3.02Å
224E85.5Confident85Confident110 Ų110111.7 Ų111.751%0.51454%0.537SS..Hα-helixtrans-62.5-42.5176.2-72.8171.5-168.500111.6K220 L221 K226 Q227 I228K220-E224 WeakPolarHBondContact O-CG 3.26Å; K220-E224 PolarHBondContact O-N 3.42Å; L221-E224 PolarHBondContact O-N 2.96Å; E224-K226 PolarHBondContact O-N 2.94Å; E224-Q227 PolarHBondContact O-N 2.96Å; E224-I228 VanDerWaalsContact O-CG1 3.31Å; E224-I228 WeakPolarHBondContact O-CG1 3.38Å; E224-I228 PolarHBondContact O-N 3.28Å
225L83.2Confident85.1Confident110 Ų110114.2 Ų114.258%0.57654%0.542SS*.Hα-helixtrans-62-43.9177-162.996.5000112L221 I228 Q229L221-L225 WeakPolarHBondContact O-CB 3.49Å; L221-L225 PolarHBondContact O-N 3.47Å; L225-I228 PolarHBondContact O-N 3.4Å; L225-Q229 WeakPolarHBondContact O-CG 3.38Å; L225-Q229 PolarHBondContact O-N 3.02Å
226K84.9Confident85Confident147 Ų147116.2 Ų116.264%0.63954%0.544SS*.Hα-helixtrans-63.3-40.4175.8-81-179.4177.1176.80112.1E222 K223 E224 Q229 L230E222-K226 WeakPolarHBondContact O-CG 3.34Å; E222-K226 PolarHBondContact O-N 2.81Å; E222-K226 VanDerWaalsContact O-N 3.15Å; K223-K226 PolarHBondContact O-N 3.22Å; E224-K226 PolarHBondContact O-N 2.94Å; K226-Q229 PolarHBondContact O-N 2.71Å; K226-L230 PolarHBondContact O-N 3.07Å; K226-L230 VanDerWaalsContact O-N 3.09Å
227Q86.3Confident84.9Confident104 Ų104111.1 Ų111.149%0.48654%0.536SS..Hα-helixtrans-65.1-44.9177.3-172.560.840.700111.4K223 E224 Q229 L230 D231K223-Q227 PolarHBondContact O-N 3.02Å; E224-Q227 PolarHBondContact O-N 2.96Å; Q227-Q229 VanDerWaalsContact C-N 3.31Å; Q227-Q229 PolarHBondContact O-N 2.97Å; Q227-L230 PolarHBondContact O-N 2.65Å; Q227-D231 PolarHBondContact NE2-OD1 2.93Å; Q227-D231 VanDerWaalsContact O-CG 3.27Å; Q227-D231 PolarHBondContact O-N 3.43Å
228I85.7Confident84.9Confident113 Ų113110.3 Ų110.358%0.57953%0.534SS*.Hα-helixtrans-63-37.7177.7-68.3167.5000111.3E224 L225 D231 M232E224-I228 VanDerWaalsContact O-CG1 3.31Å; E224-I228 WeakPolarHBondContact O-CG1 3.38Å; E224-I228 PolarHBondContact O-N 3.28Å; L225-I228 PolarHBondContact O-N 3.4Å; I228-D231 PolarHBondContact O-N 3.2Å; I228-M232 VanDerWaalsContact O-CB 3.3Å; I228-M232 WeakPolarHBondContact O-CB 3.37Å; I228-M232 PolarHBondContact O-N 3.46Å
229Q81.7Confident84.7Confident105 Ų105108.1 Ų108.149%0.49153%0.528SS..Hα-helixtrans-63-45.6174.5-80.2177.3-19.700112.1L225 K226 Q227 M232 D233L225-Q229 WeakPolarHBondContact O-CG 3.38Å; L225-Q229 PolarHBondContact O-N 3.02Å; K226-Q229 PolarHBondContact O-N 2.71Å; Q227-Q229 VanDerWaalsContact C-N 3.31Å; Q227-Q229 PolarHBondContact O-N 2.97Å; Q229-M232 PolarHBondContact O-N 3.34Å; Q229-D233 PolarHBondContact O-N 3.06Å
230L85.4Confident84.8Confident113 Ų113109.1 Ų109.159%0.59253%0.53SS*.Hα-helixtrans-62.2-42.8175.9-74.9169.8000112.1K226 Q227 M232 D233 G234K226-L230 PolarHBondContact O-N 3.07Å; K226-L230 VanDerWaalsContact O-N 3.09Å; Q227-L230 PolarHBondContact O-N 2.65Å; L230-M232 VanDerWaalsContact C-N 3.34Å; L230-D233 PolarHBondContact O-N 3.42Å; L230-G234 PolarHBondContact O-N 3.04Å
231D85.8Confident84.7Confident87 Ų87104.9 Ų104.947%0.46552%0.522SS..Hα-helixtrans-65-39.8177.8-67.7-11.7000111Q227 I228 G234 R235Q227-D231 PolarHBondContact NE2-OD1 2.93Å; Q227-D231 VanDerWaalsContact O-CG 3.27Å; Q227-D231 PolarHBondContact O-N 3.43Å; I228-D231 PolarHBondContact O-N 3.2Å; D231-G234 PolarHBondContact O-N 3.13Å; D231-R235 VanDerWaalsContact O-CG 3.29Å; D231-R235 WeakPolarHBondContact O-CG 3.31Å; D231-R235 PolarHBondContact O-N 3.01Å
232M83Confident84.7Confident114 Ų114106 Ų10656%0.56253%0.527SS*.Hα-helixtrans-64-45.6176.4-171.7-171.472.100111.8I228 Q229 L230 G234 R235 Q236I228-M232 VanDerWaalsContact O-CB 3.3Å; I228-M232 WeakPolarHBondContact O-CB 3.37Å; I228-M232 PolarHBondContact O-N 3.46Å; Q229-M232 PolarHBondContact O-N 3.34Å; L230-M232 VanDerWaalsContact C-N 3.34Å; M232-G234 VanDerWaalsContact C-N 3.32Å; M232-G234 PolarHBondContact O-N 2.88Å; M232-R235 PolarHBondContact O-N 3.29Å; M232-Q236 WeakPolarHBondContact O-CB 3.41Å; M232-Q236 PolarHBondContact O-N 3.03Å
233D86.5Confident84.7Confident102 Ų102107 Ų10755%0.54553%0.531SS..Hα-helixtrans-63.2-40.3176.5-73.9-19.6000111.3Q229 L230 Q236 S237Q229-D233 PolarHBondContact O-N 3.06Å; L230-D233 PolarHBondContact O-N 3.42Å; D233-Q236 PolarHBondContact O-N 3.35Å; D233-S237 PolarHBondContact O-N 3.26Å
234G86.7Confident84.6Confident29 Ų29106.1 Ų106.130%0.29953%0.529SS..Hα-helixtrans-58.2-51.3172.300000112.2L230 D231 M232 Q236 S237 E238L230-G234 PolarHBondContact O-N 3.04Å; D231-G234 PolarHBondContact O-N 3.13Å; M232-G234 VanDerWaalsContact C-N 3.32Å; M232-G234 PolarHBondContact O-N 2.88Å; G234-Q236 VanDerWaalsContact C-N 3.33Å; G234-Q236 PolarHBondContact O-N 2.88Å; G234-S237 WeakPolarHBondContact O-CB 3.37Å; G234-S237 PolarHBondContact O-N 3.36Å; G234-S237 VanDerWaalsContact O-N 3.13Å; G234-S237 PolarHBondContact O-OG 3.19Å; G234-E238 PolarHBondContact O-N 3.24Å
235R85.8Confident84.5Confident161 Ų161106.6 Ų106.661%0.60853%0.527SS*.Hα-helixtrans-61.8-37.6176.6-68.9-57.4-172.3173.32.4113D231 M232 S237 E238 I239D231-R235 VanDerWaalsContact O-CG 3.29Å; D231-R235 WeakPolarHBondContact O-CG 3.31Å; D231-R235 PolarHBondContact O-N 3.01Å; M232-R235 PolarHBondContact O-N 3.29Å; R235-S237 VanDerWaalsContact C-N 3.28Å; R235-S237 PolarHBondContact O-N 3.46Å; R235-E238 WeakPolarHBondContact CD-OE2 3.32Å; R235-E238 IonicContact CZ-OE2 2.83Å; R235-E238 IonicContact NE-OE2 3.71Å; R235-E238 IonicContact NH1-OE2 2.71Å; R235-E238 PolarHBondContact NH1-OE2 3.09Å; R235-E238 PolarHBondContact O-N 3.08Å; R235-I239 VanDerWaalsContact O-CG1 3.3Å; R235-I239 WeakPolarHBondContact O-CG1 3.02Å; R235-I239 PolarHBondContact O-N 3.31Å
236Q83.8Confident84.4Confident107 Ų107107.9 Ų107.950%0.553%0.532SS..Hα-helixtrans-64.7-35.4176.8-16072.5500111.6M232 D233 G234 K240M232-Q236 WeakPolarHBondContact O-CB 3.41Å; M232-Q236 PolarHBondContact O-N 3.03Å; D233-Q236 PolarHBondContact O-N 3.35Å; G234-Q236 VanDerWaalsContact C-N 3.33Å; G234-Q236 PolarHBondContact O-N 2.88Å; Q236-K240 PolarHBondContact O-N 2.96Å
237S83.8Confident84.2Confident71 Ų71106.5 Ų106.550%0.49753%0.527SS..Hα-helixtrans-69.8-41.8174.978.50000112.3D233 G234 R235 I239 K240 A241D233-S237 PolarHBondContact O-N 3.26Å; G234-S237 WeakPolarHBondContact O-CB 3.37Å; G234-S237 PolarHBondContact O-N 3.36Å; G234-S237 VanDerWaalsContact O-N 3.13Å; G234-S237 PolarHBondContact O-OG 3.19Å; R235-S237 VanDerWaalsContact C-N 3.28Å; R235-S237 PolarHBondContact O-N 3.46Å; S237-I239 PolarHBondContact O-N 3.09Å; S237-K240 PolarHBondContact O-N 3.16Å; S237-A241 PolarHBondContact O-N 3Å
238E83.9Confident84.1Confident99 Ų99107.8 Ų107.846%0.46353%0.532SS..Hα-helixtrans-60.6-43.4174.1-71.6177.9177.600111.8G234 R235 K240 A241 M242G234-E238 PolarHBondContact O-N 3.24Å; R235-E238 WeakPolarHBondContact CD-OE2 3.32Å; R235-E238 IonicContact CZ-OE2 2.83Å; R235-E238 IonicContact NE-OE2 3.71Å; R235-E238 IonicContact NH1-OE2 2.71Å; R235-E238 PolarHBondContact NH1-OE2 3.09Å; R235-E238 PolarHBondContact O-N 3.08Å; E238-K240 VanDerWaalsContact C-N 3.35Å; E238-K240 PolarHBondContact O-N 3.48Å; E238-A241 PolarHBondContact O-N 2.89Å; E238-M242 WeakPolarHBondContact O-CB 3.36Å; E238-M242 WeakPolarHBondContact O-CG 3.43Å; E238-M242 PolarHBondContact O-N 3.43Å
239I84.1Confident83.9Confident83 Ų83104.2 Ų104.243%0.42652%0.516SS..Hα-helixtrans-60.9-43.7177.6-71.1167.2000110.9R235 S237 M242 Q243R235-I239 VanDerWaalsContact O-CG1 3.3Å; R235-I239 WeakPolarHBondContact O-CG1 3.02Å; R235-I239 PolarHBondContact O-N 3.31Å; S237-I239 PolarHBondContact O-N 3.09Å; I239-M242 PolarHBondContact O-N 3.38Å; I239-Q243 HydrophobicContact CG2-CG 4.48Å; I239-Q243 WeakPolarHBondContact O-CB 3.32Å; I239-Q243 VanDerWaalsContact O-CG 3.31Å; I239-Q243 WeakPolarHBondContact O-CG 3.43Å; I239-Q243 PolarHBondContact O-N 3.1Å
240K85Confident83.9Confident129 Ų129105.8 Ų105.856%0.56152%0.521SS*.Hα-helixtrans-63.5-41.8176.9-75.5-178.9-179.6177.30111.8Q236 S237 E238 Q243 Q244Q236-K240 PolarHBondContact O-N 2.96Å; S237-K240 PolarHBondContact O-N 3.16Å; E238-K240 VanDerWaalsContact C-N 3.35Å; E238-K240 PolarHBondContact O-N 3.48Å; K240-Q243 PolarHBondContact O-N 3.35Å; K240-Q244 WeakPolarHBondContact O-CG 3.49Å; K240-Q244 PolarHBondContact O-N 2.97Å; K240-Q244 VanDerWaalsContact O-N 3.08Å
241A84.7Confident83.8Confident56 Ų56105.5 Ų105.546%0.46352%0.517SS..Hα-helixtrans-63.6-44.6176.900000111.8S237 E238 Q243 Q244 Y245S237-A241 PolarHBondContact O-N 3Å; E238-A241 PolarHBondContact O-N 2.89Å; A241-Q243 PolarHBondContact O-N 3.03Å; A241-Q244 PolarHBondContact O-N 3.33Å; A241-Y245 PolarHBondContact O-N 3.43Å
242M83.5Confident83.6Confident136 Ų136107.2 Ų107.267%0.6752%0.522SS*.Hα-helixtrans-63.3-38.8176.2-74.9-76.4176.900112.4E238 I239 Y245 M246E238-M242 WeakPolarHBondContact O-CB 3.36Å; E238-M242 WeakPolarHBondContact O-CG 3.43Å; E238-M242 PolarHBondContact O-N 3.43Å; I239-M242 PolarHBondContact O-N 3.38Å; M242-Y245 PolarHBondContact O-N 3.46Å; M242-M246 PolarHBondContact O-N 3.28Å
243Q84.2Confident83.5Confident120 Ų120106.6 Ų106.656%0.56152%0.521SS*.Hα-helixtrans-64.2-41.2175-76.6175.7-8.800112.3I239 K240 A241 H247I239-Q243 HydrophobicContact CG2-CG 4.48Å; I239-Q243 WeakPolarHBondContact O-CB 3.32Å; I239-Q243 VanDerWaalsContact O-CG 3.31Å; I239-Q243 WeakPolarHBondContact O-CG 3.43Å; I239-Q243 PolarHBondContact O-N 3.1Å; K240-Q243 PolarHBondContact O-N 3.35Å; A241-Q243 PolarHBondContact O-N 3.03Å; Q243-H247 PolarHBondContact O-N 3.06Å; Q243-H247 VanDerWaalsContact O-N 3.1Å
244Q82.9Confident83.3Confident132 Ų132107.4 Ų107.462%0.61752%0.521SS*.Hα-helixtrans-65.6-41.1174.8-72.4179.5-1.400111.9K240 A241 H247 K248K240-Q244 WeakPolarHBondContact O-CG 3.49Å; K240-Q244 PolarHBondContact O-N 2.97Å; K240-Q244 VanDerWaalsContact O-N 3.08Å; A241-Q244 PolarHBondContact O-N 3.33Å; Q244-H247 PolarHBondContact O-N 2.96Å; Q244-K248 PolarHBondContact O-N 2.84Å; Q244-K248 VanDerWaalsContact O-N 3.11Å
245Y82.9Confident83Confident120 Ų120114.5 Ų114.547%0.47154%0.539SS..Hα-helixtrans-62.7-47.1176-176.1-98000111.7A241 M242 H247 K248 S249A241-Y245 PolarHBondContact O-N 3.43Å; M242-Y245 PolarHBondContact O-N 3.46Å; Y245-H247 PolarHBondContact O-N 3.2Å; Y245-K248 PolarHBondContact O-N 2.91Å; Y245-S249 PolarHBondContact O-N 3.22Å; Y245-S249 PolarHBondContact O-OG 2.99Å
246M81.8Confident82.8Confident137 Ų137112 Ų11268%0.67554%0.537SS*.Hα-helixtrans-56.8-39174.8-114.6-142-46.300112.5M242 K250M242-M246 PolarHBondContact O-N 3.28Å; M246-K250 WeakPolarHBondContact O-CB 3.4Å; M246-K250 PolarHBondContact O-N 3.02Å
247H81.3Confident82.7Confident118 Ų118112.7 Ų112.755%0.54654%0.54SS..Hα-helixtrans-65.9-46.2179.5-164.326.7000111.4Q243 Q244 Y245 K250 E251Q243-H247 PolarHBondContact O-N 3.06Å; Q243-H247 VanDerWaalsContact O-N 3.1Å; Q244-H247 PolarHBondContact O-N 2.96Å; Y245-H247 PolarHBondContact O-N 3.2Å; H247-K250 WeakPolarHBondContact O-CB 3.48Å; H247-K250 PolarHBondContact O-N 3.27Å; H247-E251 IonicContact CE1-OE1 3.82Å; H247-E251 IonicContact NE2-OE1 2.97Å; H247-E251 PolarHBondContact O-N 3.22Å; H247-E251 VanDerWaalsContact O-N 3.12Å
248K83.9Confident82.5Confident132 Ų132115.4 Ų115.457%0.57455%0.545SS*.Hα-helixtrans-60.8-47.7175.5-72.3-177.9176.3-177.80112.4Q244 Y245 K250 E251 E252Q244-K248 PolarHBondContact O-N 2.84Å; Q244-K248 VanDerWaalsContact O-N 3.11Å; Y245-K248 PolarHBondContact O-N 2.91Å; K248-K250 PolarHBondContact O-N 2.81Å; K248-E251 PolarHBondContact O-N 3.44Å; K248-E251 VanDerWaalsContact O-N 3.14Å; K248-E252 PolarHBondContact O-N 3.25Å
249S80.8Confident82.3Confident37 Ų37115 Ų11526%0.25954%0.543SS..Hα-helixtrans-61.4-33.4177.5-64.30000112.2Y245 E252 L253Y245-S249 PolarHBondContact O-N 3.22Å; Y245-S249 PolarHBondContact O-OG 2.99Å; S249-E252 PolarHBondContact O-N 3.35Å; S249-L253 WeakPolarHBondContact O-CB 3.39Å; S249-L253 PolarHBondContact O-N 2.85Å
250K83.3Confident82.1Confident138 Ų138116 Ų11660%0.655%0.549SS*.Hα-helixtrans-68.8-37.8176.1-166.1175.6-178.3179.50112.4M246 H247 K248 Q254M246-K250 WeakPolarHBondContact O-CB 3.4Å; M246-K250 PolarHBondContact O-N 3.02Å; H247-K250 WeakPolarHBondContact O-CB 3.48Å; H247-K250 PolarHBondContact O-N 3.27Å; K248-K250 PolarHBondContact O-N 2.81Å; K250-Q254 WeakPolarHBondContact O-CG 3.35Å; K250-Q254 PolarHBondContact O-N 3.4Å; K250-Q254 VanDerWaalsContact O-N 3.13Å
251E82Confident81.9Confident107 Ų107117.1 Ų117.150%0.555%0.554SS.*Hα-helixtrans-66.6-41.8173.8-69.2177.3164.200111.7H247 K248 Q254 R255H247-E251 IonicContact CE1-OE1 3.82Å; H247-E251 IonicContact NE2-OE1 2.97Å; H247-E251 PolarHBondContact O-N 3.22Å; H247-E251 VanDerWaalsContact O-N 3.12Å; K248-E251 PolarHBondContact O-N 3.44Å; K248-E251 VanDerWaalsContact O-N 3.14Å; E251-Q254 PolarHBondContact O-N 3.23Å; E251-R255 WeakPolarHBondContact O-CB 3.21Å; E251-R255 PolarHBondContact O-N 2.98Å
252E81.5Confident81.8Confident123 Ų123119.7 Ų119.758%0.57556%0.556SS**Hα-helixtrans-63.1-41.1175.3-74.2177.2171.900112.2K248 S249 R255 L256K248-E252 PolarHBondContact O-N 3.25Å; S249-E252 PolarHBondContact O-N 3.35Å; E252-R255 PolarHBondContact O-N 2.93Å; E252-L256 WeakPolarHBondContact O-CB 3.46Å; E252-L256 WeakPolarHBondContact O-CG 3.48Å; E252-L256 PolarHBondContact O-N 3.41Å
253L81.6Confident81.5Confident101 Ų101119.2 Ų119.253%0.52955%0.552SS.*Hα-helixtrans-64.6-42.3178.2-141.1151.9000111.2S249 R255 L256 E257S249-L253 WeakPolarHBondContact O-CB 3.39Å; S249-L253 PolarHBondContact O-N 2.85Å; L253-R255 VanDerWaalsContact C-N 3.34Å; L253-R255 PolarHBondContact O-N 2.87Å; L253-L256 PolarHBondContact O-N 2.9Å; L253-E257 HydrophobicContact CD2-CG 4.27Å; L253-E257 WeakPolarHBondContact O-CG 3.45Å; L253-E257 PolarHBondContact O-N 3.23Å
254Q81.4Confident81.4Confident120 Ų120119.8 Ų119.856%0.56155%0.553SS**Hα-helixtrans-62.2-40.4173.1-75.9-177.2-2300112.3K250 E251 E257 Q258K250-Q254 WeakPolarHBondContact O-CG 3.35Å; K250-Q254 PolarHBondContact O-N 3.4Å; K250-Q254 VanDerWaalsContact O-N 3.13Å; E251-Q254 PolarHBondContact O-N 3.23Å; Q254-E257 PolarHBondContact O-N 2.84Å; Q254-Q258 PolarHBondContact O-N 3.41Å; Q254-Q258 VanDerWaalsContact O-N 3.1Å
255R82.1Confident81.4Confident177 Ų177117.4 Ų117.467%0.66854%0.544SS*.Hα-helixtrans-65-42.6177-171.1177.8176.6171.4-0.5111.9E251 E252 L253 Q258 Q259E251-R255 WeakPolarHBondContact O-CB 3.21Å; E251-R255 PolarHBondContact O-N 2.98Å; E252-R255 PolarHBondContact O-N 2.93Å; L253-R255 VanDerWaalsContact C-N 3.34Å; L253-R255 PolarHBondContact O-N 2.87Å; R255-Q258 PolarHBondContact O-N 2.7Å; R255-Q259 WeakPolarHBondContact O-CG 3.4Å; R255-Q259 PolarHBondContact O-N 3.48Å
256L80Confident81.2Confident108 Ų108116.2 Ų116.257%0.56555%0.545SS*.Hα-helixtrans-66.9-39.2176.5-78.7164.8000112.2E252 L253 Q258 Q259 L260E252-L256 WeakPolarHBondContact O-CB 3.46Å; E252-L256 WeakPolarHBondContact O-CG 3.48Å; E252-L256 PolarHBondContact O-N 3.41Å; L253-L256 PolarHBondContact O-N 2.9Å; L256-Q258 VanDerWaalsContact C-N 3.3Å; L256-Q258 PolarHBondContact O-N 3.41Å; L256-Q259 PolarHBondContact O-N 3.36Å; L256-L260 WeakPolarHBondContact O-CB 3.44Å; L256-L260 PolarHBondContact O-N 2.95Å
257E81.2Confident81.1Confident122 Ų122115.4 Ų115.457%0.5754%0.544SS*.Hα-helixtrans-61.1-39.1173.8-79.2-178.6166.200112L253 Q254 L260 K261L253-E257 HydrophobicContact CD2-CG 4.27Å; L253-E257 WeakPolarHBondContact O-CG 3.45Å; L253-E257 PolarHBondContact O-N 3.23Å; Q254-E257 PolarHBondContact O-N 2.84Å; E257-L260 PolarHBondContact O-N 3.35Å; E257-K261 PolarHBondContact O-N 3.49Å; E257-K261 VanDerWaalsContact O-N 3.12Å
258Q79.7Confident81.1Confident129 Ų129116 Ų11660%0.60355%0.547SS*.Hα-helixtrans-68.3-43.4176.8-167.7152.40.900112Q254 R255 L256 L260 K261 E262Q254-Q258 PolarHBondContact O-N 3.41Å; Q254-Q258 VanDerWaalsContact O-N 3.1Å; R255-Q258 PolarHBondContact O-N 2.7Å; L256-Q258 VanDerWaalsContact C-N 3.3Å; L256-Q258 PolarHBondContact O-N 3.41Å; Q258-L260 PolarHBondContact O-N 2.95Å; Q258-K261 WeakPolarHBondContact O-CB 3.44Å; Q258-K261 PolarHBondContact O-N 3.26Å; Q258-E262 PolarHBondContact O-N 3.44Å
259Q79.8Confident81Confident90 Ų90117.5 Ų117.542%0.42155%0.549SS..Hα-helixtrans-62.2-39.7174-73.6-179.7-18.900112.6R255 L256 K261 E262 Q263R255-Q259 WeakPolarHBondContact O-CG 3.4Å; R255-Q259 PolarHBondContact O-N 3.48Å; L256-Q259 PolarHBondContact O-N 3.36Å; Q259-K261 VanDerWaalsContact C-N 3.28Å; Q259-K261 PolarHBondContact O-N 3.49Å; Q259-E262 PolarHBondContact O-N 2.98Å; Q259-Q263 WeakPolarHBondContact O-CG 3.44Å; Q259-Q263 PolarHBondContact O-N 2.97Å
260L80.3Confident80.9Confident104 Ų104117.8 Ų117.855%0.54555%0.553SS.*Hα-helixtrans-62.2-38.2175.7-16979.9000111.3L256 E257 Q258 K264L256-L260 WeakPolarHBondContact O-CB 3.44Å; L256-L260 PolarHBondContact O-N 2.95Å; E257-L260 PolarHBondContact O-N 3.35Å; Q258-L260 PolarHBondContact O-N 2.95Å; L260-K264 WeakPolarHBondContact O-CG 3.31Å; L260-K264 PolarHBondContact O-N 3.01Å
261K82.3Confident80.8Confident153 Ų153113.8 Ų113.867%0.66555%0.546SS*.Hα-helixtrans-67.2-41177.5-157.5176.1-175.5-1800111.6E257 Q258 Q259 K264 I265E257-K261 PolarHBondContact O-N 3.49Å; E257-K261 VanDerWaalsContact O-N 3.12Å; Q258-K261 WeakPolarHBondContact O-CB 3.44Å; Q258-K261 PolarHBondContact O-N 3.26Å; Q259-K261 VanDerWaalsContact C-N 3.28Å; Q259-K261 PolarHBondContact O-N 3.49Å; K261-K264 PolarHBondContact O-N 2.74Å; K261-I265 WeakPolarHBondContact O-CG1 3.49Å; K261-I265 PolarHBondContact O-N 2.86Å
262E81.1Confident80.9Confident109 Ų109115.7 Ų115.751%0.50955%0.552SS.*Hα-helixtrans-64.6-43.9174.7-71.3171.5-174.400112.2Q258 Q259 K264 I265 L266Q258-E262 PolarHBondContact O-N 3.44Å; Q259-E262 PolarHBondContact O-N 2.98Å; E262-K264 PolarHBondContact O-N 3.45Å; E262-I265 PolarHBondContact O-N 3.39Å; E262-L266 PolarHBondContact O-N 3.46Å
263Q78.5Confident80.7Confident126 Ų126115.3 Ų115.359%0.58955%0.55SS**Hα-helixtrans-63.6-38.1176.9-77.3-65.7-10.900112.7Q259 I265 L266 N267Q259-Q263 WeakPolarHBondContact O-CG 3.44Å; Q259-Q263 PolarHBondContact O-N 2.97Å; Q263-I265 VanDerWaalsContact C-N 3.34Å; Q263-I265 PolarHBondContact O-N 3.26Å; Q263-L266 PolarHBondContact O-N 3.44Å; Q263-N267 WeakPolarHBondContact O-CB 3.45Å; Q263-N267 PolarHBondContact O-N 3.38Å
264K81.6Confident80.7Confident133 Ų133114.3 Ų114.358%0.57855%0.548SS*.Hα-helixtrans-60.5-42.5173.3-78-178.5177.5-176.40112.3L260 K261 E262 N267 E268L260-K264 WeakPolarHBondContact O-CG 3.31Å; L260-K264 PolarHBondContact O-N 3.01Å; K261-K264 PolarHBondContact O-N 2.74Å; E262-K264 PolarHBondContact O-N 3.45Å; K264-N267 PolarHBondContact O-N 3.33Å; K264-E268 PolarHBondContact O-N 2.94Å
265I81.7Confident80.7Confident82 Ų82115 Ų11542%0.42155%0.551SS.*Hα-helixtrans-65.4-41.5177.9-65.6165.8000111.1K261 E262 Q263 R269K261-I265 WeakPolarHBondContact O-CG1 3.49Å; K261-I265 PolarHBondContact O-N 2.86Å; E262-I265 PolarHBondContact O-N 3.39Å; Q263-I265 VanDerWaalsContact C-N 3.34Å; Q263-I265 PolarHBondContact O-N 3.26Å; I265-R269 WeakPolarHBondContact O-CG 3.34Å; I265-R269 PolarHBondContact O-N 3.34Å; I265-R269 VanDerWaalsContact O-N 3.12Å
266L79.9Confident80.6Confident95 Ų95113.5 Ų113.550%0.49755%0.552SS.*Hα-helixtrans-62.7-42.9175.6-84.3164.5000111.8E262 Q263 R269 A270E262-L266 PolarHBondContact O-N 3.46Å; Q263-L266 PolarHBondContact O-N 3.44Å; L266-R269 PolarHBondContact O-N 3.28Å; L266-A270 PolarHBondContact O-N 3.46Å
267N80.4Confident80.6Confident120 Ų120114.8 Ų114.864%0.64255%0.554SS**Hα-helixtrans-67.5-38.2-179.3-140.43.4000111.9Q263 K264 R269 A270 A271Q263-N267 WeakPolarHBondContact O-CB 3.45Å; Q263-N267 PolarHBondContact O-N 3.38Å; K264-N267 PolarHBondContact O-N 3.33Å; N267-R269 VanDerWaalsContact C-N 3.33Å; N267-R269 PolarHBondContact O-N 3.39Å; N267-A270 PolarHBondContact O-N 3.21Å; N267-A271 WeakPolarHBondContact O-CB 2.96Å; N267-A271 PolarHBondContact O-N 2.89Å
268E80.7Confident80.7Confident131 Ų131115 Ų11561%0.61256%0.555SS**Hα-helixtrans-63.5-35.9172.2-78.5179.4-177.500112.8K264 K272K264-E268 PolarHBondContact O-N 2.94Å; E268-K272 WeakPolarHBondContact O-CG 3.41Å; E268-K272 PolarHBondContact O-N 3.16Å
269R81.6Confident80.9Confident163 Ų163114.3 Ų114.362%0.61555%0.554SS**Hα-helixtrans-68.2-46.6174.6-72.9176.8-177.7-177.60.9111.6I265 L266 N267 A271 K272 E273I265-R269 WeakPolarHBondContact O-CG 3.34Å; I265-R269 PolarHBondContact O-N 3.34Å; I265-R269 VanDerWaalsContact O-N 3.12Å; L266-R269 PolarHBondContact O-N 3.28Å; N267-R269 VanDerWaalsContact C-N 3.33Å; N267-R269 PolarHBondContact O-N 3.39Å; R269-A271 VanDerWaalsContact C-N 3.32Å; R269-A271 PolarHBondContact O-N 2.94Å; R269-K272 PolarHBondContact O-N 3.47Å; R269-E273 PolarHBondContact O-N 2.97Å
270A78.4Confident81.1Confident43 Ų43118.2 Ų118.236%0.35557%0.565SS.*Hα-helixtrans-61-40.8177.800000111.9L266 N267 K272 E273 V274L266-A270 PolarHBondContact O-N 3.46Å; N267-A270 PolarHBondContact O-N 3.21Å; A270-K272 PolarHBondContact O-N 2.98Å; A270-E273 PolarHBondContact O-N 3.43Å; A270-V274 WeakPolarHBondContact O-CG2 3.39Å; A270-V274 PolarHBondContact O-N 3.07Å
271A81.6Confident81.1Confident53 Ų53118.3 Ų118.344%0.43857%0.566SS.*Hα-helixtrans-60.2-42.6175.700000112.4N267 R269 V274 E275N267-A271 WeakPolarHBondContact O-CB 2.96Å; N267-A271 PolarHBondContact O-N 2.89Å; R269-A271 VanDerWaalsContact C-N 3.32Å; R269-A271 PolarHBondContact O-N 2.94Å; A271-V274 PolarHBondContact O-N 3.36Å; A271-E275 PolarHBondContact O-N 3.47Å
272K83Confident81.2Confident147 Ų147116.3 Ų116.364%0.63956%0.561SS**Hα-helixtrans-65.6-36.7175.7-74.1-178.7179.5179.80113.1E268 R269 A270 E275 Q276E268-K272 WeakPolarHBondContact O-CG 3.41Å; E268-K272 PolarHBondContact O-N 3.16Å; R269-K272 PolarHBondContact O-N 3.47Å; A270-K272 PolarHBondContact O-N 2.98Å; K272-E275 PolarHBondContact O-N 3.49Å; K272-Q276 PolarHBondContact O-N 2.99Å
273E78.3Confident81.3Confident115 Ų115117.6 Ų117.654%0.53756%0.564SS.*Hα-helixtrans-65.4-42.3175.1-74.4179.5-177.900111.4R269 A270 E275 Q276 F277R269-E273 PolarHBondContact O-N 2.97Å; A270-E273 PolarHBondContact O-N 3.43Å; E273-E275 PolarHBondContact O-N 3.48Å; E273-Q276 WeakPolarHBondContact O-CB 3.3Å; E273-Q276 PolarHBondContact O-N 3.39Å; E273-F277 HydrophobicContact CB-CE2 4.4Å; E273-F277 WeakPolarHBondContact O-CD2 3.34Å; E273-F277 PolarHBondContact O-N 2.96Å
274V80.4Confident81.4Confident80 Ų80116 Ų11649%0.48556%0.56SS.*Hα-helixtrans-61.1-44.6175.7172.30000111.4A270 A271 Q276 F277 Q278A270-V274 WeakPolarHBondContact O-CG2 3.39Å; A270-V274 PolarHBondContact O-N 3.07Å; A271-V274 PolarHBondContact O-N 3.36Å; V274-Q276 VanDerWaalsContact C-N 3.35Å; V274-Q276 PolarHBondContact O-N 3.04Å; V274-F277 PolarHBondContact O-N 3.19Å; V274-Q278 HydrophobicContact CG1-CG 4.45Å; V274-Q278 WeakPolarHBondContact O-CB 3.33Å; V274-Q278 WeakPolarHBondContact O-CG 3.48Å; V274-Q278 PolarHBondContact O-N 3.28Å
275E81.8Confident81.5Confident134 Ų134115.1 Ų115.163%0.62656%0.557SS**Hα-helixtrans-60.6-41.7174.9-76.6-177.7170.700112.2A271 K272 E273 Q278 L279A271-E275 PolarHBondContact O-N 3.47Å; K272-E275 PolarHBondContact O-N 3.49Å; E273-E275 PolarHBondContact O-N 3.48Å; E275-Q278 PolarHBondContact O-N 3.42Å; E275-L279 PolarHBondContact O-N 3.22Å
276Q81.5Confident81.6Confident146 Ų146117 Ų11768%0.68256%0.564SS**Hα-helixtrans-62.3-44174.9-96.3-171.60.800112.5K272 E273 V274 L279 R280K272-Q276 PolarHBondContact O-N 2.99Å; E273-Q276 WeakPolarHBondContact O-CB 3.3Å; E273-Q276 PolarHBondContact O-N 3.39Å; V274-Q276 VanDerWaalsContact C-N 3.35Å; V274-Q276 PolarHBondContact O-N 3.04Å; Q276-L279 PolarHBondContact O-N 3.11Å; Q276-R280 WeakPolarHBondContact O-CB 3.33Å; Q276-R280 PolarHBondContact O-N 2.86Å
277F79.1Confident81.7Confident136 Ų136117.1 Ų117.160%0.59656%0.562SS**Hα-helixtrans-66.2-39.1178-76.3-58.5000112E273 V274 R280 N281E273-F277 HydrophobicContact CB-CE2 4.4Å; E273-F277 WeakPolarHBondContact O-CD2 3.34Å; E273-F277 PolarHBondContact O-N 2.96Å; V274-F277 PolarHBondContact O-N 3.19Å; F277-R280 PolarHBondContact O-N 3.49Å; F277-N281 WeakPolarHBondContact O-CB 3.42Å; F277-N281 PolarHBondContact O-N 2.87Å
278Q82.8Confident81.7Confident127 Ų127116.6 Ų116.659%0.59356%0.56SS**Hα-helixtrans-61.5-45.5174.5-75.5178.4-7.500111.7V274 E275 R280 N281 M282V274-Q278 HydrophobicContact CG1-CG 4.45Å; V274-Q278 WeakPolarHBondContact O-CB 3.33Å; V274-Q278 WeakPolarHBondContact O-CG 3.48Å; V274-Q278 PolarHBondContact O-N 3.28Å; E275-Q278 PolarHBondContact O-N 3.42Å; Q278-R280 VanDerWaalsContact C-N 3.32Å; Q278-R280 PolarHBondContact O-N 3.2Å; Q278-N281 PolarHBondContact O-N 3.08Å; Q278-M282 PolarHBondContact O-N 3.38Å
279L84.4Confident81.9Confident113 Ų113115.7 Ų115.759%0.59256%0.556SS**Hα-helixtrans-62.3-39.3177.4-163.276.6000112.1E275 Q276 K283E275-L279 PolarHBondContact O-N 3.22Å; Q276-L279 PolarHBondContact O-N 3.11Å; L279-K283 PolarHBondContact O-N 3.25Å
280R83.6Confident82Confident173 Ų173114.3 Ų114.365%0.65356%0.556SS**Hα-helixtrans-68.3-39.7177.6-168.5173.5-174171.30.9112.2Q276 F277 Q278 K283 L284Q276-R280 WeakPolarHBondContact O-CB 3.33Å; Q276-R280 PolarHBondContact O-N 2.86Å; F277-R280 PolarHBondContact O-N 3.49Å; Q278-R280 VanDerWaalsContact C-N 3.32Å; Q278-R280 PolarHBondContact O-N 3.2Å; R280-K283 PolarHBondContact O-N 3.37Å; R280-L284 PolarHBondContact O-N 3.11Å; R280-L284 VanDerWaalsContact O-N 3.09Å
281N81.3Confident82.2Confident105 Ų105118 Ų11856%0.56157%0.566SS**Hα-helixtrans-65-42.1177.1-159.1-10.7000111F277 Q278 K283 L284 Q285F277-N281 WeakPolarHBondContact O-CB 3.42Å; F277-N281 PolarHBondContact O-N 2.87Å; Q278-N281 PolarHBondContact O-N 3.08Å; N281-K283 VanDerWaalsContact C-N 3.32Å; N281-K283 PolarHBondContact O-N 2.84Å; N281-L284 PolarHBondContact O-N 2.91Å; N281-Q285 WeakPolarHBondContact O-CB 3.48Å; N281-Q285 PolarHBondContact O-N 3.4Å
282M83.3Confident82.3Confident112 Ų112119.1 Ų119.155%0.55257%0.567SS**Hα-helixtrans-62.3-36.8176.9-152.4170.57500112.6Q278 Q286Q278-M282 PolarHBondContact O-N 3.38Å; M282-Q286 PolarHBondContact O-N 2.92Å
283K84.1Confident82.3Confident135 Ų135117 Ų11759%0.58756%0.562SS**Hα-helixtrans-65.2-47.4172-88.2-172.6173.3-174.80113L279 R280 N281 Q285 Q286 E287L279-K283 PolarHBondContact O-N 3.25Å; R280-K283 PolarHBondContact O-N 3.37Å; N281-K283 VanDerWaalsContact C-N 3.32Å; N281-K283 PolarHBondContact O-N 2.84Å; K283-Q285 PolarHBondContact O-N 3.16Å; K283-Q286 PolarHBondContact O-N 3.35Å; K283-E287 PolarHBondContact O-N 3Å
284L80.1Confident82.5Confident94 Ų94114.6 Ų114.649%0.49256%0.555SS.*Hα-helixtrans-61.9-35.6178.9-77.6166.2000111.6R280 N281 E287 N288R280-L284 PolarHBondContact O-N 3.11Å; R280-L284 VanDerWaalsContact O-N 3.09Å; N281-L284 PolarHBondContact O-N 2.91Å; L284-E287 PolarHBondContact O-N 3.2Å; L284-N288 WeakPolarHBondContact O-CB 3.37Å; L284-N288 PolarHBondContact O-N 3.3Å
285Q83Confident82.4Confident113 Ų113114.7 Ų114.753%0.52856%0.559SS.*Hα-helixtrans-65.1-42.7176.2-167169.9-7.700111.9N281 K283 N288 E289N281-Q285 WeakPolarHBondContact O-CB 3.48Å; N281-Q285 PolarHBondContact O-N 3.4Å; K283-Q285 PolarHBondContact O-N 3.16Å; Q285-N288 PolarHBondContact O-N 3.48Å; Q285-E289 WeakPolarHBondContact O-CG 3.44Å; Q285-E289 PolarHBondContact O-N 3.27Å
286Q83.6Confident82.4Confident122 Ų122114 Ų11457%0.5756%0.556SS**Hα-helixtrans-63.3-42.4174.3-73179.3-15.200112.7M282 K283 N288 E289 Q290M282-Q286 PolarHBondContact O-N 2.92Å; K283-Q286 PolarHBondContact O-N 3.35Å; Q286-N288 VanDerWaalsContact C-N 3.31Å; Q286-N288 PolarHBondContact O-N 2.71Å; Q286-E289 PolarHBondContact O-N 3.48Å; Q286-Q290 PolarHBondContact O-N 2.7Å
287E82.5Confident82.4Confident97 Ų97113 Ų11345%0.45355%0.551SS.*Hα-helixtrans-62.1-40.1176-72.5173-178.700111.3K283 L284 Q290 H291K283-E287 PolarHBondContact O-N 3Å; L284-E287 PolarHBondContact O-N 3.2Å; E287-Q290 PolarHBondContact O-N 2.98Å; E287-H291 PolarHBondContact O-CD2 3.25Å; E287-H291 PolarHBondContact O-N 2.82Å
288N80.1Confident82.4Confident110 Ų110111.3 Ų111.359%0.58855%0.547SS*.Hα-helixtrans-68.5-39.9180-147.21.2000112.2L284 Q285 Q286 Q290 H291 T292L284-N288 WeakPolarHBondContact O-CB 3.37Å; L284-N288 PolarHBondContact O-N 3.3Å; Q285-N288 PolarHBondContact O-N 3.48Å; Q286-N288 VanDerWaalsContact C-N 3.31Å; Q286-N288 PolarHBondContact O-N 2.71Å; N288-Q290 VanDerWaalsContact C-N 3.33Å; N288-Q290 PolarHBondContact O-N 2.75Å; N288-H291 PolarHBondContact O-N 3.25Å; N288-T292 WeakPolarHBondContact O-CB 3.4Å; N288-T292 PolarHBondContact O-N 3.29Å; N288-T292 PolarHBondContact O-OG1 2.83Å
289E84.4Confident82.4Confident112 Ų112108.3 Ų108.352%0.52354%0.541SS..Hα-helixtrans-61.3-41.7172.2-74.6172.1-172.400111.4Q285 Q286 T292 L293Q285-E289 WeakPolarHBondContact O-CG 3.44Å; Q285-E289 PolarHBondContact O-N 3.27Å; Q286-E289 PolarHBondContact O-N 3.48Å; E289-T292 PolarHBondContact O-N 3.48Å; E289-L293 PolarHBondContact O-N 3.48Å; E289-L293 VanDerWaalsContact O-N 3.08Å
290Q84.1Confident82.2Confident133 Ų133109.1 Ų109.162%0.62154%0.542SS*.Hα-helixtrans-66.2-41.3178-164.1172.416.500112.4Q286 E287 N288 T292 L293 T294Q286-Q290 PolarHBondContact O-N 2.7Å; E287-Q290 PolarHBondContact O-N 2.98Å; N288-Q290 VanDerWaalsContact C-N 3.33Å; N288-Q290 PolarHBondContact O-N 2.75Å; Q290-T292 VanDerWaalsContact C-N 3.34Å; Q290-L293 PolarHBondContact O-N 3.23Å; Q290-T294 PolarHBondContact O-N 3.12Å; Q290-T294 VanDerWaalsContact O-N 3.13Å; Q290-T294 PolarHBondContact O-OG1 3.39Å
291H82.5Confident82.1Confident122 Ų122106.1 Ų106.157%0.56554%0.535SS*.Hα-helixtrans-64.5-38.2174-74.7-51.1000112.4E287 N288 T294 C295E287-H291 PolarHBondContact O-CD2 3.25Å; E287-H291 PolarHBondContact O-N 2.82Å; N288-H291 PolarHBondContact O-N 3.25Å; H291-T294 PolarHBondContact O-N 3.06Å; H291-C295 PolarHBondContact O-N 3.34Å; H291-C295 PolarHBondContact O-SG 2.99Å; H291-C295 VanDerWaalsContact O-SG 3.41Å
292T83.4Confident81.9Confident75 Ų75106.8 Ų106.846%0.4654%0.539SS..Hα-helixtrans-63.1-45.7177.8-52.60000111.3N288 E289 Q290 T294 C295 E296N288-T292 WeakPolarHBondContact O-CB 3.4Å; N288-T292 PolarHBondContact O-N 3.29Å; N288-T292 PolarHBondContact O-OG1 2.83Å; E289-T292 PolarHBondContact O-N 3.48Å; Q290-T292 VanDerWaalsContact C-N 3.34Å; T292-T294 VanDerWaalsContact C-N 3.3Å; T292-T294 PolarHBondContact O-N 3.15Å; T292-C295 PolarHBondContact O-N 3.24Å; T292-E296 PolarHBondContact O-N 3.36Å
293L84.1Confident81.9Confident104 Ų104107.6 Ų107.655%0.54554%0.541SS..Hα-helixtrans-59.3-39.8174.2-81.8161.3000112.6E289 Q290 E296 Q297E289-L293 PolarHBondContact O-N 3.48Å; E289-L293 VanDerWaalsContact O-N 3.08Å; Q290-L293 PolarHBondContact O-N 3.23Å; L293-E296 PolarHBondContact O-N 3.06Å; L293-Q297 WeakPolarHBondContact O-CG 3.45Å; L293-Q297 PolarHBondContact O-N 3.15Å; L293-Q297 VanDerWaalsContact O-N 3.14Å
294T82.5Confident81.7Confident63 Ų63107.5 Ų107.539%0.38754%0.543SS..Hα-helixtrans-67.4-39.9179.1-47.10000111.3Q290 H291 T292 Q297 L298Q290-T294 PolarHBondContact O-N 3.12Å; Q290-T294 VanDerWaalsContact O-N 3.13Å; Q290-T294 PolarHBondContact O-OG1 3.39Å; H291-T294 PolarHBondContact O-N 3.06Å; T292-T294 VanDerWaalsContact C-N 3.3Å; T292-T294 PolarHBondContact O-N 3.15Å; T294-Q297 PolarHBondContact O-N 3.5Å; T294-L298 WeakPolarHBondContact O-CG 3.42Å; T294-L298 PolarHBondContact O-N 3.36Å; T294-L298 VanDerWaalsContact O-N 3.11Å
295C77.2Confident81.7Confident83 Ų83109.2 Ų109.256%0.56155%0.546SS*.Hα-helixtrans-64.5-39.1175.4-74.70000112.6H291 T292 S299H291-C295 PolarHBondContact O-N 3.34Å; H291-C295 PolarHBondContact O-SG 2.99Å; H291-C295 VanDerWaalsContact O-SG 3.41Å; T292-C295 PolarHBondContact O-N 3.24Å; C295-S299 WeakPolarHBondContact O-CB 3.49Å; C295-S299 PolarHBondContact O-N 2.99Å
296E83.2Confident81.6Confident119 Ų119106.6 Ų106.656%0.55654%0.544SS*.Hα-helixtrans-64.1-41.6175.4-78.3-176.4160.600112.3T292 L293 S299 Q300T292-E296 PolarHBondContact O-N 3.36Å; L293-E296 PolarHBondContact O-N 3.06Å; E296-S299 WeakPolarHBondContact O-CB 3.47Å; E296-S299 PolarHBondContact O-N 3.39Å; E296-Q300 WeakPolarHBondContact O-CG 3.41Å; E296-Q300 PolarHBondContact O-N 3.04Å; E296-Q300 VanDerWaalsContact O-N 3.11Å
297Q81.7Confident81.5Confident124 Ų124106.7 Ų106.758%0.57955%0.548SS*.Hα-helixtrans-61.6-47.9175.9-73.1177-5.600112.1L293 T294 S299 Q300 E301L293-Q297 WeakPolarHBondContact O-CG 3.45Å; L293-Q297 PolarHBondContact O-N 3.15Å; L293-Q297 VanDerWaalsContact O-N 3.14Å; T294-Q297 PolarHBondContact O-N 3.5Å; Q297-S299 VanDerWaalsContact C-N 3.27Å; Q297-S299 PolarHBondContact O-N 2.96Å; Q297-Q300 PolarHBondContact O-N 3.38Å; Q297-E301 PolarHBondContact O-N 3.3Å
298L77.7Confident81.3Confident101 Ų101108.6 Ų108.653%0.52956%0.556SS.*Hα-helixtrans-63-34.2178.1-72.6171.5000112.5T294 N302T294-L298 WeakPolarHBondContact O-CG 3.42Å; T294-L298 PolarHBondContact O-N 3.36Å; T294-L298 VanDerWaalsContact O-N 3.11Å; L298-N302 WeakPolarHBondContact O-CB 3.42Å; L298-N302 PolarHBondContact O-N 3.42Å; L298-N302 VanDerWaalsContact O-N 3.1Å
299S82.8Confident81.1Confident65 Ų65108.6 Ų108.646%0.45556%0.556SS.*Hα-helixtrans-64.7-43175.2-173.80000112C295 E296 Q297 N302 Q303C295-S299 WeakPolarHBondContact O-CB 3.49Å; C295-S299 PolarHBondContact O-N 2.99Å; E296-S299 WeakPolarHBondContact O-CB 3.47Å; E296-S299 PolarHBondContact O-N 3.39Å; Q297-S299 VanDerWaalsContact C-N 3.27Å; Q297-S299 PolarHBondContact O-N 2.96Å; S299-N302 PolarHBondContact O-N 2.99Å; S299-Q303 PolarHBondContact O-N 3.28Å; S299-Q303 VanDerWaalsContact O-N 3.09Å
300Q81.8Confident81.1Confident130 Ų130109.4 Ų109.461%0.60756%0.558SS**Hα-helixtrans-65.5-41.9177-70.6-179.610.400112.2E296 Q297 N302 Q303 Q304E296-Q300 WeakPolarHBondContact O-CG 3.41Å; E296-Q300 PolarHBondContact O-N 3.04Å; E296-Q300 VanDerWaalsContact O-N 3.11Å; Q297-Q300 PolarHBondContact O-N 3.38Å; Q300-N302 VanDerWaalsContact C-N 3.3Å; Q300-N302 PolarHBondContact O-N 3.12Å; Q300-Q303 PolarHBondContact O-N 3.47Å; Q300-Q304 PolarHBondContact O-N 2.97Å; Q300-Q304 VanDerWaalsContact O-N 3.09Å
301E81Confident81Confident110 Ų110105.8 Ų105.851%0.51455%0.55SS.*Hα-helixtrans-61.1-39.3174.7-73.6-173.617400112.2Q297 Q304 K305Q297-E301 PolarHBondContact O-N 3.3Å; E301-Q304 PolarHBondContact O-N 3.34Å; E301-K305 PolarHBondContact O-N 2.65Å; E301-K305 VanDerWaalsContact O-N 3.09Å
302N77.3Confident80.7Confident119 Ų119105.9 Ų105.964%0.63655%0.549SS*.Hα-helixtrans-66.9-38.4178.8-129.5-18.8000111.8L298 S299 Q300 K305 A306L298-N302 WeakPolarHBondContact O-CB 3.42Å; L298-N302 PolarHBondContact O-N 3.42Å; L298-N302 VanDerWaalsContact O-N 3.1Å; S299-N302 PolarHBondContact O-N 2.99Å; Q300-N302 VanDerWaalsContact C-N 3.3Å; Q300-N302 PolarHBondContact O-N 3.12Å; N302-K305 PolarHBondContact O-N 3.4Å; N302-A306 WeakPolarHBondContact O-CB 3.38Å; N302-A306 PolarHBondContact O-N 3.26Å
303Q81.9Confident80.5Confident128 Ų128108 Ų10860%0.59855%0.554SS**Hα-helixtrans-64.7-40174.3-77.3-178.1-7.200112.3S299 Q300 A306 L307S299-Q303 PolarHBondContact O-N 3.28Å; S299-Q303 VanDerWaalsContact O-N 3.09Å; Q300-Q303 PolarHBondContact O-N 3.47Å; Q303-A306 PolarHBondContact O-N 3.15Å; Q303-L307 WeakPolarHBondContact O-CG 3.5Å; Q303-L307 PolarHBondContact O-N 3.4Å
304Q81.2Confident80.3Confident134 Ų134107.8 Ų107.863%0.62655%0.553SS**Hα-helixtrans-62.5-47.1175.2-80.9-177.4-13.100112Q300 E301 A306 L307 E308Q300-Q304 PolarHBondContact O-N 2.97Å; Q300-Q304 VanDerWaalsContact O-N 3.09Å; E301-Q304 PolarHBondContact O-N 3.34Å; Q304-A306 VanDerWaalsContact C-N 3.31Å; Q304-A306 PolarHBondContact O-N 3.04Å; Q304-L307 PolarHBondContact O-N 3.09Å; Q304-L307 VanDerWaalsContact O-N 3.16Å; Q304-E308 PolarHBondContact O-N 3.07Å
305K80.4Confident80Confident130 Ų130110.2 Ų110.257%0.56556%0.56SS**Hα-helixtrans-63.7-34.7178.4-72.8-172.5179.2176.50113.2E301 N302 L307 E308 L309E301-K305 PolarHBondContact O-N 2.65Å; E301-K305 VanDerWaalsContact O-N 3.09Å; N302-K305 PolarHBondContact O-N 3.4Å; K305-L307 VanDerWaalsContact C-N 3.32Å; K305-L307 PolarHBondContact O-N 2.91Å; K305-E308 PolarHBondContact O-N 2.7Å; K305-L309 PolarHBondContact O-N 3.19Å
306A79.7Confident79.9Confident58 Ų58110.5 Ų110.548%0.47956%0.555SS.*Hα-helixtrans-64.2-36.6175.500000112.4N302 Q303 Q304 K310N302-A306 WeakPolarHBondContact O-CB 3.38Å; N302-A306 PolarHBondContact O-N 3.26Å; Q303-A306 PolarHBondContact O-N 3.15Å; Q304-A306 VanDerWaalsContact C-N 3.31Å; Q304-A306 PolarHBondContact O-N 3.04Å; A306-K310 PolarHBondContact O-N 3.44Å
307L82.2Confident79.8Confident124 Ų124110 Ų11065%0.64955%0.553SS**Hα-helixtrans-68.7-39.6175.8-70.7169.2000112.1Q303 Q304 K305 K310 A311Q303-L307 WeakPolarHBondContact O-CG 3.5Å; Q303-L307 PolarHBondContact O-N 3.4Å; Q304-L307 PolarHBondContact O-N 3.09Å; Q304-L307 VanDerWaalsContact O-N 3.16Å; K305-L307 VanDerWaalsContact C-N 3.32Å; K305-L307 PolarHBondContact O-N 2.91Å; L307-K310 PolarHBondContact O-N 2.96Å; L307-A311 PolarHBondContact O-N 3.32Å
308E79Confident79.7Confident136 Ų136109 Ų10964%0.63655%0.548SS*.Hα-helixtrans-64-41.9175.4-69.7-179.5170.400112.5Q304 K305 K310 A311 K312Q304-E308 PolarHBondContact O-N 3.07Å; K305-E308 PolarHBondContact O-N 2.7Å; E308-K310 PolarHBondContact O-N 3.19Å; E308-A311 PolarHBondContact O-N 2.83Å; E308-K312 PolarHBondContact O-N 2.92Å
309L75.3Confident79.5Confident111 Ų111110.6 Ų110.658%0.58155%0.554SS**Hα-helixtrans-60.7-44.1176.2-108.6151.5000111.7K305 A311 K312 E313K305-L309 PolarHBondContact O-N 3.19Å; L309-A311 PolarHBondContact O-N 3.48Å; L309-K312 PolarHBondContact O-N 3.43Å; L309-E313 WeakPolarHBondContact O-CG 3.32Å; L309-E313 PolarHBondContact O-N 3.46Å
310K83.9Confident79.2Confident129 Ų129116 Ų11656%0.56157%0.565SS**Hα-helixtrans-62.6-41.7178.6-166.5177.8-179.2-177.70112.3A306 L307 E308 K312 E313 D314A306-K310 PolarHBondContact O-N 3.44Å; L307-K310 PolarHBondContact O-N 2.96Å; E308-K310 PolarHBondContact O-N 3.19Å; K310-K312 VanDerWaalsContact C-N 3.28Å; K310-K312 PolarHBondContact O-N 3.26Å; K310-E313 PolarHBondContact O-N 3.1Å; K310-D314 PolarHBondContact O-N 3.09Å; K310-D314 VanDerWaalsContact O-N 3.1Å
311A81.6Confident79Confident57 Ų57113.8 Ų113.847%0.47156%0.557SS.*Hα-helixtrans-61.8-36.4175.900000112.4L307 E308 L309 E315L307-A311 PolarHBondContact O-N 3.32Å; E308-A311 PolarHBondContact O-N 2.83Å; L309-A311 PolarHBondContact O-N 3.48Å; A311-E315 PolarHBondContact O-N 3.17Å
312K77.7Confident78.8Confident124 Ų124111.9 Ų111.954%0.53955%0.55SS..Hα-helixtrans-71.3-35.8175.7-73.6-74.8164.1-155.10113E308 L309 K310 D314 E315 I316E308-K312 PolarHBondContact O-N 2.92Å; L309-K312 PolarHBondContact O-N 3.43Å; K310-K312 VanDerWaalsContact C-N 3.28Å; K310-K312 PolarHBondContact O-N 3.26Å; K312-D314 VanDerWaalsContact C-N 3.34Å; K312-E315 IonicContact NZ-OE1 3.85Å; K312-E315 IonicContact NZ-OE2 2.89Å; K312-E315 PolarHBondContact NZ-OE2 3.06Å; K312-E315 PolarHBondContact O-N 3.4Å; K312-I316 WeakPolarHBondContact O-CG1 3.35Å; K312-I316 PolarHBondContact O-N 3.35Å
313E78.5Confident78.4Confident120 Ų120111.4 Ų111.456%0.56155%0.547SS*.Hα-helixtrans-63.9-39.3174.5-72.5177.3161.700111.9L309 K310 I316 H317L309-E313 WeakPolarHBondContact O-CG 3.32Å; L309-E313 PolarHBondContact O-N 3.46Å; K310-E313 PolarHBondContact O-N 3.1Å; E313-I316 PolarHBondContact O-N 3.02Å; E313-H317 PolarHBondContact O-N 3.38Å
314D79.9Confident78.2Confident99 Ų99107 Ų10753%0.52954%0.536SS..Hα-helixtrans-67-38.4177.1-70.4-27000112.2K310 K312 I316 H317 Q318K310-D314 PolarHBondContact O-N 3.09Å; K310-D314 VanDerWaalsContact O-N 3.1Å; K312-D314 VanDerWaalsContact C-N 3.34Å; D314-I316 PolarHBondContact O-N 3.15Å; D314-H317 PolarHBondContact O-N 3.48Å; D314-Q318 PolarHBondContact O-N 3.22Å
315E77Confident78Confident114 Ų114106.6 Ų106.653%0.53353%0.532SS..Hα-helixtrans-60-43171.9-79.7-178.8163.400112A311 K312 H317 Q318 M319A311-E315 PolarHBondContact O-N 3.17Å; K312-E315 IonicContact NZ-OE1 3.85Å; K312-E315 IonicContact NZ-OE2 2.89Å; K312-E315 PolarHBondContact NZ-OE2 3.06Å; K312-E315 PolarHBondContact O-N 3.4Å; E315-H317 VanDerWaalsContact C-N 3.34Å; E315-Q318 PolarHBondContact O-N 3.07Å; E315-M319 PolarHBondContact O-N 3.33Å
316I74.8Confident77.4Confident89 Ų89106 Ų10646%0.45654%0.535SS..Hα-helixtrans-66.4-38.3177.9-67.9169.7000110.7K312 E313 D314 M319 R320K312-I316 WeakPolarHBondContact O-CG1 3.35Å; K312-I316 PolarHBondContact O-N 3.35Å; E313-I316 PolarHBondContact O-N 3.02Å; D314-I316 PolarHBondContact O-N 3.15Å; I316-M319 PolarHBondContact O-N 3.25Å; I316-R320 WeakPolarHBondContact O-CG 3.47Å; I316-R320 PolarHBondContact O-N 2.98Å; I316-R320 VanDerWaalsContact O-N 3.15Å
317H79.5Confident77.1Confident109 Ų109106.4 Ų106.451%0.50553%0.529SS..Hα-helixtrans-62.1-43.5177-169.675.6000111.6E313 D314 E315 M319 R320 L321E313-H317 PolarHBondContact O-N 3.38Å; D314-H317 PolarHBondContact O-N 3.48Å; E315-H317 VanDerWaalsContact C-N 3.34Å; H317-M319 PolarHBondContact O-N 3.46Å; H317-R320 WeakPolarHBondContact O-CB 3.35Å; H317-R320 PolarHBondContact O-N 3.42Å; H317-L321 PolarHBondContact O-N 2.95Å
318Q80Confident76.7Confident102 Ų102107.5 Ų107.548%0.47753%0.528SS..Hα-helixtrans-61.7-42.4177.5-169.660.133.700112.1D314 E315 R320 L321 D322D314-Q318 PolarHBondContact O-N 3.22Å; E315-Q318 PolarHBondContact O-N 3.07Å; Q318-R320 VanDerWaalsContact C-N 3.3Å; Q318-R320 PolarHBondContact O-N 3.18Å; Q318-L321 WeakPolarHBondContact O-CB 3.41Å; Q318-L321 PolarHBondContact O-N 3.04Å; Q318-L321 VanDerWaalsContact O-N 3.17Å; Q318-D322 PolarHBondContact O-N 3.2Å
319M73.2Confident76.4Confident134 Ų134106 Ų10666%0.6652%0.524SS*.Hα-helixtrans-63.8-32.8176.5-70.8-135.7-89.900113.3E315 I316 H317 D322 L323E315-M319 PolarHBondContact O-N 3.33Å; I316-M319 PolarHBondContact O-N 3.25Å; H317-M319 PolarHBondContact O-N 3.46Å; M319-D322 PolarHBondContact O-N 2.92Å; M319-L323 PolarHBondContact O-N 2.94Å
320R76.4Confident76Confident178 Ų178108 Ų10867%0.67252%0.523SS*.Hα-helixtrans-67.3-35.4174.7-72178.2-178.7178.93.3112.4I316 H317 Q318 G324I316-R320 WeakPolarHBondContact O-CG 3.47Å; I316-R320 PolarHBondContact O-N 2.98Å; I316-R320 VanDerWaalsContact O-N 3.15Å; H317-R320 WeakPolarHBondContact O-CB 3.35Å; H317-R320 PolarHBondContact O-N 3.42Å; Q318-R320 VanDerWaalsContact C-N 3.3Å; Q318-R320 PolarHBondContact O-N 3.18Å; R320-G324 PolarHBondContact O-N 3.42Å; R320-G324 VanDerWaalsContact O-N 3.17Å
321L78.3Confident75.3Confident85 Ų85106.9 Ų106.945%0.44552%0.52SS..Hα-helixtrans-65.9-37.9177-69.9171.9000111.9H317 Q318 G324 K325H317-L321 PolarHBondContact O-N 2.95Å; Q318-L321 WeakPolarHBondContact O-CB 3.41Å; Q318-L321 PolarHBondContact O-N 3.04Å; Q318-L321 VanDerWaalsContact O-N 3.17Å; L321-G324 PolarHBondContact O-N 3.14Å; L321-K325 PolarHBondContact O-N 2.88Å
322D76.6Confident74.8Confident69 Ų69110.8 Ų110.837%0.36953%0.529SS..Hα-helixtrans-72.8-36178.7-68.1-30.7000112.7Q318 M319 G324 K325 L326Q318-D322 PolarHBondContact O-N 3.2Å; M319-D322 PolarHBondContact O-N 2.92Å; D322-G324 VanDerWaalsContact C-N 3.27Å; D322-G324 PolarHBondContact O-N 3.23Å; D322-K325 PolarHBondContact O-N 3.01Å; D322-K325 IonicContact OD1-NZ 3.91Å; D322-K325 PolarHBondContact OD1-NZ 3.48Å; D322-L326 PolarHBondContact O-N 3.4Å
323L70.2Confident74.2Confident110 Ų110110.7 Ų110.758%0.57653%0.533SS*.Hα-helixtrans-58.2-37.8168.5-93160.8000112.6M319 K325 L326 N327M319-L323 PolarHBondContact O-N 2.94Å; L323-K325 PolarHBondContact O-N 3.43Å; L323-L326 PolarHBondContact O-N 3.39Å; L323-N327 PolarHBondContact O-N 3.09Å; L323-N327 VanDerWaalsContact O-N 3.14Å
324G76.4Confident73.6Confident36 Ų36110.3 Ų110.337%0.37153%0.531SS..Hα-helixtrans-63.5-36.8176.400000113.6R320 L321 D322 N327 K328R320-G324 PolarHBondContact O-N 3.42Å; R320-G324 VanDerWaalsContact O-N 3.17Å; L321-G324 PolarHBondContact O-N 3.14Å; D322-G324 VanDerWaalsContact C-N 3.27Å; D322-G324 PolarHBondContact O-N 3.23Å; G324-N327 PolarHBondContact O-N 3.27Å; G324-K328 PolarHBondContact O-N 2.96Å
325K77.8Confident73Confident124 Ų124113 Ų11354%0.53954%0.538SS..Hα-helixtrans-67.9-42177.6-65.5171.6-169.1154.40111.7L321 D322 L323 N327 K328L321-K325 PolarHBondContact O-N 2.88Å; D322-K325 PolarHBondContact O-N 3.01Å; D322-K325 IonicContact OD1-NZ 3.91Å; D322-K325 PolarHBondContact OD1-NZ 3.48Å; L323-K325 PolarHBondContact O-N 3.43Å; K325-N327 VanDerWaalsContact C-N 3.35Å; K325-N327 PolarHBondContact O-N 3.09Å; K325-K328 PolarHBondContact O-N 2.89Å
326L68.2Low72.2Confident119 Ų119116 Ų11662%0.62355%0.549SS*.Hα-helixtrans-63.9-38.7176.7-74.1168.3000112.2D322 L323 K328 I329 R330D322-L326 PolarHBondContact O-N 3.4Å; L323-L326 PolarHBondContact O-N 3.39Å; L326-K328 VanDerWaalsContact C-N 3.35Å; L326-K328 PolarHBondContact O-N 3.31Å; L326-I329 PolarHBondContact O-N 2.89Å; L326-R330 PolarHBondContact O-N 3.15Å
327N71.8Confident71.4Confident65 Ų65117.4 Ų117.435%0.34856%0.557SS.*Hα-helixtrans-63.3-36.7176.3-91.3-26.5000113.2L323 G324 K325 I329 R330 E331L323-N327 PolarHBondContact O-N 3.09Å; L323-N327 VanDerWaalsContact O-N 3.14Å; G324-N327 PolarHBondContact O-N 3.27Å; K325-N327 VanDerWaalsContact C-N 3.35Å; K325-N327 PolarHBondContact O-N 3.09Å; N327-I329 VanDerWaalsContact C-N 3.33Å; N327-I329 PolarHBondContact O-N 3.31Å; N327-R330 WeakPolarHBondContact O-CB 3.49Å; N327-R330 PolarHBondContact O-N 2.93Å; N327-R330 PolarHBondContact OD1-NH1 3.13Å; N327-R330 VanDerWaalsContact OD1-NH1 3.15Å; N327-R330 PolarHBondContact OD1-NH2 3.46Å; N327-E331 PolarHBondContact O-N 3.09Å; N327-E331 VanDerWaalsContact O-N 3.09Å
328K74.4Confident70.6Confident148 Ų148120.1 Ų120.164%0.64356%0.562SS**Hα-helixtrans-64.6-35.2177.8-76.1-178.2177.2179.60113.1G324 K325 L326 E331 Q332G324-K328 PolarHBondContact O-N 2.96Å; K325-K328 PolarHBondContact O-N 2.89Å; L326-K328 VanDerWaalsContact C-N 3.35Å; L326-K328 PolarHBondContact O-N 3.31Å; K328-E331 PolarHBondContact O-N 3.48Å; K328-Q332 PolarHBondContact O-N 2.9Å
329I72.4Confident69.9Low105 Ų105121.2 Ų121.254%0.53857%0.571SS.*Hα-helixtrans-67.8-40176.4-62.1171.7000110.2L326 N327 E331 Q332L326-I329 PolarHBondContact O-N 2.89Å; N327-I329 VanDerWaalsContact C-N 3.33Å; N327-I329 PolarHBondContact O-N 3.31Å; I329-E331 PolarHBondContact O-N 3Å; I329-Q332 PolarHBondContact O-N 2.96Å
330R66.8Low69.3Low152 Ų152121 Ų12157%0.57457%0.571SS**Hα-helixtrans-61.1-41175.3-169.2-172.771.3-165.9-0.8112.4L326 N327 Q332 I333 H334L326-R330 PolarHBondContact O-N 3.15Å; N327-R330 WeakPolarHBondContact O-CB 3.49Å; N327-R330 PolarHBondContact O-N 2.93Å; N327-R330 PolarHBondContact OD1-NH1 3.13Å; N327-R330 VanDerWaalsContact OD1-NH1 3.15Å; N327-R330 PolarHBondContact OD1-NH2 3.46Å; R330-Q332 PolarHBondContact O-N 3.29Å; R330-I333 PolarHBondContact O-N 2.86Å; R330-H334 PolarHBondContact O-N 3.01Å
331E69.3Low68.3Low105 Ų105116.5 Ų116.549%0.49156%0.56SS.*Hα-helixtrans-65.9-34.4-179.7-76.7177.317600113.5N327 K328 I329 I333 H334 K335N327-E331 PolarHBondContact O-N 3.09Å; N327-E331 VanDerWaalsContact O-N 3.09Å; K328-E331 PolarHBondContact O-N 3.48Å; I329-E331 PolarHBondContact O-N 3Å; E331-I333 VanDerWaalsContact C-N 3.34Å; E331-I333 PolarHBondContact O-N 3.39Å; E331-H334 PolarHBondContact O-N 3.47Å; E331-K335 PolarHBondContact O-N 2.96Å; E331-K335 VanDerWaalsContact O-N 3.1Å
332Q70.8Confident67.5Low140 Ų140116.7 Ų116.765%0.65456%0.562SS**Hα-helixtrans-67.4-34.6178.1-71.9-178-5.800112.5K328 I329 R330K328-Q332 PolarHBondContact O-N 2.9Å; I329-Q332 PolarHBondContact O-N 2.96Å; R330-Q332 PolarHBondContact O-N 3.29Å
333I66.4Low66.6Low122 Ų122120.7 Ų120.763%0.62658%0.579SS**Hα-helixtrans-68.8-39.3174.4-62.2174.5000110.3R330 E331 K335 K336R330-I333 PolarHBondContact O-N 2.86Å; E331-I333 VanDerWaalsContact C-N 3.34Å; E331-I333 PolarHBondContact O-N 3.39Å; I333-K335 PolarHBondContact O-N 3.34Å; I333-K336 PolarHBondContact O-N 2.95Å
334H65.8Low65.9Low112 Ų112122 Ų12252%0.51958%0.579SS.*Hα-helixtrans-64.2-34.5177.1-110.848.3000113.8R330 E331 K336 L337 R338R330-H334 PolarHBondContact O-N 3.01Å; E331-H334 PolarHBondContact O-N 3.47Å; H334-K336 VanDerWaalsContact C-N 3.34Å; H334-K336 PolarHBondContact O-N 3.06Å; H334-L337 PolarHBondContact O-N 3.36Å; H334-R338 PolarHBondContact O-N 2.92Å
335K65.9Low65.3Low156 Ų156123.3 Ų123.368%0.67858%0.577SS**Hα-helixtrans-65-33.2179.2-77.1-178.2179-177.90113.6E331 I333 L337E331-K335 PolarHBondContact O-N 2.96Å; E331-K335 VanDerWaalsContact O-N 3.1Å; I333-K335 PolarHBondContact O-N 3.34Å; K335-L337 VanDerWaalsContact C-N 3.34Å
336K60.9Low64.4Low177 Ų177123.4 Ų123.477%0.7758%0.58SS**Hα-helixtrans-71.7-28.9176.5-76.4-174.1176.2-177.20113I333 H334I333-K336 PolarHBondContact O-N 2.95Å; H334-K336 VanDerWaalsContact C-N 3.34Å; H334-K336 PolarHBondContact O-N 3.06Å
337L58.5Low63.9Low117 Ų117123.1 Ų123.161%0.61358%0.583SS**Hα-helixtrans-72.4-41.3176.6-147.486.1000111.4H334 K335 L339 I340H334-L337 PolarHBondContact O-N 3.36Å; K335-L337 VanDerWaalsContact C-N 3.34Å; L337-L339 PolarHBondContact O-N 3.34Å; L337-I340 PolarHBondContact O-N 3.02Å
338R63.6Low63.2Low166 Ų166125.8 Ų125.863%0.62659%0.593SS**Hα-helixtrans-62.4-35.2-179.4-78.8-172.4178.2-179.2-1.3114.4H334 I340 D341 D342H334-R338 PolarHBondContact O-N 2.92Å; R338-I340 PolarHBondContact O-N 2.85Å; R338-D341 PolarHBondContact O-N 3.42Å; R338-D341 VanDerWaalsContact O-N 3.1Å; R338-D342 PolarHBondContact O-N 2.88Å
339L64.4Low62.6Low125 Ų125124.1 Ų124.165%0.65459%0.588SS**Hα-helixtrans-61-28.9-179.2-164.676.4000113L337L337-L339 PolarHBondContact O-N 3.34Å
340I60.2Low62Low131 Ų131125.8 Ų125.867%0.67259%0.593SS**Hα-helixtrans-82-33.4178.4-63.2176.2000110.9L337 R338L337-I340 PolarHBondContact O-N 3.02Å; R338-I340 PolarHBondContact O-N 2.85Å
341D56.6Low61.5Low82 Ų82126.9 Ų126.944%0.43960%0.602SS.*Hα-helixtrans-73.9-34.5176-84.1-28.2000112.6R338 Q343 K344 I345R338-D341 PolarHBondContact O-N 3.42Å; R338-D341 VanDerWaalsContact O-N 3.1Å; D341-Q343 VanDerWaalsContact C-N 3.31Å; D341-Q343 PolarHBondContact O-N 3.28Å; D341-K344 WeakPolarHBondContact O-CB 3.47Å; D341-K344 PolarHBondContact O-N 2.95Å; D341-I345 HydrophobicContact CB-CD1 4.36Å; D341-I345 WeakPolarHBondContact O-CG1 3.49Å; D341-I345 PolarHBondContact O-N 3.32Å; D341-I345 VanDerWaalsContact O-N 3.09Å
342D61Low61.2Low90 Ų90126.8 Ų126.848%0.48160%0.602SS.*Hα-helixtrans-63-34.4-177.2-70.1-26.3000112.5R338 K344 I345 E346R338-D342 PolarHBondContact O-N 2.88Å; D342-K344 VanDerWaalsContact C-N 3.27Å; D342-K344 PolarHBondContact O-N 2.96Å; D342-I345 PolarHBondContact O-N 2.95Å; D342-E346 PolarHBondContact O-N 3.37Å
343Q57Low60.9Low153 Ų153123.6 Ų123.672%0.71559%0.591SS**Hα-helixtrans-68.8-23.9176.3-69.8-176.2-16.300113.4D341D341-Q343 VanDerWaalsContact C-N 3.31Å; D341-Q343 PolarHBondContact O-N 3.28Å
344K56.5Low60.5Low137 Ų137123.3 Ų123.360%0.59659%0.591SS**Hα-helixtrans-83.6-37175.8-171.6-174170.8-167.90111.2D341 D342D341-K344 WeakPolarHBondContact O-CB 3.47Å; D341-K344 PolarHBondContact O-N 2.95Å; D342-K344 VanDerWaalsContact C-N 3.27Å; D342-K344 PolarHBondContact O-N 2.96Å
345I62.1Low60.4Low64 Ų64125.1 Ų125.133%0.32860%0.597SS.*Hα-helixtrans-71.7-31.6-176.8-69.4168000111.9D341 D342 V347 E348 Q349D341-I345 HydrophobicContact CB-CD1 4.36Å; D341-I345 WeakPolarHBondContact O-CG1 3.49Å; D341-I345 PolarHBondContact O-N 3.32Å; D341-I345 VanDerWaalsContact O-N 3.09Å; D342-I345 PolarHBondContact O-N 2.95Å; I345-V347 VanDerWaalsContact C-N 3.26Å; I345-V347 PolarHBondContact O-N 2.84Å; I345-E348 PolarHBondContact O-N 3.31Å; I345-E348 VanDerWaalsContact O-N 3.11Å; I345-Q349 VanDerWaalsContact CG2-CD 3.5Å; I345-Q349 HydrophobicContact CG2-CG 3.69Å; I345-Q349 WeakPolarHBondContact O-CB 3.28Å; I345-Q349 WeakPolarHBondContact O-CG 3.39Å; I345-Q349 PolarHBondContact O-N 3.03Å
346E59.4Low60.4Low125 Ų125121.9 Ų121.958%0.58459%0.587SS**Hα-helixtrans-61.5-33.2-178.5-158.5172.8-163.300113D342D342-E346 PolarHBondContact O-N 3.37Å
347V57.2Low60.9Low113 Ų113119.1 Ų119.169%0.68558%0.577SS**Hα-helixtrans-76.4-30.5176.8177.50000112.2I345I345-V347 VanDerWaalsContact C-N 3.26Å; I345-V347 PolarHBondContact O-N 2.84Å
348E57.7Low61.3Low121 Ų121119 Ų11957%0.56558%0.576SS**Hα-helixtrans-82.6-31176.9-73.7175.9164.400112.2I345 Q350 K351 E352I345-E348 PolarHBondContact O-N 3.31Å; I345-E348 VanDerWaalsContact O-N 3.11Å; E348-Q350 PolarHBondContact O-N 2.88Å; E348-K351 PolarHBondContact O-N 3.47Å; E348-E352 PolarHBondContact O-N 2.85Å
349Q62Low61.7Low114 Ų114115 Ų11553%0.53357%0.566SS.*Hα-helixtrans-65.5-37.4-179.4-83.2-179.4-100113.5I345 K351 E352 T353I345-Q349 VanDerWaalsContact CG2-CD 3.5Å; I345-Q349 HydrophobicContact CG2-CG 3.69Å; I345-Q349 WeakPolarHBondContact O-CB 3.28Å; I345-Q349 WeakPolarHBondContact O-CG 3.39Å; I345-Q349 PolarHBondContact O-N 3.03Å; Q349-K351 PolarHBondContact O-N 2.89Å; Q349-E352 PolarHBondContact O-N 2.96Å; Q349-E352 VanDerWaalsContact O-N 3.16Å; Q349-T353 PolarHBondContact O-N 3.25Å; Q349-T353 PolarHBondContact O-OG1 3.25Å
350Q59.1Low62.2Low139 Ų139110.3 Ų110.365%0.6555%0.549SS*.Hα-helixtrans-61.5-31.4179.4-68.7-178.22.200112.5E348 T353E348-Q350 PolarHBondContact O-N 2.88Å; Q350-T353 WeakPolarHBondContact CA-OG1 3.44Å; Q350-T353 PolarHBondContact O-OG1 3.01Å
351K57.8Low62.7Low175 Ų175109.4 Ų109.476%0.76155%0.545SS*.Hα-helixtrans-77.7-35.7177.2-171.6-179.3173.8-175.30112.4E348 Q349E348-K351 PolarHBondContact O-N 3.47Å; Q349-K351 PolarHBondContact O-N 2.89Å
352E62.2Low63.5Low104 Ų104111.6 Ų111.649%0.48655%0.552SS.*Hα-helixtrans-79.4-31.7179-152.373.9-165.200112.2E348 Q349 L354 K355 N356E348-E352 PolarHBondContact O-N 2.85Å; Q349-E352 PolarHBondContact O-N 2.96Å; Q349-E352 VanDerWaalsContact O-N 3.16Å; E352-L354 PolarHBondContact O-N 3.01Å; E352-K355 PolarHBondContact O-N 3.31Å; E352-K355 VanDerWaalsContact O-N 3.13Å; E352-N356 WeakPolarHBondContact O-CB 3.05Å; E352-N356 PolarHBondContact O-N 3.45Å; E352-N356 PolarHBondContact O-ND2 3.26Å
353T65.6Low64.2Low72 Ų72116 Ų11644%0.44256%0.562SS.*Hα-helixtrans-59.1-43179.531.30000112.9Q349 Q350 K355 N356 Q357Q349-T353 PolarHBondContact O-N 3.25Å; Q349-T353 PolarHBondContact O-OG1 3.25Å; Q350-T353 WeakPolarHBondContact CA-OG1 3.44Å; Q350-T353 PolarHBondContact O-OG1 3.01Å; T353-K355 VanDerWaalsContact C-N 3.27Å; T353-K355 PolarHBondContact O-N 3.48Å; T353-N356 PolarHBondContact O-N 3.3Å; T353-Q357 VanDerWaalsContact O-CG 3.28Å; T353-Q357 WeakPolarHBondContact O-CG 3.38Å; T353-Q357 PolarHBondContact O-N 3.49Å
354L56.4Low65.1Low117 Ų117114.9 Ų114.961%0.61356%0.557SS**Hα-helixtrans-69.3-27.8179.5-73.1168.3000112.2E352E352-L354 PolarHBondContact O-N 3.01Å
355K63.9Low66.1Low149 Ų149112.6 Ų112.665%0.64855%0.554SS**Hα-helixtrans-78.3-37.6175.6-126.8180-179.5-175.20112.2E352 T353 L359E352-K355 PolarHBondContact O-N 3.31Å; E352-K355 VanDerWaalsContact O-N 3.13Å; T353-K355 VanDerWaalsContact C-N 3.27Å; T353-K355 PolarHBondContact O-N 3.48Å; K355-L359 PolarHBondContact O-N 3.06Å
356N66.7Low67Low88 Ų88114.7 Ų114.747%0.47156%0.562SS.*Hα-helixtrans-75.2-28.4179-75.1-29.6000113.4E352 T353 I358 L359 G360E352-N356 WeakPolarHBondContact O-CB 3.05Å; E352-N356 PolarHBondContact O-N 3.45Å; E352-N356 PolarHBondContact O-ND2 3.26Å; T353-N356 PolarHBondContact O-N 3.3Å; N356-I358 VanDerWaalsContact C-N 3.31Å; N356-I358 PolarHBondContact O-N 3.28Å; N356-L359 PolarHBondContact O-N 3.45Å; N356-G360 PolarHBondContact O-N 3.11Å
357Q70.5Confident68Low119 Ų119112.3 Ų112.356%0.55656%0.56SS**Hα-helixtrans-62.2-38.5174.5-78.4172.2-3.400112.2T353 G360 L361T353-Q357 VanDerWaalsContact O-CG 3.28Å; T353-Q357 WeakPolarHBondContact O-CG 3.38Å; T353-Q357 PolarHBondContact O-N 3.49Å; Q357-G360 PolarHBondContact O-N 2.83Å; Q357-L361 WeakPolarHBondContact O-CG 3.41Å; Q357-L361 PolarHBondContact O-N 3.49Å
358I66.8Low69.1Low115 Ų115110.8 Ų110.859%0.5955%0.554SS**Hα-helixtrans-69.4-46178.1-62.8175000110.7N356 G360 L361 E362N356-I358 VanDerWaalsContact C-N 3.31Å; N356-I358 PolarHBondContact O-N 3.28Å; I358-G360 VanDerWaalsContact C-N 3.32Å; I358-G360 PolarHBondContact O-N 3.49Å; I358-L361 PolarHBondContact O-N 3.28Å; I358-E362 PolarHBondContact O-N 3.42Å
359L72.1Confident70.3Confident81 Ų81111.1 Ų111.142%0.42455%0.554SS.*Hα-helixtrans-67.1-29.8176.1-90.3161.2000113.5K355 N356 R363K355-L359 PolarHBondContact O-N 3.06Å; N356-L359 PolarHBondContact O-N 3.45Å; L359-R363 WeakPolarHBondContact O-CG 3.38Å; L359-R363 PolarHBondContact O-N 2.93Å
360G75.1Confident71.3Confident28 Ų28111.9 Ų111.929%0.28956%0.555SS.*Hα-helixtrans-66.3-47.1176.900000112N356 Q357 I358 E362 R363 E364N356-G360 PolarHBondContact O-N 3.11Å; Q357-G360 PolarHBondContact O-N 2.83Å; I358-G360 VanDerWaalsContact C-N 3.32Å; I358-G360 PolarHBondContact O-N 3.49Å; G360-E362 VanDerWaalsContact C-N 3.34Å; G360-E362 PolarHBondContact O-N 3.46Å; G360-R363 PolarHBondContact O-N 3.44Å; G360-R363 VanDerWaalsContact O-N 3.14Å; G360-E364 WeakPolarHBondContact O-CG 3.42Å; G360-E364 PolarHBondContact O-N 2.91Å
361L71.9Confident72.5Confident112 Ų112109.9 Ų109.959%0.58655%0.546SS*.Hα-helixtrans-64-37.5179.6-70.9170.8000112.3Q357 I358 R363 E364 V365Q357-L361 WeakPolarHBondContact O-CG 3.41Å; Q357-L361 PolarHBondContact O-N 3.49Å; I358-L361 PolarHBondContact O-N 3.28Å; L361-R363 VanDerWaalsContact C-N 3.34Å; L361-R363 PolarHBondContact O-N 3.12Å; L361-E364 PolarHBondContact O-N 3.27Å; L361-V365 WeakPolarHBondContact O-CG2 3.45Å; L361-V365 PolarHBondContact O-N 2.86Å; L361-V365 VanDerWaalsContact O-N 3.14Å
362E72.7Confident73.7Confident128 Ų128104.2 Ų104.260%0.59853%0.532SS*.Hα-helixtrans-65-37.8174.3-69.5-178.8158.400112.2I358 G360 E366I358-E362 PolarHBondContact O-N 3.42Å; G360-E362 VanDerWaalsContact C-N 3.34Å; G360-E362 PolarHBondContact O-N 3.46Å; E362-E366 PolarHBondContact O-N 3.21Å
363R74.7Confident74.8Confident181 Ų181105.3 Ų105.368%0.68354%0.537SS*.Hα-helixtrans-71.1-35.4175.7-74.2176.6179.6171.52.1112.9L359 G360 L361 E366 S367L359-R363 WeakPolarHBondContact O-CG 3.38Å; L359-R363 PolarHBondContact O-N 2.93Å; G360-R363 PolarHBondContact O-N 3.44Å; G360-R363 VanDerWaalsContact O-N 3.14Å; L361-R363 VanDerWaalsContact C-N 3.34Å; L361-R363 PolarHBondContact O-N 3.12Å; R363-E366 PolarHBondContact O-N 2.96Å; R363-S367 WeakPolarHBondContact O-CB 3.45Å; R363-S367 PolarHBondContact O-N 3.41Å
364E75.8Confident75.7Confident131 Ų131106.6 Ų106.661%0.61254%0.54SS*.Hα-helixtrans-65-40.3176.1-77.5-179.6178.400111.7G360 L361 S367 S368G360-E364 WeakPolarHBondContact O-CG 3.42Å; G360-E364 PolarHBondContact O-N 2.91Å; L361-E364 PolarHBondContact O-N 3.27Å; E364-S367 PolarHBondContact O-N 3.07Å; E364-S368 WeakPolarHBondContact O-CB 3.49Å; E364-S368 PolarHBondContact O-N 3Å
365V78.9Confident77.1Confident88 Ų88104.7 Ų104.753%0.53353%0.531SS..Hα-helixtrans-63.7-43.3175173.20000111.4L361 S368 K369L361-V365 WeakPolarHBondContact O-CG2 3.45Å; L361-V365 PolarHBondContact O-N 2.86Å; L361-V365 VanDerWaalsContact O-N 3.14Å; V365-S368 PolarHBondContact O-N 3.39Å; V365-K369 PolarHBondContact O-N 2.91Å; V365-K369 VanDerWaalsContact O-N 3.1Å
366E80.7Confident78.2Confident108 Ų108104 Ų10451%0.50553%0.528SS..Hα-helixtrans-67.9-38.9177.8-163.265.8-158.400112E362 R363 K369 K370E362-E366 PolarHBondContact O-N 3.21Å; R363-E366 PolarHBondContact O-N 2.96Å; E366-K369 PolarHBondContact O-N 2.96Å; E366-K370 PolarHBondContact O-N 3Å; E366-K370 VanDerWaalsContact O-N 3.08Å
367S80Confident79.1Confident76 Ų76105.8 Ų105.853%0.53153%0.532SS..Hα-helixtrans-62-46.4173.7174.20000111.7R363 E364 K369 K370 Q371R363-S367 WeakPolarHBondContact O-CB 3.45Å; R363-S367 PolarHBondContact O-N 3.41Å; E364-S367 PolarHBondContact O-N 3.07Å; S367-K369 VanDerWaalsContact C-N 3.31Å; S367-K369 PolarHBondContact O-N 3.16Å; S367-K370 PolarHBondContact O-N 3.43Å; S367-Q371 PolarHBondContact O-N 3.01Å
368S81.2Confident79.8Confident80 Ų80102.1 Ų102.156%0.55952%0.522SS*.Hα-helixtrans-64.4-35.5179.3-1710000112.1E364 V365 Q371 A372E364-S368 WeakPolarHBondContact O-CB 3.49Å; E364-S368 PolarHBondContact O-N 3Å; V365-S368 PolarHBondContact O-N 3.39Å; S368-Q371 PolarHBondContact O-N 2.95Å; S368-A372 WeakPolarHBondContact O-CB 3.44Å; S368-A372 PolarHBondContact O-N 3.2Å
369K81.3Confident80.6Confident128 Ų128102.8 Ų102.856%0.55752%0.524SS*.Hα-helixtrans-64.7-45.3172.4-79.7-178.3178.8174.30112V365 E366 S367 Q371 A372 E373V365-K369 PolarHBondContact O-N 2.91Å; V365-K369 VanDerWaalsContact O-N 3.1Å; E366-K369 PolarHBondContact O-N 2.96Å; S367-K369 VanDerWaalsContact C-N 3.31Å; S367-K369 PolarHBondContact O-N 3.16Å; K369-Q371 VanDerWaalsContact C-N 3.32Å; K369-Q371 PolarHBondContact O-N 3.37Å; K369-A372 PolarHBondContact O-N 2.98Å; K369-E373 PolarHBondContact O-N 3.18Å
370K83.1Confident81.3Confident131 Ų131103.2 Ų103.257%0.5752%0.524SS*.Hα-helixtrans-61.3-40.6175.4-78.9-177.1178.2177.80112.2E366 S367 E373 L374E366-K370 PolarHBondContact O-N 3Å; E366-K370 VanDerWaalsContact O-N 3.08Å; S367-K370 PolarHBondContact O-N 3.43Å; K370-E373 PolarHBondContact O-N 2.95Å; K370-L374 WeakPolarHBondContact O-CG 3.43Å; K370-L374 PolarHBondContact O-N 2.99Å
371Q84.8Confident81.7Confident96 Ų96107.7 Ų107.745%0.44954%0.537SS..Hα-helixtrans-63.7-43.8176.6-17059.543.900111.3S367 S368 K369 E373 L374 D375S367-Q371 PolarHBondContact O-N 3.01Å; S368-Q371 PolarHBondContact O-N 2.95Å; K369-Q371 VanDerWaalsContact C-N 3.32Å; K369-Q371 PolarHBondContact O-N 3.37Å; Q371-E373 VanDerWaalsContact C-N 3.3Å; Q371-E373 PolarHBondContact O-N 3.1Å; Q371-L374 WeakPolarHBondContact O-CB 3.22Å; Q371-L374 PolarHBondContact O-N 3Å; Q371-L374 VanDerWaalsContact O-N 3.12Å; Q371-D375 PolarHBondContact NE2-OD1 3.45Å; Q371-D375 VanDerWaalsContact O-CG 3.24Å; Q371-D375 PolarHBondContact O-N 3.26Å
372A84.1Confident82.3Confident57 Ų57107.5 Ų107.547%0.47154%0.536SS..Hα-helixtrans-62.1-35.7176.500000113S368 K369 K376S368-A372 WeakPolarHBondContact O-CB 3.44Å; S368-A372 PolarHBondContact O-N 3.2Å; K369-A372 PolarHBondContact O-N 2.98Å; A372-K376 WeakPolarHBondContact O-CB 3.32Å; A372-K376 PolarHBondContact O-N 3.21Å
373E84.7Confident82.8Confident127 Ų127105.9 Ų105.959%0.59353%0.531SS*.Hα-helixtrans-68.3-37.8173.1-73.6-174.2173.400112.8K369 K370 Q371 K377K369-E373 PolarHBondContact O-N 3.18Å; K370-E373 PolarHBondContact O-N 2.95Å; Q371-E373 VanDerWaalsContact C-N 3.3Å; Q371-E373 PolarHBondContact O-N 3.1Å; E373-K377 WeakPolarHBondContact O-CG 3.27Å; E373-K377 PolarHBondContact O-N 2.96Å; E373-K377 VanDerWaalsContact O-N 3.1Å
374L85.3Confident83.3Confident98 Ų98105.2 Ų105.251%0.51353%0.528SS..Hα-helixtrans-66.2-44.9174.6-72.5172.7000111.4K370 Q371 K376 K377 A378K370-L374 WeakPolarHBondContact O-CG 3.43Å; K370-L374 PolarHBondContact O-N 2.99Å; Q371-L374 WeakPolarHBondContact O-CB 3.22Å; Q371-L374 PolarHBondContact O-N 3Å; Q371-L374 VanDerWaalsContact O-N 3.12Å; L374-K376 VanDerWaalsContact C-N 3.29Å; L374-K376 PolarHBondContact O-N 3.46Å; L374-K377 PolarHBondContact O-N 2.89Å; L374-K377 VanDerWaalsContact O-N 3.16Å; L374-A378 PolarHBondContact O-N 3.48Å
375D85.7Confident83.8Confident77 Ų77104.5 Ų104.541%0.41253%0.525SS..Hα-helixtrans-63-38.1178.1-65.4-15.4000111Q371 A378 M379Q371-D375 PolarHBondContact NE2-OD1 3.45Å; Q371-D375 VanDerWaalsContact O-CG 3.24Å; Q371-D375 PolarHBondContact O-N 3.26Å; D375-A378 PolarHBondContact O-N 3.33Å; D375-M379 WeakPolarHBondContact O-CG 3.37Å; D375-M379 PolarHBondContact O-N 3.03Å
376K86.4Confident84.2Confident134 Ų134107.3 Ų107.358%0.58353%0.526SS*.Hα-helixtrans-62.9-43.7173.9-172.3-179.5176.7-175.70111.9A372 L374 M379 E380A372-K376 WeakPolarHBondContact O-CB 3.32Å; A372-K376 PolarHBondContact O-N 3.21Å; L374-K376 VanDerWaalsContact C-N 3.29Å; L374-K376 PolarHBondContact O-N 3.46Å; K376-M379 PolarHBondContact O-N 3.42Å; K376-E380 WeakPolarHBondContact CE-OE1 3.46Å; K376-E380 WeakPolarHBondContact O-CG 3.46Å; K376-E380 PolarHBondContact O-N 2.89Å
377K85.7Confident84.6Confident127 Ų127105.6 Ų105.655%0.55252%0.52SS*.Hα-helixtrans-63-43174.8-74.1177.8-178.9175.60111.7E373 L374 M379 E380 E381E373-K377 WeakPolarHBondContact O-CG 3.27Å; E373-K377 PolarHBondContact O-N 2.96Å; E373-K377 VanDerWaalsContact O-N 3.1Å; L374-K377 PolarHBondContact O-N 2.89Å; L374-K377 VanDerWaalsContact O-N 3.16Å; K377-M379 VanDerWaalsContact C-N 3.34Å; K377-M379 PolarHBondContact O-N 3.38Å; K377-E380 PolarHBondContact O-N 2.64Å; K377-E381 WeakPolarHBondContact O-CG 3.45Å; K377-E381 PolarHBondContact O-N 3.13Å
378A84.5Confident85Confident42 Ų42106.7 Ų106.735%0.34752%0.52SS..Hα-helixtrans-62.1-40.5176.400000111.9L374 D375 E381 L382L374-A378 PolarHBondContact O-N 3.48Å; D375-A378 PolarHBondContact O-N 3.33Å; A378-E381 PolarHBondContact O-N 3.39Å; A378-L382 WeakPolarHBondContact O-CB 3.44Å; A378-L382 VanDerWaalsContact O-CG 3.27Å; A378-L382 WeakPolarHBondContact O-CG 3.46Å; A378-L382 PolarHBondContact O-N 2.98Å
379M83.6Confident85.2Confident128 Ų128108.5 Ų108.563%0.63152%0.522SS*.Hα-helixtrans-63.8-41.3173.5-75.2-171.6-166.500112.4D375 K376 K377 E381 L382 L383D375-M379 WeakPolarHBondContact O-CG 3.37Å; D375-M379 PolarHBondContact O-N 3.03Å; K376-M379 PolarHBondContact O-N 3.42Å; K377-M379 VanDerWaalsContact C-N 3.34Å; K377-M379 PolarHBondContact O-N 3.38Å; M379-E381 VanDerWaalsContact C-N 3.35Å; M379-L382 PolarHBondContact O-N 2.9Å; M379-L383 WeakPolarHBondContact O-CB 3.39Å; M379-L383 WeakPolarHBondContact O-CG 3.28Å; M379-L383 PolarHBondContact O-N 3.34Å
380E87.1Confident85.5Confident91 Ų91106 Ų10643%0.42552%0.515SS..Hα-helixtrans-64.6-38.4176.1-73.4176.6-167.200112.1K376 K377 R384K376-E380 WeakPolarHBondContact CE-OE1 3.46Å; K376-E380 WeakPolarHBondContact O-CG 3.46Å; K376-E380 PolarHBondContact O-N 2.89Å; K377-E380 PolarHBondContact O-N 2.64Å; E380-R384 WeakPolarHBondContact O-CG 3.41Å; E380-R384 PolarHBondContact O-N 2.93Å; E380-R384 VanDerWaalsContact O-N 3.14Å
381E84Confident85.8Confident121 Ų121106.8 Ų106.857%0.56552%0.518SS*.Hα-helixtrans-66.1-46.9174.1-74.8178.617100111.9K377 A378 M379 L383 R384 E385K377-E381 WeakPolarHBondContact O-CG 3.45Å; K377-E381 PolarHBondContact O-N 3.13Å; A378-E381 PolarHBondContact O-N 3.39Å; M379-E381 VanDerWaalsContact C-N 3.35Å; E381-L383 VanDerWaalsContact C-N 3.3Å; E381-L383 PolarHBondContact O-N 2.94Å; E381-R384 WeakPolarHBondContact O-CB 3.41Å; E381-R384 PolarHBondContact O-N 3.04Å; E381-R384 VanDerWaalsContact O-N 3.08Å; E381-E385 PolarHBondContact O-N 3.42Å
382L83.4Confident86Confident109 Ų109106.2 Ų106.257%0.57152%0.518SS*.Hα-helixtrans-61.9-36.4176.9-73.3171.1000112.5A378 M379 E385 R386A378-L382 WeakPolarHBondContact O-CB 3.44Å; A378-L382 VanDerWaalsContact O-CG 3.27Å; A378-L382 WeakPolarHBondContact O-CG 3.46Å; A378-L382 PolarHBondContact O-N 2.98Å; M379-L382 PolarHBondContact O-N 2.9Å; L382-E385 PolarHBondContact O-N 3.37Å; L382-R386 WeakPolarHBondContact O-CB 3.38Å; L382-R386 PolarHBondContact O-N 3.29Å
383L84.1Confident86.3Confident94 Ų94108.5 Ų108.549%0.49252%0.52SS..Hα-helixtrans-64.7-40.9173.4-77.4170.8000111.8M379 E381 R386 D387M379-L383 WeakPolarHBondContact O-CB 3.39Å; M379-L383 WeakPolarHBondContact O-CG 3.28Å; M379-L383 PolarHBondContact O-N 3.34Å; E381-L383 VanDerWaalsContact C-N 3.3Å; E381-L383 PolarHBondContact O-N 2.94Å; L383-R386 PolarHBondContact O-N 3.22Å; L383-D387 PolarHBondContact O-N 3.03Å
384R85.7Confident86.5Confident166 Ų166107.4 Ų107.463%0.62652%0.518SS*.Hα-helixtrans-65-43.9174.5-74.3179.3-175.7160.75.6111.9E380 E381 D387 I388E380-R384 WeakPolarHBondContact O-CG 3.41Å; E380-R384 PolarHBondContact O-N 2.93Å; E380-R384 VanDerWaalsContact O-N 3.14Å; E381-R384 WeakPolarHBondContact O-CB 3.41Å; E381-R384 PolarHBondContact O-N 3.04Å; E381-R384 VanDerWaalsContact O-N 3.08Å; R384-D387 PolarHBondContact O-N 3.47Å; R384-I388 VanDerWaalsContact O-CG1 3.27Å; R384-I388 WeakPolarHBondContact O-CG1 3.42Å; R384-I388 PolarHBondContact O-N 3.39Å
385E84.7Confident86.7Confident117 Ų117109.5 Ų109.555%0.54752%0.523SS..Hα-helixtrans-61.3-44.7177-74.4-173.4168.900111.6E381 L382 D387 I388 L389E381-E385 PolarHBondContact O-N 3.42Å; L382-E385 PolarHBondContact O-N 3.37Å; E385-D387 VanDerWaalsContact C-N 3.32Å; E385-D387 PolarHBondContact O-N 3.41Å; E385-I388 PolarHBondContact O-N 3.25Å; E385-L389 WeakPolarHBondContact O-CB 3.46Å; E385-L389 WeakPolarHBondContact O-CG 3.49Å; E385-L389 PolarHBondContact O-N 3.49Å
386R88.2Confident86.7Confident147 Ų147108.3 Ų108.356%0.55552%0.524SS*.Hα-helixtrans-55.7-45.9173.6-173.4-150.275.6173.52.9111.6L382 L383 L389 N390L382-R386 WeakPolarHBondContact O-CB 3.38Å; L382-R386 PolarHBondContact O-N 3.29Å; L383-R386 PolarHBondContact O-N 3.22Å; R386-L389 PolarHBondContact O-N 3.18Å; R386-N390 VanDerWaalsContact O-CB 3.32Å; R386-N390 WeakPolarHBondContact O-CB 3.49Å; R386-N390 PolarHBondContact O-N 3.44Å
387D88.8Confident86.8Confident71 Ų71106.2 Ų106.238%0.3852%0.523SS..Hα-helixtrans-68.4-37-178.8-73.5-14000112.8L383 R384 E385 K391L383-D387 PolarHBondContact O-N 3.03Å; R384-D387 PolarHBondContact O-N 3.47Å; E385-D387 VanDerWaalsContact C-N 3.32Å; E385-D387 PolarHBondContact O-N 3.41Å; D387-K391 WeakPolarHBondContact O-CG 3.36Å; D387-K391 PolarHBondContact O-N 2.86Å
388I87.9Confident86.9Confident100 Ų100103.1 Ų103.151%0.51352%0.517SS..Hα-helixtrans-66.4-46.8174.1-67.9165.4000110.2R384 E385 N390 K391 N392R384-I388 VanDerWaalsContact O-CG1 3.27Å; R384-I388 WeakPolarHBondContact O-CG1 3.42Å; R384-I388 PolarHBondContact O-N 3.39Å; E385-I388 PolarHBondContact O-N 3.25Å; I388-N390 VanDerWaalsContact C-N 3.33Å; I388-N390 PolarHBondContact O-N 3.43Å; I388-K391 PolarHBondContact O-N 3.43Å; I388-N392 PolarHBondContact O-N 3.48Å
389L85.3Confident87.2Confident117 Ų117103.9 Ų103.961%0.61352%0.523SS*.Hα-helixtrans-59.7-43.2176.5-78.7166.3000111.5E385 R386 K391 N392 M393E385-L389 WeakPolarHBondContact O-CB 3.46Å; E385-L389 WeakPolarHBondContact O-CG 3.49Å; E385-L389 PolarHBondContact O-N 3.49Å; R386-L389 PolarHBondContact O-N 3.18Å; L389-K391 PolarHBondContact O-N 3.45Å; L389-N392 PolarHBondContact O-N 3.14Å; L389-M393 WeakPolarHBondContact O-CB 3.32Å; L389-M393 PolarHBondContact O-N 2.85Å
390N89.3Confident87.4Confident75 Ų75101.9 Ų101.940%0.40152%0.518SS..Hα-helixtrans-65.2-40.3178.3-160.517.5000111.9R386 I388 N392 M393 L394R386-N390 VanDerWaalsContact O-CB 3.32Å; R386-N390 WeakPolarHBondContact O-CB 3.49Å; R386-N390 PolarHBondContact O-N 3.44Å; I388-N390 VanDerWaalsContact C-N 3.33Å; I388-N390 PolarHBondContact O-N 3.43Å; N390-N392 PolarHBondContact O-N 3.47Å; N390-M393 PolarHBondContact O-N 2.93Å; N390-M393 VanDerWaalsContact OD1-CE 3.27Å; N390-M393 WeakPolarHBondContact OD1-CE 3.29Å; N390-L394 WeakPolarHBondContact O-CG 3.49Å; N390-L394 PolarHBondContact O-N 3.04Å
391K88.7Confident87.5Confident148 Ų148102.1 Ų102.164%0.64352%0.519SS*.Hα-helixtrans-62.4-41.2172-80.6179.5-179.91740112.4D387 I388 L389 L394 K395D387-K391 WeakPolarHBondContact O-CG 3.36Å; D387-K391 PolarHBondContact O-N 2.86Å; I388-K391 PolarHBondContact O-N 3.43Å; L389-K391 PolarHBondContact O-N 3.45Å; K391-L394 PolarHBondContact O-N 2.98Å; K391-K395 WeakPolarHBondContact O-CG 3.49Å; K391-K395 PolarHBondContact O-N 3.46Å
392N88.3Confident87.8Confident85 Ų85103.9 Ų103.946%0.45553%0.525SS..Hα-helixtrans-67.7-39.7178.1-72.5-17.1000111.7I388 L389 N390 K395 A396I388-N392 PolarHBondContact O-N 3.48Å; L389-N392 PolarHBondContact O-N 3.14Å; N390-N392 PolarHBondContact O-N 3.47Å; N392-K395 PolarHBondContact O-N 2.89Å; N392-A396 WeakPolarHBondContact O-CB 3.42Å; N392-A396 PolarHBondContact O-N 3.49Å
393M90.6Very high88Confident104 Ų104104 Ų10451%0.51252%0.523SS..Hα-helixtrans-60-47.8173.3-175.7-172.775.500111.3L389 N390 K395 A396 V397L389-M393 WeakPolarHBondContact O-CB 3.32Å; L389-M393 PolarHBondContact O-N 2.85Å; N390-M393 PolarHBondContact O-N 2.93Å; N390-M393 VanDerWaalsContact OD1-CE 3.27Å; N390-M393 WeakPolarHBondContact OD1-CE 3.29Å; M393-K395 VanDerWaalsContact C-N 3.31Å; M393-K395 PolarHBondContact O-N 2.93Å; M393-A396 PolarHBondContact O-N 3.35Å; M393-A396 VanDerWaalsContact O-N 3.16Å; M393-V397 HydrophobicContact CG-CG2 4.48Å; M393-V397 WeakPolarHBondContact O-CG2 3.3Å; M393-V397 PolarHBondContact O-N 3.38Å
394L88.7Confident88.3Confident105 Ų105102.5 Ų102.555%0.5552%0.517SS..Hα-helixtrans-60.7-39.8177.1-73170.8000112.4N390 K391 S398N390-L394 WeakPolarHBondContact O-CG 3.49Å; N390-L394 PolarHBondContact O-N 3.04Å; K391-L394 PolarHBondContact O-N 2.98Å; L394-S398 WeakPolarHBondContact O-CB 3.46Å; L394-S398 PolarHBondContact O-N 3.49Å
395K89Confident88.5Confident141 Ų14198.2 Ų98.261%0.61351%0.507SS*.Hα-helixtrans-62.1-46.8173.3-75.7179.1-179.7179.50111.4K391 N392 M393 S398 A399K391-K395 WeakPolarHBondContact O-CG 3.49Å; K391-K395 PolarHBondContact O-N 3.46Å; N392-K395 PolarHBondContact O-N 2.89Å; M393-K395 VanDerWaalsContact C-N 3.31Å; M393-K395 PolarHBondContact O-N 2.93Å; K395-S398 PolarHBondContact O-N 2.99Å; K395-S398 PolarHBondContact O-OG 3.24Å; K395-A399 WeakPolarHBondContact O-CB 3.46Å; K395-A399 PolarHBondContact O-N 2.95Å
396A86.4Confident88.7Confident53 Ų5396.6 Ų96.644%0.43850%0.501SS..Hα-helixtrans-62.3-42.1178.600000112.3N392 M393 A399 T400N392-A396 WeakPolarHBondContact O-CB 3.42Å; N392-A396 PolarHBondContact O-N 3.49Å; M393-A396 PolarHBondContact O-N 3.35Å; M393-A396 VanDerWaalsContact O-N 3.16Å; A396-A399 PolarHBondContact O-N 3Å; A396-T400 WeakPolarHBondContact O-CB 3.32Å; A396-T400 PolarHBondContact O-N 3.22Å; A396-T400 PolarHBondContact O-OG1 3.03Å
397V88.7Confident88.7Confident90 Ų9092.6 Ų92.655%0.54549%0.493SS..Hα-helixtrans-61-45.5174.1171.70000110.6M393 A399 T400 Q401M393-V397 HydrophobicContact CG-CG2 4.48Å; M393-V397 WeakPolarHBondContact O-CG2 3.3Å; M393-V397 PolarHBondContact O-N 3.38Å; V397-A399 VanDerWaalsContact C-N 3.35Å; V397-A399 PolarHBondContact O-N 2.95Å; V397-T400 PolarHBondContact O-N 3.38Å; V397-Q401 PolarHBondContact O-N 3.36Å
398S88.8Confident88.8Confident62 Ų6295 Ų9543%0.43450%0.5SS..Hα-helixtrans-64.6-3717878.10000113.2L394 K395 K402L394-S398 WeakPolarHBondContact O-CB 3.46Å; L394-S398 PolarHBondContact O-N 3.49Å; K395-S398 PolarHBondContact O-N 2.99Å; K395-S398 PolarHBondContact O-OG 3.24Å; S398-K402 WeakPolarHBondContact O-CG 3.27Å; S398-K402 PolarHBondContact O-N 3.25Å; S398-K402 VanDerWaalsContact O-N 3.15Å
399A89.5Confident88.8Confident57 Ų5796 Ų9647%0.47151%0.506SS..Hα-helixtrans-69-41176.300000111.2K395 A396 V397 Q401 K402 Q403K395-A399 WeakPolarHBondContact O-CB 3.46Å; K395-A399 PolarHBondContact O-N 2.95Å; A396-A399 PolarHBondContact O-N 3Å; V397-A399 VanDerWaalsContact C-N 3.35Å; V397-A399 PolarHBondContact O-N 2.95Å; A399-Q401 VanDerWaalsContact C-N 3.34Å; A399-K402 PolarHBondContact O-N 3.25Å; A399-Q403 PolarHBondContact O-N 2.92Å
400T87.4Confident88.9Confident86 Ų8696 Ų9653%0.52850%0.503SS..Hα-helixtrans-63.3-41.8175.7-52.80000110.8A396 V397 K402 Q403 V404A396-T400 WeakPolarHBondContact O-CB 3.32Å; A396-T400 PolarHBondContact O-N 3.22Å; A396-T400 PolarHBondContact O-OG1 3.03Å; V397-T400 PolarHBondContact O-N 3.38Å; T400-K402 PolarHBondContact O-N 3.02Å; T400-Q403 WeakPolarHBondContact O-CB 3.3Å; T400-Q403 PolarHBondContact O-N 2.98Å; T400-Q403 VanDerWaalsContact O-N 3.15Å; T400-V404 WeakPolarHBondContact O-CG2 3.47Å; T400-V404 PolarHBondContact O-N 3.28Å
401Q91.1Very high88.9Confident96 Ų9697.4 Ų97.445%0.44951%0.507SS..Hα-helixtrans-61.7-44.3176.7-17358.545.200112.1V397 A399 Q403 V404 D405V397-Q401 PolarHBondContact O-N 3.36Å; A399-Q401 VanDerWaalsContact C-N 3.34Å; Q401-Q403 VanDerWaalsContact C-N 3.27Å; Q401-Q403 PolarHBondContact O-N 3.49Å; Q401-V404 WeakPolarHBondContact O-CB 3.47Å; Q401-V404 PolarHBondContact O-N 3.23Å; Q401-D405 PolarHBondContact NE2-OD1 3.27Å; Q401-D405 VanDerWaalsContact NE2-OD1 3.09Å; Q401-D405 VanDerWaalsContact O-CG 3.32Å; Q401-D405 PolarHBondContact O-N 3.25Å
402K90.1Very high89Confident158 Ų15896.5 Ų96.569%0.68751%0.505SS*.Hα-helixtrans-58.4-40.2173.9-72.6178.9179.8-177.20112.1S398 A399 T400 D405 L406S398-K402 WeakPolarHBondContact O-CG 3.27Å; S398-K402 PolarHBondContact O-N 3.25Å; S398-K402 VanDerWaalsContact O-N 3.15Å; A399-K402 PolarHBondContact O-N 3.25Å; T400-K402 PolarHBondContact O-N 3.02Å; K402-D405 PolarHBondContact O-N 2.92Å; K402-L406 WeakPolarHBondContact O-CB 3.37Å; K402-L406 PolarHBondContact O-N 3.29Å
403Q86.5Confident89Confident113 Ų11394.5 Ų94.553%0.52850%0.5SS..Hα-helixtrans-66.8-40.6177.4-166.86323.700111.7A399 T400 Q401 D405 L406 V407A399-Q403 PolarHBondContact O-N 2.92Å; T400-Q403 WeakPolarHBondContact O-CB 3.3Å; T400-Q403 PolarHBondContact O-N 2.98Å; T400-Q403 VanDerWaalsContact O-N 3.15Å; Q401-Q403 VanDerWaalsContact C-N 3.27Å; Q401-Q403 PolarHBondContact O-N 3.49Å; Q403-D405 VanDerWaalsContact C-N 3.35Å; Q403-L406 PolarHBondContact O-N 3.04Å; Q403-V407 VanDerWaalsContact O-CG2 3.3Å; Q403-V407 WeakPolarHBondContact O-CG2 3.38Å; Q403-V407 PolarHBondContact O-N 3.22Å
404V90.1Very high89Confident61 Ų6195.5 Ų95.537%0.3750%0.501SS..Hα-helixtrans-60.8-43.7174.7169.50000111.3T400 Q401 L406 V407 K408T400-V404 WeakPolarHBondContact O-CG2 3.47Å; T400-V404 PolarHBondContact O-N 3.28Å; Q401-V404 WeakPolarHBondContact O-CB 3.47Å; Q401-V404 PolarHBondContact O-N 3.23Å; V404-L406 VanDerWaalsContact C-N 3.35Å; V404-V407 PolarHBondContact O-N 3.34Å; V404-K408 WeakPolarHBondContact O-CG 3.43Å; V404-K408 PolarHBondContact O-N 3.08Å
405D90.5Very high89.1Confident77 Ų7798.1 Ų98.141%0.41250%0.504SS..Hα-helixtrans-66.9-38179-63.3-27.6000111.6Q401 K402 Q403 K408 L409Q401-D405 PolarHBondContact NE2-OD1 3.27Å; Q401-D405 VanDerWaalsContact NE2-OD1 3.09Å; Q401-D405 VanDerWaalsContact O-CG 3.32Å; Q401-D405 PolarHBondContact O-N 3.25Å; K402-D405 PolarHBondContact O-N 2.92Å; Q403-D405 VanDerWaalsContact C-N 3.35Å; D405-K408 PolarHBondContact O-N 3.05Å; D405-L409 PolarHBondContact O-N 3.12Å; D405-L409 VanDerWaalsContact O-N 3.1Å
406L88.9Confident89Confident82 Ų8295.3 Ų95.343%0.42950%0.496SS..Hα-helixtrans-64.2-41.9174.5-163.175.8000111.9K402 Q403 V404 L409 H410K402-L406 WeakPolarHBondContact O-CB 3.37Å; K402-L406 PolarHBondContact O-N 3.29Å; Q403-L406 PolarHBondContact O-N 3.04Å; V404-L406 VanDerWaalsContact C-N 3.35Å; L406-L409 PolarHBondContact O-N 3.45Å; L406-H410 PolarHBondContact O-CD2 3.1Å; L406-H410 PolarHBondContact O-N 3.1Å
407V88.7Confident89.1Confident64 Ų6497.4 Ų97.439%0.38850%0.499SS..Hα-helixtrans-61.4-44.4175.9169.30000111Q403 V404 L409 H410 E411Q403-V407 VanDerWaalsContact O-CG2 3.3Å; Q403-V407 WeakPolarHBondContact O-CG2 3.38Å; Q403-V407 PolarHBondContact O-N 3.22Å; V404-V407 PolarHBondContact O-N 3.34Å; V407-L409 VanDerWaalsContact C-N 3.29Å; V407-L409 PolarHBondContact O-N 2.94Å; V407-H410 PolarHBondContact O-N 3.11Å; V407-E411 HydrophobicContact CG1-CG 4.45Å; V407-E411 WeakPolarHBondContact O-CG 3.48Å; V407-E411 PolarHBondContact O-N 3.29Å
408K91.3Very high89.2Confident120 Ų12098 Ų9852%0.52250%0.496SS..Hα-helixtrans-59.3-40.6175.5-72.8175.9-179.1173.60112.3V404 D405 E411 Q412V404-K408 WeakPolarHBondContact O-CG 3.43Å; V404-K408 PolarHBondContact O-N 3.08Å; D405-K408 PolarHBondContact O-N 3.05Å; K408-E411 PolarHBondContact O-N 3.36Å; K408-Q412 PolarHBondContact O-N 3.48Å
409L87.4Confident89.2Confident122 Ų122101.2 Ų101.264%0.63950%0.504SS*.Hα-helixtrans-66.7-39.3179.1-151.2139.6000111.3D405 L406 V407 Q412 A413D405-L409 PolarHBondContact O-N 3.12Å; D405-L409 VanDerWaalsContact O-N 3.1Å; L406-L409 PolarHBondContact O-N 3.45Å; V407-L409 VanDerWaalsContact C-N 3.29Å; V407-L409 PolarHBondContact O-N 2.94Å; L409-Q412 PolarHBondContact O-N 3.13Å; L409-A413 PolarHBondContact O-N 3.41Å
410H87.6Confident89.1Confident118 Ų118103.2 Ų103.255%0.54650%0.504SS..Hα-helixtrans-67.4-38.7172.3-73.7-53.5000113.3L406 V407 Q412 A413 K414L406-H410 PolarHBondContact O-CD2 3.1Å; L406-H410 PolarHBondContact O-N 3.1Å; V407-H410 PolarHBondContact O-N 3.11Å; H410-Q412 VanDerWaalsContact C-N 3.31Å; H410-Q412 PolarHBondContact O-N 2.91Å; H410-A413 PolarHBondContact O-N 3.12Å; H410-K414 WeakPolarHBondContact O-CB 3.43Å; H410-K414 PolarHBondContact O-N 3.09Å
411E89.8Confident89.2Confident104 Ų104103.5 Ų103.549%0.48650%0.501SS..Hα-helixtrans-62.5-39.2174.1-76.6-177.7166.800111.8V407 K408 K414 R415V407-E411 HydrophobicContact CG1-CG 4.45Å; V407-E411 WeakPolarHBondContact O-CG 3.48Å; V407-E411 PolarHBondContact O-N 3.29Å; K408-E411 PolarHBondContact O-N 3.36Å; E411-K414 PolarHBondContact O-N 3.07Å; E411-R415 WeakPolarHBondContact O-CG 3.33Å; E411-R415 PolarHBondContact O-N 2.87Å
412Q89.9Confident89.2Confident129 Ų129103.4 Ų103.460%0.60350%0.501SS*.Hα-helixtrans-68.6-42.6176-167.3133.116.900112K408 L409 H410 K414 R415 N416K408-Q412 PolarHBondContact O-N 3.48Å; L409-Q412 PolarHBondContact O-N 3.13Å; H410-Q412 VanDerWaalsContact C-N 3.31Å; H410-Q412 PolarHBondContact O-N 2.91Å; Q412-K414 VanDerWaalsContact C-N 3.31Å; Q412-K414 PolarHBondContact O-N 2.96Å; Q412-R415 PolarHBondContact O-N 3.37Å; Q412-N416 PolarHBondContact O-N 3.31Å; Q412-N416 VanDerWaalsContact O-N 3.12Å; Q412-N416 PolarHBondContact O-OD1 3.39Å
413A88.1Confident89.2Confident43 Ų43100.8 Ų100.836%0.35549%0.494SS..Hα-helixtrans-61.2-40.2173.600000112.1L409 H410 N416 L417L409-A413 PolarHBondContact O-N 3.41Å; H410-A413 PolarHBondContact O-N 3.12Å; A413-N416 PolarHBondContact O-N 3.01Å; A413-L417 WeakPolarHBondContact O-CG 3.34Å; A413-L417 PolarHBondContact O-N 3.45Å; A413-L417 VanDerWaalsContact O-N 3.07Å
414K90Very high89.2Confident124 Ų124103.5 Ų103.554%0.53950%0.501SS..Hα-helixtrans-60.8-45.6175.1179.4-176.7165.9-173.80111.6H410 E411 Q412 N416 L417 E418H410-K414 WeakPolarHBondContact O-CB 3.43Å; H410-K414 PolarHBondContact O-N 3.09Å; E411-K414 PolarHBondContact O-N 3.07Å; Q412-K414 VanDerWaalsContact C-N 3.31Å; Q412-K414 PolarHBondContact O-N 2.96Å; K414-N416 VanDerWaalsContact C-N 3.35Å; K414-N416 PolarHBondContact O-N 3.43Å; K414-L417 PolarHBondContact O-N 3.28Å; K414-E418 WeakPolarHBondContact CE-OE1 3.48Å; K414-E418 HydrophobicContact CG-CG 4.47Å; K414-E418 IonicContact NZ-OE1 2.88Å; K414-E418 WeakPolarHBondContact O-CG 3.31Å; K414-E418 PolarHBondContact O-N 2.85Å
415R91Very high89.1Confident160 Ų160106.6 Ų106.660%0.60451%0.509SS*.Hα-helixtrans-60-43.1177.2-74.9-179.3-173162.25.6112.3E411 Q412 L417 E418 E419E411-R415 WeakPolarHBondContact O-CG 3.33Å; E411-R415 PolarHBondContact O-N 2.87Å; Q412-R415 PolarHBondContact O-N 3.37Å; R415-L417 VanDerWaalsContact C-N 3.35Å; R415-L417 PolarHBondContact O-N 2.85Å; R415-E418 PolarHBondContact O-N 2.96Å; R415-E419 PolarHBondContact O-N 2.98Å
416N88.3Confident89.1Confident83 Ų83106.2 Ų106.244%0.44451%0.507SS..Hα-helixtrans-61.7-43.6177.2-66.4-3.9000111.6Q412 A413 K414 E418 E419 E420Q412-N416 PolarHBondContact O-N 3.31Å; Q412-N416 VanDerWaalsContact O-N 3.12Å; Q412-N416 PolarHBondContact O-OD1 3.39Å; A413-N416 PolarHBondContact O-N 3.01Å; K414-N416 VanDerWaalsContact C-N 3.35Å; K414-N416 PolarHBondContact O-N 3.43Å; N416-E418 VanDerWaalsContact C-N 3.34Å; N416-E418 PolarHBondContact O-N 3.19Å; N416-E419 PolarHBondContact O-N 3.28Å; N416-E420 WeakPolarHBondContact O-CG 3.48Å; N416-E420 PolarHBondContact O-N 3.38Å
417L87.7Confident89Confident97 Ų97106.3 Ų106.351%0.50851%0.505SS..Hα-helixtrans-66-36176.7-70.6170.1000112.4A413 K414 R415 E420 I421A413-L417 WeakPolarHBondContact O-CG 3.34Å; A413-L417 PolarHBondContact O-N 3.45Å; A413-L417 VanDerWaalsContact O-N 3.07Å; K414-L417 PolarHBondContact O-N 3.28Å; R415-L417 VanDerWaalsContact C-N 3.35Å; R415-L417 PolarHBondContact O-N 2.85Å; L417-E420 PolarHBondContact O-N 2.89Å; L417-I421 WeakPolarHBondContact O-CB 3.49Å; L417-I421 WeakPolarHBondContact O-CD1 3.46Å; L417-I421 WeakPolarHBondContact O-CG1 3.39Å; L417-I421 PolarHBondContact O-N 3.48Å
418E89.8Confident88.8Confident102 Ų102105.6 Ų105.648%0.47751%0.507SS..Hα-helixtrans-64.2-40.1174.6-75.3174.5163.100111.8K414 R415 N416 Q422K414-E418 WeakPolarHBondContact CE-OE1 3.48Å; K414-E418 HydrophobicContact CG-CG 4.47Å; K414-E418 IonicContact NZ-OE1 2.88Å; K414-E418 WeakPolarHBondContact O-CG 3.31Å; K414-E418 PolarHBondContact O-N 2.85Å; R415-E418 PolarHBondContact O-N 2.96Å; N416-E418 VanDerWaalsContact C-N 3.34Å; N416-E418 PolarHBondContact O-N 3.19Å; E418-Q422 PolarHBondContact O-N 3.18Å
419E90Very high88.8Confident130 Ų130105.2 Ų105.261%0.60751%0.507SS*.Hα-helixtrans-65.2-43.3172.7-75.7-177.9176.600112.3R415 N416 I421 Q422 N423R415-E419 PolarHBondContact O-N 2.98Å; N416-E419 PolarHBondContact O-N 3.28Å; E419-I421 PolarHBondContact O-N 2.91Å; E419-Q422 PolarHBondContact O-N 3.43Å; E419-N423 VanDerWaalsContact O-CG 3.31Å; E419-N423 PolarHBondContact O-N 2.99Å; E419-N423 PolarHBondContact O-ND2 3.49Å
420E87.7Confident88.9Confident98 Ų98105.4 Ų105.446%0.45850%0.502SS..Hα-helixtrans-60.2-46175-74.3177.2-168.700111.8N416 L417 Q422 N423 Y424N416-E420 WeakPolarHBondContact O-CG 3.48Å; N416-E420 PolarHBondContact O-N 3.38Å; L417-E420 PolarHBondContact O-N 2.89Å; E420-Q422 VanDerWaalsContact C-N 3.28Å; E420-Q422 PolarHBondContact O-N 3.48Å; E420-N423 PolarHBondContact O-N 3.15Å; E420-Y424 HydrophobicContact CB-CE2 4.39Å; E420-Y424 WeakPolarHBondContact O-CD2 3.33Å; E420-Y424 PolarHBondContact O-N 3.16Å
421I88.3Confident88.9Confident93 Ų93104 Ų10448%0.47750%0.496SS..Hα-helixtrans-60.5-39.8176.6-70.7165.9000110.9L417 E419 Y424 K425L417-I421 WeakPolarHBondContact O-CB 3.49Å; L417-I421 WeakPolarHBondContact O-CD1 3.46Å; L417-I421 WeakPolarHBondContact O-CG1 3.39Å; L417-I421 PolarHBondContact O-N 3.48Å; E419-I421 PolarHBondContact O-N 2.91Å; I421-Y424 PolarHBondContact O-N 3.13Å; I421-K425 WeakPolarHBondContact O-CG 3.4Å; I421-K425 PolarHBondContact O-N 3.32Å
422Q91.8Very high88.8Confident93 Ų93108.2 Ų108.244%0.43551%0.508SS..Hα-helixtrans-66.1-43.7177.1-171.956.738.500111.5E418 E419 E420 Y424 K425 D426E418-Q422 PolarHBondContact O-N 3.18Å; E419-Q422 PolarHBondContact O-N 3.43Å; E420-Q422 VanDerWaalsContact C-N 3.28Å; E420-Q422 PolarHBondContact O-N 3.48Å; Q422-Y424 VanDerWaalsContact C-N 3.33Å; Q422-Y424 PolarHBondContact O-N 2.72Å; Q422-K425 WeakPolarHBondContact O-CB 3.42Å; Q422-K425 PolarHBondContact O-N 2.93Å; Q422-K425 VanDerWaalsContact O-N 3.14Å; Q422-D426 PolarHBondContact NE2-OD1 3.41Å; Q422-D426 VanDerWaalsContact NE2-OD1 3.08Å; Q422-D426 PolarHBondContact O-N 2.92Å
423N88.9Confident88.9Confident104 Ų104108.4 Ų108.456%0.55651%0.506SS*.Hα-helixtrans-59.8-42.3175-70.9-29.9000112E419 E420 K425 D426 E427E419-N423 VanDerWaalsContact O-CG 3.31Å; E419-N423 PolarHBondContact O-N 2.99Å; E419-N423 PolarHBondContact O-ND2 3.49Å; E420-N423 PolarHBondContact O-N 3.15Å; N423-K425 PolarHBondContact O-N 3.34Å; N423-D426 PolarHBondContact O-N 2.95Å; N423-E427 PolarHBondContact O-N 3.47Å
424Y88.5Confident88.9Confident170 Ų170110 Ų11067%0.66751%0.508SS*.Hα-helixtrans-65.9-35.3175.5-74.5-58.7000112.9E420 I421 Q422 A428E420-Y424 HydrophobicContact CB-CE2 4.39Å; E420-Y424 WeakPolarHBondContact O-CD2 3.33Å; E420-Y424 PolarHBondContact O-N 3.16Å; I421-Y424 PolarHBondContact O-N 3.13Å; Q422-Y424 VanDerWaalsContact C-N 3.33Å; Q422-Y424 PolarHBondContact O-N 2.72Å; Y424-A428 VanDerWaalsContact O-CB 3.31Å; Y424-A428 WeakPolarHBondContact O-CB 3.2Å; Y424-A428 PolarHBondContact O-N 3.42Å
425K87.6Confident88.8Confident126 Ų126108.4 Ų108.455%0.54850%0.504SS..Hα-helixtrans-64.5-43.7173.5-78.7177.7-178.9174.10111.8I421 Q422 N423 A428 Q429I421-K425 WeakPolarHBondContact O-CG 3.4Å; I421-K425 PolarHBondContact O-N 3.32Å; Q422-K425 WeakPolarHBondContact O-CB 3.42Å; Q422-K425 PolarHBondContact O-N 2.93Å; Q422-K425 VanDerWaalsContact O-N 3.14Å; N423-K425 PolarHBondContact O-N 3.34Å; K425-A428 PolarHBondContact O-N 3.28Å; K425-Q429 WeakPolarHBondContact O-CB 3.44Å; K425-Q429 PolarHBondContact O-N 2.84Å
426D90.3Very high88.8Confident69 Ų69107.1 Ų107.137%0.36950%0.504SS..Hα-helixtrans-65.6-40.3179.3-68.5-11.5000111.2Q422 N423 Q429 K430Q422-D426 PolarHBondContact NE2-OD1 3.41Å; Q422-D426 VanDerWaalsContact NE2-OD1 3.08Å; Q422-D426 PolarHBondContact O-N 2.92Å; N423-D426 PolarHBondContact O-N 2.95Å; D426-Q429 PolarHBondContact O-N 2.94Å; D426-K430 PolarHBondContact O-N 3.46Å
427E85.8Confident88.8Confident83 Ų83109.1 Ų109.139%0.38851%0.51SS..Hα-helixtrans-66.8-43.5175.2-16956.3-148.700111.6N423 Q429 K430 Q431N423-E427 PolarHBondContact O-N 3.47Å; E427-Q429 PolarHBondContact O-N 3.35Å; E427-K430 WeakPolarHBondContact O-CB 3.45Å; E427-K430 PolarHBondContact O-N 2.88Å; E427-K430 VanDerWaalsContact O-N 3.12Å; E427-K430 IonicContact OE2-NZ 3.75Å; E427-Q431 WeakPolarHBondContact O-CG 3.49Å; E427-Q431 PolarHBondContact O-N 3.46Å; E427-Q431 PolarHBondContact OE1-NE2 3.48Å
428A85.6Confident88.7Confident50 Ų50109.3 Ų109.341%0.41351%0.511SS..Hα-helixtrans-59.7-36.6173.700000112.1Y424 K425 R432Y424-A428 VanDerWaalsContact O-CB 3.31Å; Y424-A428 WeakPolarHBondContact O-CB 3.2Å; Y424-A428 PolarHBondContact O-N 3.42Å; K425-A428 PolarHBondContact O-N 3.28Å; A428-R432 WeakPolarHBondContact O-CG 3.48Å; A428-R432 PolarHBondContact O-N 3.35Å
429Q91Very high88.5Confident112 Ų112108.5 Ų108.552%0.52351%0.507SS..Hα-helixtrans-68.8-38.8175.3-165.9179.77.100112.2K425 D426 E427 R432 K433K425-Q429 WeakPolarHBondContact O-CB 3.44Å; K425-Q429 PolarHBondContact O-N 2.84Å; D426-Q429 PolarHBondContact O-N 2.94Å; E427-Q429 PolarHBondContact O-N 3.35Å; Q429-R432 PolarHBondContact O-N 3.43Å; Q429-K433 WeakPolarHBondContact O-CG 3.36Å; Q429-K433 PolarHBondContact O-N 3.34Å; Q429-K433 VanDerWaalsContact O-N 3.16Å
430K89.3Confident88.5Confident125 Ų125109.4 Ų109.454%0.54351%0.509SS..Hα-helixtrans-61.6-48171.7-77.6177.1-177.9168.90111.6D426 E427 R432 K433 I434D426-K430 PolarHBondContact O-N 3.46Å; E427-K430 WeakPolarHBondContact O-CB 3.45Å; E427-K430 PolarHBondContact O-N 2.88Å; E427-K430 VanDerWaalsContact O-N 3.12Å; E427-K430 IonicContact OE2-NZ 3.75Å; K430-R432 VanDerWaalsContact C-N 3.32Å; K430-R432 PolarHBondContact O-N 2.88Å; K430-K433 WeakPolarHBondContact O-CB 3.33Å; K430-K433 PolarHBondContact O-N 3.23Å; K430-I434 PolarHBondContact O-N 3.22Å
431Q87.3Confident88.4Confident90 Ų90109.5 Ų109.542%0.42151%0.51SS..Hα-helixtrans-59.8-41.9178.7-66.2-62-25.600111.5E427 K433 I434 I435E427-Q431 WeakPolarHBondContact O-CG 3.49Å; E427-Q431 PolarHBondContact O-N 3.46Å; E427-Q431 PolarHBondContact OE1-NE2 3.48Å; Q431-K433 VanDerWaalsContact C-N 3.32Å; Q431-K433 PolarHBondContact O-N 3.14Å; Q431-I434 PolarHBondContact O-N 3.28Å; Q431-I435 WeakPolarHBondContact O-CG1 3.36Å; Q431-I435 PolarHBondContact O-N 3.12Å
432R88.4Confident88.4Confident192 Ų192111 Ų11173%0.72551%0.509SS*.Hα-helixtrans-59.8-38.6173.6-75.6178.3-174.9-155.52.2113.1A428 Q429 K430 F436A428-R432 WeakPolarHBondContact O-CG 3.48Å; A428-R432 PolarHBondContact O-N 3.35Å; Q429-R432 PolarHBondContact O-N 3.43Å; K430-R432 VanDerWaalsContact C-N 3.32Å; K430-R432 PolarHBondContact O-N 2.88Å; R432-F436 WeakPolarHBondContact O-CB 3.37Å; R432-F436 PolarHBondContact O-N 3.21Å
433K91.2Very high88.2Confident132 Ų132109.9 Ų109.957%0.57451%0.506SS*.Hα-helixtrans-66.5-39.3175.9-72177.8-179178.30112.1Q429 K430 Q431 F436 Q437Q429-K433 WeakPolarHBondContact O-CG 3.36Å; Q429-K433 PolarHBondContact O-N 3.34Å; Q429-K433 VanDerWaalsContact O-N 3.16Å; K430-K433 WeakPolarHBondContact O-CB 3.33Å; K430-K433 PolarHBondContact O-N 3.23Å; Q431-K433 VanDerWaalsContact C-N 3.32Å; Q431-K433 PolarHBondContact O-N 3.14Å; K433-F436 PolarHBondContact O-N 2.97Å; K433-Q437 WeakPolarHBondContact O-CG 3.48Å; K433-Q437 PolarHBondContact O-N 3.45Å; K433-Q437 VanDerWaalsContact O-N 3.08Å
434I88.6Confident88.2Confident76 Ų76112.8 Ų112.839%0.3951%0.51SS..Hα-helixtrans-65.8-46.9176.7-64.8169000110.3K430 Q431 F436 Q437 L438K430-I434 PolarHBondContact O-N 3.22Å; Q431-I434 PolarHBondContact O-N 3.28Å; I434-F436 VanDerWaalsContact C-N 3.31Å; I434-F436 PolarHBondContact O-N 3.26Å; I434-Q437 PolarHBondContact O-N 3.47Å; I434-Q437 VanDerWaalsContact O-N 3.12Å; I434-L438 HydrophobicContact CG2-CD1 4.01Å; I434-L438 HydrophobicContact CG2-CG 4.44Å; I434-L438 WeakPolarHBondContact O-CG 3.45Å; I434-L438 PolarHBondContact O-N 3.21Å
435I87.5Confident88.1Confident91 Ų91111.7 Ų111.747%0.46751%0.505SS..Hα-helixtrans-57.4-46.5177.1-67.9166.5000110.5Q431 Q437 L438 E439Q431-I435 WeakPolarHBondContact O-CG1 3.36Å; Q431-I435 PolarHBondContact O-N 3.12Å; I435-Q437 VanDerWaalsContact C-N 3.31Å; I435-Q437 PolarHBondContact O-N 3.04Å; I435-L438 PolarHBondContact O-N 3.01Å; I435-E439 HydrophobicContact CG2-CG 4.38Å; I435-E439 WeakPolarHBondContact O-CG 3.35Å; I435-E439 PolarHBondContact O-N 3.01Å
436F91.8Very high88.1Confident134 Ų134110.2 Ų110.259%0.58850%0.502SS*.Hα-helixtrans-61.5-36.8177.5-177.1-101.3000113.1R432 K433 I434 K440R432-F436 WeakPolarHBondContact O-CB 3.37Å; R432-F436 PolarHBondContact O-N 3.21Å; K433-F436 PolarHBondContact O-N 2.97Å; I434-F436 VanDerWaalsContact C-N 3.31Å; I434-F436 PolarHBondContact O-N 3.26Å; F436-K440 WeakPolarHBondContact O-CB 3.32Å; F436-K440 PolarHBondContact O-N 3.06Å; F436-K440 VanDerWaalsContact O-N 3.09Å
437Q88.4Confident88Confident125 Ų125111.6 Ų111.658%0.58451%0.51SS*.Hα-helixtrans-66.4-44.3174.1-76.6178.7-10.600111.8K433 I434 I435 E439 K440 E441K433-Q437 WeakPolarHBondContact O-CG 3.48Å; K433-Q437 PolarHBondContact O-N 3.45Å; K433-Q437 VanDerWaalsContact O-N 3.08Å; I434-Q437 PolarHBondContact O-N 3.47Å; I434-Q437 VanDerWaalsContact O-N 3.12Å; I435-Q437 VanDerWaalsContact C-N 3.31Å; I435-Q437 PolarHBondContact O-N 3.04Å; Q437-E439 PolarHBondContact O-N 2.93Å; Q437-K440 WeakPolarHBondContact O-CB 3.4Å; Q437-K440 PolarHBondContact O-N 3.41Å; Q437-E441 PolarHBondContact O-N 3.19Å
438L85.4Confident88.1Confident100 Ų100111.2 Ų111.252%0.52451%0.508SS..Hα-helixtrans-64.9-37.3177.6-69.6171.6000112.4I434 I435 E441 R442I434-L438 HydrophobicContact CG2-CD1 4.01Å; I434-L438 HydrophobicContact CG2-CG 4.44Å; I434-L438 WeakPolarHBondContact O-CG 3.45Å; I434-L438 PolarHBondContact O-N 3.21Å; I435-L438 PolarHBondContact O-N 3.01Å; L438-E441 PolarHBondContact O-N 3.04Å; L438-R442 WeakPolarHBondContact O-CB 3.44Å; L438-R442 PolarHBondContact O-N 3Å
439E85.9Confident88.1Confident85 Ų85111.3 Ų111.340%0.39751%0.509SS..Hα-helixtrans-63.3-42.3172.9-73.7177.915500111.5I435 Q437 E441 R442 D443I435-E439 HydrophobicContact CG2-CG 4.38Å; I435-E439 WeakPolarHBondContact O-CG 3.35Å; I435-E439 PolarHBondContact O-N 3.01Å; Q437-E439 PolarHBondContact O-N 2.93Å; E439-E441 PolarHBondContact O-N 3.36Å; E439-R442 WeakPolarHBondContact O-CB 3.28Å; E439-R442 PolarHBondContact O-N 3.31Å; E439-D443 VanDerWaalsContact O-CG 3.29Å; E439-D443 PolarHBondContact O-N 2.89Å
440K90.1Very high87.9Confident150 Ų150109 Ų10965%0.65251%0.505SS*.Hα-helixtrans-64.9-38.1176.1-166.4179.3-178.2-1780112.3F436 Q437 R444F436-K440 WeakPolarHBondContact O-CB 3.32Å; F436-K440 PolarHBondContact O-N 3.06Å; F436-K440 VanDerWaalsContact O-N 3.09Å; Q437-K440 WeakPolarHBondContact O-CB 3.4Å; Q437-K440 PolarHBondContact O-N 3.41Å; K440-R444 WeakPolarHBondContact O-CB 3.36Å; K440-R444 PolarHBondContact O-N 3.29Å
441E84.9Confident87.8Confident100 Ų100106.9 Ų106.947%0.46750%0.5SS..Hα-helixtrans-67.1-44.7173.8-74.5-177.7174.900111.8Q437 L438 E439 D443 R444 Y445Q437-E441 PolarHBondContact O-N 3.19Å; L438-E441 PolarHBondContact O-N 3.04Å; E439-E441 PolarHBondContact O-N 3.36Å; E441-D443 VanDerWaalsContact C-N 3.33Å; E441-D443 PolarHBondContact O-N 3.3Å; E441-R444 WeakPolarHBondContact O-CB 3.36Å; E441-R444 PolarHBondContact O-N 2.93Å; E441-Y445 HydrophobicContact CB-CE2 4.27Å; E441-Y445 WeakPolarHBondContact O-CD2 3.48Å; E441-Y445 PolarHBondContact O-N 3.44Å
442R88.3Confident87.8Confident124 Ų124107.5 Ų107.547%0.46851%0.505SS..Hα-helixtrans-54.5-50.3173.8179.2-154.566-153.6-5.7110.9L438 E439 R444 Y445 I446L438-R442 WeakPolarHBondContact O-CB 3.44Å; L438-R442 PolarHBondContact O-N 3Å; E439-R442 WeakPolarHBondContact O-CB 3.28Å; E439-R442 PolarHBondContact O-N 3.31Å; R442-R444 VanDerWaalsContact C-N 3.31Å; R442-R444 PolarHBondContact O-N 2.99Å; R442-Y445 PolarHBondContact O-N 3.2Å; R442-I446 HydrophobicContact CG-CD1 3.85Å; R442-I446 HydrophobicContact CG-CG1 4.49Å; R442-I446 VanDerWaalsContact O-CG1 3.3Å; R442-I446 WeakPolarHBondContact O-CG1 3.3Å; R442-I446 PolarHBondContact O-N 3.28Å
443D87.7Confident87.7Confident69 Ų69102.3 Ų102.337%0.36950%0.495SS..Hα-helixtrans-65.7-35.7-178.1-67.5-14.4000111.9E439 E441 I446 N447E439-D443 VanDerWaalsContact O-CG 3.29Å; E439-D443 PolarHBondContact O-N 2.89Å; E441-D443 VanDerWaalsContact C-N 3.33Å; E441-D443 PolarHBondContact O-N 3.3Å; D443-I446 PolarHBondContact O-N 3.44Å; D443-N447 VanDerWaalsContact O-CG 3.26Å; D443-N447 PolarHBondContact O-N 2.92Å; D443-N447 PolarHBondContact O-ND2 3.4Å
444R89.4Confident87.6Confident166 Ų166102.4 Ų102.463%0.62650%0.497SS*.Hα-helixtrans-60.5-48.7171.4-178.6-176.7172.3167.81.4111.7K440 E441 R442 I446 N447 E448K440-R444 WeakPolarHBondContact O-CB 3.36Å; K440-R444 PolarHBondContact O-N 3.29Å; E441-R444 WeakPolarHBondContact O-CB 3.36Å; E441-R444 PolarHBondContact O-N 2.93Å; R442-R444 VanDerWaalsContact C-N 3.31Å; R442-R444 PolarHBondContact O-N 2.99Å; R444-I446 VanDerWaalsContact C-N 3.34Å; R444-I446 PolarHBondContact O-N 3.26Å; R444-N447 PolarHBondContact O-N 3.45Å; R444-E448 IonicContact CZ-OE1 2.67Å; R444-E448 IonicContact NE-OE1 3.88Å; R444-E448 PolarHBondContact NE-OE1 2.93Å; R444-E448 IonicContact NH2-OE1 3.66Å; R444-E448 WeakPolarHBondContact O-CG 3.49Å; R444-E448 PolarHBondContact O-N 2.92Å
445Y86.2Confident87.6Confident146 Ų146106.5 Ų106.557%0.57351%0.508SS*.Hα-helixtrans-67.6-33.4179.6-69.4-55.5000112.9E441 R442 E448 A449E441-Y445 HydrophobicContact CB-CE2 4.27Å; E441-Y445 WeakPolarHBondContact O-CD2 3.48Å; E441-Y445 PolarHBondContact O-N 3.44Å; R442-Y445 PolarHBondContact O-N 3.2Å; Y445-E448 PolarHBondContact O-N 3.45Å; Y445-A449 WeakPolarHBondContact O-CB 3.45Å; Y445-A449 PolarHBondContact O-N 3.26Å
446I86.9Confident87.4Confident95 Ų95106.1 Ų106.149%0.48751%0.51SS..Hα-helixtrans-61.6-45.8172.3-71.3169.3000110.2R442 D443 R444 A449 S450R442-I446 HydrophobicContact CG-CD1 3.85Å; R442-I446 HydrophobicContact CG-CG1 4.49Å; R442-I446 VanDerWaalsContact O-CG1 3.3Å; R442-I446 WeakPolarHBondContact O-CG1 3.3Å; R442-I446 PolarHBondContact O-N 3.28Å; D443-I446 PolarHBondContact O-N 3.44Å; R444-I446 VanDerWaalsContact C-N 3.34Å; R444-I446 PolarHBondContact O-N 3.26Å; I446-A449 PolarHBondContact O-N 3.03Å; I446-S450 WeakPolarHBondContact O-CB 3.31Å; I446-S450 PolarHBondContact O-N 3.1Å
447N89.1Confident87.3Confident98 Ų98104.5 Ų104.552%0.52451%0.507SS..Hα-helixtrans-65.2-43177.5-69-23.3000111.9D443 R444 A449 S450 D451D443-N447 VanDerWaalsContact O-CG 3.26Å; D443-N447 PolarHBondContact O-N 2.92Å; D443-N447 PolarHBondContact O-ND2 3.4Å; R444-N447 PolarHBondContact O-N 3.45Å; N447-A449 VanDerWaalsContact C-N 3.35Å; N447-A449 PolarHBondContact O-N 3.15Å; N447-S450 WeakPolarHBondContact O-CB 3.47Å; N447-S450 PolarHBondContact O-N 3.29Å; N447-D451 PolarHBondContact O-N 3.47Å
448E88.2Confident87.4Confident75 Ų75100.7 Ų100.735%0.3550%0.496SS..Hα-helixtrans-61.8-41176.1-73.5176.5-17000111.8R444 Y445 D451 L452R444-E448 IonicContact CZ-OE1 2.67Å; R444-E448 IonicContact NE-OE1 3.88Å; R444-E448 PolarHBondContact NE-OE1 2.93Å; R444-E448 IonicContact NH2-OE1 3.66Å; R444-E448 WeakPolarHBondContact O-CG 3.49Å; R444-E448 PolarHBondContact O-N 2.92Å; Y445-E448 PolarHBondContact O-N 3.45Å; E448-D451 PolarHBondContact O-N 2.9Å; E448-L452 WeakPolarHBondContact O-CB 3.47Å; E448-L452 VanDerWaalsContact O-CG 3.29Å; E448-L452 WeakPolarHBondContact O-CG 3.38Å; E448-L452 PolarHBondContact O-N 2.89Å
449A84Confident87.5Confident53 Ų53100.4 Ų100.444%0.43850%0.496SS..Hα-helixtrans-66.8-39.3175.500000112.5Y445 I446 N447 T453Y445-A449 WeakPolarHBondContact O-CB 3.45Å; Y445-A449 PolarHBondContact O-N 3.26Å; I446-A449 PolarHBondContact O-N 3.03Å; N447-A449 VanDerWaalsContact C-N 3.35Å; N447-A449 PolarHBondContact O-N 3.15Å; A449-T453 WeakPolarHBondContact O-CB 3.31Å; A449-T453 PolarHBondContact O-N 3.2Å; A449-T453 PolarHBondContact O-OG1 3.01Å
450S87.7Confident87.5Confident62 Ų62101.3 Ų101.343%0.43450%0.501SS..Hα-helixtrans-58.6-52.2172.6156.50000111.3I446 N447 L452 T453 Q454I446-S450 WeakPolarHBondContact O-CB 3.31Å; I446-S450 PolarHBondContact O-N 3.1Å; N447-S450 WeakPolarHBondContact O-CB 3.47Å; N447-S450 PolarHBondContact O-N 3.29Å; S450-L452 PolarHBondContact O-N 3.32Å; S450-T453 WeakPolarHBondContact O-CB 3.23Å; S450-T453 PolarHBondContact O-N 3.17Å; S450-Q454 PolarHBondContact O-N 3.13Å
451D87.8Confident87.4Confident82 Ų82100.3 Ų100.344%0.43950%0.499SS..Hα-helixtrans-61.6-42.6-179.8-77.2-2.3000111.8N447 E448 Q454 R455N447-D451 PolarHBondContact O-N 3.47Å; E448-D451 PolarHBondContact O-N 2.9Å; D451-Q454 PolarHBondContact O-N 3.23Å; D451-R455 WeakPolarHBondContact O-CG 3.35Å; D451-R455 PolarHBondContact O-N 3.4Å
452L86.5Confident87.6Confident103 Ų103100.3 Ų100.354%0.53950%0.502SS..Hα-helixtrans-64-41.7175.7-75.2171.3000111.7E448 S450 Q454 R455 V456E448-L452 WeakPolarHBondContact O-CB 3.47Å; E448-L452 VanDerWaalsContact O-CG 3.29Å; E448-L452 WeakPolarHBondContact O-CG 3.38Å; E448-L452 PolarHBondContact O-N 2.89Å; S450-L452 PolarHBondContact O-N 3.32Å; L452-Q454 VanDerWaalsContact C-N 3.33Å; L452-Q454 PolarHBondContact O-N 3Å; L452-R455 PolarHBondContact O-N 3.4Å; L452-V456 WeakPolarHBondContact O-CG2 3.18Å; L452-V456 PolarHBondContact O-N 3.28Å
453T86.7Confident87.4Confident83 Ų8399 Ų9951%0.50950%0.504SS..Hα-helixtrans-62.3-42.8176.6-58.30000110.9A449 S450 R455 V456 L457A449-T453 WeakPolarHBondContact O-CB 3.31Å; A449-T453 PolarHBondContact O-N 3.2Å; A449-T453 PolarHBondContact O-OG1 3.01Å; S450-T453 WeakPolarHBondContact O-CB 3.23Å; S450-T453 PolarHBondContact O-N 3.17Å; T453-R455 PolarHBondContact O-N 2.91Å; T453-V456 PolarHBondContact O-N 3.41Å; T453-L457 HydrophobicContact CG2-CD1 4.43Å; T453-L457 WeakPolarHBondContact O-CG 3.47Å; T453-L457 PolarHBondContact O-N 3.46Å
454Q88.7Confident87.5Confident133 Ų133101.6 Ų101.662%0.62151%0.511SS*.Hα-helixtrans-64.2-39.8177-164.2173.614.300112S450 D451 L452 L457 A458S450-Q454 PolarHBondContact O-N 3.13Å; D451-Q454 PolarHBondContact O-N 3.23Å; L452-Q454 VanDerWaalsContact C-N 3.33Å; L452-Q454 PolarHBondContact O-N 3Å; Q454-L457 PolarHBondContact O-N 3.29Å; Q454-A458 PolarHBondContact O-N 3.07Å
455R88Confident87.4Confident163 Ų16397.3 Ų97.362%0.61550%0.503SS*.Hα-helixtrans-63.6-39.6173.2-72.6-179-159.5-177.36.7112.6D451 L452 T453 A458 N459D451-R455 WeakPolarHBondContact O-CG 3.35Å; D451-R455 PolarHBondContact O-N 3.4Å; L452-R455 PolarHBondContact O-N 3.4Å; T453-R455 PolarHBondContact O-N 2.91Å; R455-A458 PolarHBondContact O-N 3.49Å; R455-N459 WeakPolarHBondContact O-CB 3.49Å; R455-N459 VanDerWaalsContact O-CG 3.25Å; R455-N459 PolarHBondContact O-N 3.35Å; R455-N459 PolarHBondContact O-ND2 3.24Å
456V84.9Confident87.5Confident83 Ų8398.4 Ų98.450%0.50351%0.506SS..Hα-helixtrans-63.2-44.4176.2169.70000110.5L452 T453 N459 M460L452-V456 WeakPolarHBondContact O-CG2 3.18Å; L452-V456 PolarHBondContact O-N 3.28Å; T453-V456 PolarHBondContact O-N 3.41Å; V456-N459 PolarHBondContact O-N 2.99Å; V456-M460 HydrophobicContact CG1-SD 4.36Å; V456-M460 WeakPolarHBondContact O-CG 3.39Å; V456-M460 PolarHBondContact O-N 3.44Å
457L89.1Confident87.5Confident99 Ų9999.6 Ų99.652%0.51851%0.51SS..Hα-helixtrans-62.5-45177.2-69.9173000112.1T453 Q454 N459 M460 E461T453-L457 HydrophobicContact CG2-CD1 4.43Å; T453-L457 WeakPolarHBondContact O-CG 3.47Å; T453-L457 PolarHBondContact O-N 3.46Å; Q454-L457 PolarHBondContact O-N 3.29Å; L457-N459 PolarHBondContact O-N 3.43Å; L457-M460 PolarHBondContact O-N 3.03Å; L457-E461 PolarHBondContact O-N 3.24Å
458A89.2Confident87.4Confident45 Ų4599.8 Ų99.837%0.37251%0.51SS..Hα-helixtrans-60.5-45.1175.700000112Q454 R455 M460 E461 D462Q454-A458 PolarHBondContact O-N 3.07Å; R455-A458 PolarHBondContact O-N 3.49Å; A458-M460 VanDerWaalsContact C-N 3.31Å; A458-M460 PolarHBondContact O-N 3.5Å; A458-E461 WeakPolarHBondContact O-CB 3.4Å; A458-E461 PolarHBondContact O-N 3.06Å; A458-E461 VanDerWaalsContact O-N 3.16Å; A458-D462 PolarHBondContact O-N 3.45Å
459N88.7Confident87.5Confident95 Ų9599.8 Ų99.851%0.50851%0.51SS..Hα-helixtrans-64.4-34.7176.4-72.7-19.6000112.3R455 V456 L457 E461 D462 I463R455-N459 WeakPolarHBondContact O-CB 3.49Å; R455-N459 VanDerWaalsContact O-CG 3.25Å; R455-N459 PolarHBondContact O-N 3.35Å; R455-N459 PolarHBondContact O-ND2 3.24Å; V456-N459 PolarHBondContact O-N 2.99Å; L457-N459 PolarHBondContact O-N 3.43Å; N459-E461 VanDerWaalsContact C-N 3.35Å; N459-D462 PolarHBondContact O-N 3.47Å; N459-I463 VanDerWaalsContact O-CG1 3.28Å; N459-I463 WeakPolarHBondContact O-CG1 3.43Å; N459-I463 PolarHBondContact O-N 3.15Å
460M86.3Confident87.6Confident104 Ų104101.6 Ų101.651%0.51251%0.511SS..Hα-helixtrans-66.9-36.1174-75.2-175.590.500112V456 L457 A458 K464V456-M460 HydrophobicContact CG1-SD 4.36Å; V456-M460 WeakPolarHBondContact O-CG 3.39Å; V456-M460 PolarHBondContact O-N 3.44Å; L457-M460 PolarHBondContact O-N 3.03Å; A458-M460 VanDerWaalsContact C-N 3.31Å; A458-M460 PolarHBondContact O-N 3.5Å; M460-K464 WeakPolarHBondContact O-CG 3.47Å; M460-K464 PolarHBondContact O-N 3.48Å; M460-K464 VanDerWaalsContact O-N 3.1Å
461E88.2Confident87.7Confident128 Ų128105.2 Ų105.260%0.59852%0.519SS*.Hα-helixtrans-65.8-43.4172.7-72.9177.1174.400111.3L457 A458 N459 I463 K464 V465L457-E461 PolarHBondContact O-N 3.24Å; A458-E461 WeakPolarHBondContact O-CB 3.4Å; A458-E461 PolarHBondContact O-N 3.06Å; A458-E461 VanDerWaalsContact O-N 3.16Å; N459-E461 VanDerWaalsContact C-N 3.35Å; E461-I463 PolarHBondContact O-N 3.06Å; E461-K464 WeakPolarHBondContact O-CB 3.42Å; E461-K464 PolarHBondContact O-N 2.95Å; E461-V465 WeakPolarHBondContact O-CG2 3.42Å; E461-V465 PolarHBondContact O-N 2.89Å
462D87.8Confident87.7Confident100 Ų100105 Ų10554%0.53552%0.518SS..Hα-helixtrans-60.4-43174.7-79.8-19.1000112.1A458 N459 K464 V465 R466A458-D462 PolarHBondContact O-N 3.45Å; N459-D462 PolarHBondContact O-N 3.47Å; D462-K464 VanDerWaalsContact C-N 3.34Å; D462-K464 PolarHBondContact O-N 2.86Å; D462-V465 PolarHBondContact O-N 2.9Å; D462-R466 VanDerWaalsContact O-CG 3.27Å; D462-R466 WeakPolarHBondContact O-CG 3.42Å; D462-R466 PolarHBondContact O-N 2.98Å
463I85.4Confident87.8Confident98 Ų98106.8 Ų106.850%0.50352%0.519SS..Hα-helixtrans-59.8-45.3175.3-71166.2000110.4N459 E461 V465 R466 E467N459-I463 VanDerWaalsContact O-CG1 3.28Å; N459-I463 WeakPolarHBondContact O-CG1 3.43Å; N459-I463 PolarHBondContact O-N 3.15Å; E461-I463 PolarHBondContact O-N 3.06Å; I463-V465 VanDerWaalsContact C-N 3.35Å; I463-V465 PolarHBondContact O-N 3.28Å; I463-R466 PolarHBondContact O-N 2.92Å; I463-R466 VanDerWaalsContact O-N 3.17Å; I463-E467 HydrophobicContact CG2-CG 4.33Å; I463-E467 WeakPolarHBondContact O-CG 3.44Å; I463-E467 PolarHBondContact O-N 3.43Å
464K88.5Confident87.8Confident123 Ų123111.5 Ų111.554%0.53553%0.527SS..Hα-helixtrans-60.4-42.7176.7-73.5173.1-176.7174.20112.1M460 E461 D462 R466 E467 I468M460-K464 WeakPolarHBondContact O-CG 3.47Å; M460-K464 PolarHBondContact O-N 3.48Å; M460-K464 VanDerWaalsContact O-N 3.1Å; E461-K464 WeakPolarHBondContact O-CB 3.42Å; E461-K464 PolarHBondContact O-N 2.95Å; D462-K464 VanDerWaalsContact C-N 3.34Å; D462-K464 PolarHBondContact O-N 2.86Å; K464-R466 VanDerWaalsContact C-N 3.33Å; K464-R466 PolarHBondContact O-N 3.06Å; K464-E467 PolarHBondContact O-N 3.23Å; K464-I468 VanDerWaalsContact O-CG1 3.31Å; K464-I468 WeakPolarHBondContact O-CG1 3.4Å; K464-I468 PolarHBondContact O-N 3.45Å
465V88.1Confident87.9Confident75 Ų75110.8 Ų110.846%0.45552%0.522SS..Hα-helixtrans-62-42.3175.9172.90000110.7E461 D462 I463 I468 Q469E461-V465 WeakPolarHBondContact O-CG2 3.42Å; E461-V465 PolarHBondContact O-N 2.89Å; D462-V465 PolarHBondContact O-N 2.9Å; I463-V465 VanDerWaalsContact C-N 3.35Å; I463-V465 PolarHBondContact O-N 3.28Å; V465-I468 PolarHBondContact O-N 2.95Å; V465-Q469 WeakPolarHBondContact O-CG 3.37Å; V465-Q469 PolarHBondContact O-N 3.42Å
466R87.5Confident87.8Confident169 Ų169108.9 Ų108.964%0.63852%0.518SS*.Hα-helixtrans-66-38.9176.5-66.6-65.4-177.1156.53112.4D462 I463 K464 Q469 I470D462-R466 VanDerWaalsContact O-CG 3.27Å; D462-R466 WeakPolarHBondContact O-CG 3.42Å; D462-R466 PolarHBondContact O-N 2.98Å; I463-R466 PolarHBondContact O-N 2.92Å; I463-R466 VanDerWaalsContact O-N 3.17Å; K464-R466 VanDerWaalsContact C-N 3.33Å; K464-R466 PolarHBondContact O-N 3.06Å; R466-Q469 PolarHBondContact O-N 3.49Å; R466-I470 VanDerWaalsContact O-CG1 3.28Å; R466-I470 WeakPolarHBondContact O-CG1 3.37Å; R466-I470 PolarHBondContact O-N 3.21Å
467E86.5Confident87.9Confident121 Ų121109.5 Ų109.557%0.56552%0.518SS*.Hα-helixtrans-62.7-41.9175.2-75.9179.7160.800111.9I463 K464 I470 F471I463-E467 HydrophobicContact CG2-CG 4.33Å; I463-E467 WeakPolarHBondContact O-CG 3.44Å; I463-E467 PolarHBondContact O-N 3.43Å; K464-E467 PolarHBondContact O-N 3.23Å; E467-I470 PolarHBondContact O-N 3.11Å; E467-F471 WeakPolarHBondContact O-CB 3.45Å; E467-F471 PolarHBondContact O-N 3.29Å
468I88.5Confident87.9Confident102 Ų102107 Ų10752%0.52351%0.511SS..Hα-helixtrans-62.1-44.8174.1-66.4165000110.5K464 V465 I470 F471 D472K464-I468 VanDerWaalsContact O-CG1 3.31Å; K464-I468 WeakPolarHBondContact O-CG1 3.4Å; K464-I468 PolarHBondContact O-N 3.45Å; V465-I468 PolarHBondContact O-N 2.95Å; I468-I470 PolarHBondContact O-N 2.96Å; I468-F471 WeakPolarHBondContact O-CB 3.44Å; I468-F471 PolarHBondContact O-N 3.47Å; I468-D472 PolarHBondContact O-N 3.44Å
469Q90.2Very high87.8Confident75 Ų75109 Ų10935%0.3551%0.513SS..Hα-helixtrans-61.5-43.7176.3-71.9175.1-3.500112.2V465 R466 F471 D472 Y473V465-Q469 WeakPolarHBondContact O-CG 3.37Å; V465-Q469 PolarHBondContact O-N 3.42Å; R466-Q469 PolarHBondContact O-N 3.49Å; Q469-F471 VanDerWaalsContact C-N 3.28Å; Q469-F471 PolarHBondContact O-N 2.91Å; Q469-D472 PolarHBondContact O-N 2.94Å; Q469-Y473 HydrophobicContact CB-CD2 4.45Å; Q469-Y473 HydrophobicContact CB-CE2 4.31Å; Q469-Y473 WeakPolarHBondContact O-CD2 3.49Å; Q469-Y473 PolarHBondContact O-N 2.96Å
470I85.9Confident87.6Confident90 Ų90108 Ų10846%0.46251%0.513SS..Hα-helixtrans-60.7-41.6176.3-70.8166.5000110.3R466 E467 I468 Y473 R474R466-I470 VanDerWaalsContact O-CG1 3.28Å; R466-I470 WeakPolarHBondContact O-CG1 3.37Å; R466-I470 PolarHBondContact O-N 3.21Å; E467-I470 PolarHBondContact O-N 3.11Å; I468-I470 PolarHBondContact O-N 2.96Å; I470-Y473 PolarHBondContact O-N 3.04Å; I470-R474 HydrophobicContact CG2-CG 4.49Å; I470-R474 WeakPolarHBondContact O-CB 3.46Å; I470-R474 WeakPolarHBondContact O-CG 3.17Å; I470-R474 PolarHBondContact O-N 3.02Å
471F89.8Confident87.6Confident138 Ų138108.9 Ų108.961%0.60552%0.516SS*.Hα-helixtrans-61.6-46.9176-177.6-95.1000111.8E467 I468 Q469 Y473 R474 K475E467-F471 WeakPolarHBondContact O-CB 3.45Å; E467-F471 PolarHBondContact O-N 3.29Å; I468-F471 WeakPolarHBondContact O-CB 3.44Å; I468-F471 PolarHBondContact O-N 3.47Å; Q469-F471 VanDerWaalsContact C-N 3.28Å; Q469-F471 PolarHBondContact O-N 2.91Å; F471-Y473 PolarHBondContact O-N 3.31Å; F471-R474 PolarHBondContact O-N 3.35Å; F471-K475 PolarHBondContact O-N 3.02Å
472D87.8Confident87.5Confident77 Ų77106.4 Ų106.441%0.41251%0.51SS..Hα-helixtrans-63.5-39.4177.3-73.4-22000112.4I468 Q469 K475 K476I468-D472 PolarHBondContact O-N 3.44Å; Q469-D472 PolarHBondContact O-N 2.94Å; D472-K475 PolarHBondContact O-N 3.17Å; D472-K476 WeakPolarHBondContact O-CG 3.4Å; D472-K476 PolarHBondContact O-N 3.06Å
473Y88.6Confident87.4Confident142 Ų142107.9 Ų107.956%0.55751%0.511SS*.Hα-helixtrans-66.9-41.2174.8-75.3-57.1000112.2Q469 I470 F471 K475 K476 I477Q469-Y473 HydrophobicContact CB-CD2 4.45Å; Q469-Y473 HydrophobicContact CB-CE2 4.31Å; Q469-Y473 WeakPolarHBondContact O-CD2 3.49Å; Q469-Y473 PolarHBondContact O-N 2.96Å; I470-Y473 PolarHBondContact O-N 3.04Å; F471-Y473 PolarHBondContact O-N 3.31Å; Y473-K475 VanDerWaalsContact C-N 3.29Å; Y473-K475 PolarHBondContact O-N 3.44Å; Y473-K476 PolarHBondContact O-N 3.21Å; Y473-I477 VanDerWaalsContact O-CG1 3.28Å; Y473-I477 WeakPolarHBondContact O-CG1 3.47Å; Y473-I477 PolarHBondContact O-N 2.93Å
474R87.1Confident87.3Confident181 Ų181107.8 Ų107.868%0.68351%0.511SS*.Hα-helixtrans-60.5-40.8173.1-76.9178.6177.9-171.30.9111.5I470 F471 I477 A478I470-R474 HydrophobicContact CG2-CG 4.49Å; I470-R474 WeakPolarHBondContact O-CB 3.46Å; I470-R474 WeakPolarHBondContact O-CG 3.17Å; I470-R474 PolarHBondContact O-N 3.02Å; F471-R474 PolarHBondContact O-N 3.35Å; R474-I477 PolarHBondContact O-N 3.22Å; R474-A478 WeakPolarHBondContact O-CB 3.41Å; R474-A478 PolarHBondContact O-N 3.38Å
475K88.8Confident87.3Confident119 Ų119108 Ų10852%0.51751%0.512SS..Hα-helixtrans-62.3-45.9174.6-171.8-179.2174.4-173.50111.6F471 D472 Y473 I477 A478 E479F471-K475 PolarHBondContact O-N 3.02Å; D472-K475 PolarHBondContact O-N 3.17Å; Y473-K475 VanDerWaalsContact C-N 3.29Å; Y473-K475 PolarHBondContact O-N 3.44Å; K475-I477 VanDerWaalsContact C-N 3.34Å; K475-I477 PolarHBondContact O-N 3.09Å; K475-A478 PolarHBondContact O-N 3.45Å; K475-E479 VanDerWaalsContact CE-OE1 3.24Å; K475-E479 WeakPolarHBondContact CE-OE1 3.35Å; K475-E479 WeakPolarHBondContact O-CB 3.37Å; K475-E479 WeakPolarHBondContact O-CG 3.35Å; K475-E479 PolarHBondContact O-N 2.91Å
476K87.3Confident87.1Confident123 Ų123110 Ų11054%0.53552%0.517SS..Hα-helixtrans-62.2-37.4175.2-77.4178.9179.81750113.3D472 Y473 S480D472-K476 WeakPolarHBondContact O-CG 3.4Å; D472-K476 PolarHBondContact O-N 3.06Å; Y473-K476 PolarHBondContact O-N 3.21Å; K476-S480 WeakPolarHBondContact O-CB 3.46Å; K476-S480 PolarHBondContact O-N 3.24Å; K476-S480 PolarHBondContact O-OG 3.35Å
477I86.5Confident86.9Confident96 Ų96108.3 Ų108.349%0.49252%0.516SS..Hα-helixtrans-64.3-49.7174.9-69.9165.4000109.4Y473 R474 K475 E479 S480 E481Y473-I477 VanDerWaalsContact O-CG1 3.28Å; Y473-I477 WeakPolarHBondContact O-CG1 3.47Å; Y473-I477 PolarHBondContact O-N 2.93Å; R474-I477 PolarHBondContact O-N 3.22Å; K475-I477 VanDerWaalsContact C-N 3.34Å; K475-I477 PolarHBondContact O-N 3.09Å; I477-E479 VanDerWaalsContact C-N 3.33Å; I477-E479 PolarHBondContact O-N 3.36Å; I477-S480 CarbonylContact O-C 3.51Å; I477-S480 WeakPolarHBondContact O-CA 3.36Å; I477-S480 WeakPolarHBondContact O-CB 3.38Å; I477-S480 PolarHBondContact O-N 2.92Å; I477-E481 HydrophobicContact CG2-CG 4.28Å; I477-E481 WeakPolarHBondContact O-CG 3.41Å; I477-E481 PolarHBondContact O-N 3.29Å
478A88.5Confident86.7Confident46 Ų46106.7 Ų106.738%0.3851%0.509SS..Hα-helixtrans-60.3-40.2176.900000112.6R474 K475 S480 E481 T482R474-A478 WeakPolarHBondContact O-CB 3.41Å; R474-A478 PolarHBondContact O-N 3.38Å; K475-A478 PolarHBondContact O-N 3.45Å; A478-S480 VanDerWaalsContact C-N 3.31Å; A478-S480 PolarHBondContact O-N 3.47Å; A478-E481 PolarHBondContact O-N 2.86Å; A478-T482 WeakPolarHBondContact O-CB 3.47Å; A478-T482 VanDerWaalsContact O-CG2 3.3Å; A478-T482 WeakPolarHBondContact O-CG2 3.42Å; A478-T482 PolarHBondContact O-N 3.38Å; A478-T482 PolarHBondContact O-OG1 3.11Å
479E87.6Confident86.4Confident88 Ų88105.7 Ų105.741%0.41150%0.504SS..Hα-helixtrans-63.9-35173.1-74.4173.6-170.700112.4K475 I477 T482 K483K475-E479 VanDerWaalsContact CE-OE1 3.24Å; K475-E479 WeakPolarHBondContact CE-OE1 3.35Å; K475-E479 WeakPolarHBondContact O-CB 3.37Å; K475-E479 WeakPolarHBondContact O-CG 3.35Å; K475-E479 PolarHBondContact O-N 2.91Å; I477-E479 VanDerWaalsContact C-N 3.33Å; I477-E479 PolarHBondContact O-N 3.36Å; E479-T482 VanDerWaalsContact C-OG1 3.3Å; E479-T482 VanDerWaalsContact CA-OG1 3.27Å; E479-T482 WeakPolarHBondContact CA-OG1 3.48Å; E479-T482 PolarHBondContact O-OG1 3.34Å; E479-K483 WeakPolarHBondContact O-CB 3.42Å; E479-K483 VanDerWaalsContact O-CG 3.3Å; E479-K483 WeakPolarHBondContact O-CG 3.48Å; E479-K483 PolarHBondContact O-N 3.05Å
480S84.7Confident86Confident73 Ų73107.6 Ų107.651%0.5152%0.516SS..Hα-helixtrans-75.7-39.1177.4-57.30000111.9K476 I477 A478 K483 L484K476-S480 WeakPolarHBondContact O-CB 3.46Å; K476-S480 PolarHBondContact O-N 3.24Å; K476-S480 PolarHBondContact O-OG 3.35Å; I477-S480 CarbonylContact O-C 3.51Å; I477-S480 WeakPolarHBondContact O-CA 3.36Å; I477-S480 WeakPolarHBondContact O-CB 3.38Å; I477-S480 PolarHBondContact O-N 2.92Å; A478-S480 VanDerWaalsContact C-N 3.31Å; A478-S480 PolarHBondContact O-N 3.47Å; S480-K483 PolarHBondContact O-N 3.32Å; S480-L484 WeakPolarHBondContact O-CB 3.48Å; S480-L484 PolarHBondContact O-N 2.68Å
481E86.5Confident85.9Confident122 Ų122111 Ų11157%0.5753%0.525SS*.Hα-helixtrans-64.5-41.4173.9-74.3176.516900111.4I477 A478 L484 K485I477-E481 HydrophobicContact CG2-CG 4.28Å; I477-E481 WeakPolarHBondContact O-CG 3.41Å; I477-E481 PolarHBondContact O-N 3.29Å; A478-E481 PolarHBondContact O-N 2.86Å; E481-L484 PolarHBondContact O-N 2.97Å; E481-K485 WeakPolarHBondContact O-CB 3.39Å; E481-K485 PolarHBondContact O-N 3.48Å
482T85.8Confident85.5Confident76 Ų76110 Ų11047%0.46652%0.522SS..Hα-helixtrans-65.7-41174.348.30000111.8A478 E479 K485 Q486A478-T482 WeakPolarHBondContact O-CB 3.47Å; A478-T482 VanDerWaalsContact O-CG2 3.3Å; A478-T482 WeakPolarHBondContact O-CG2 3.42Å; A478-T482 PolarHBondContact O-N 3.38Å; A478-T482 PolarHBondContact O-OG1 3.11Å; E479-T482 VanDerWaalsContact C-OG1 3.3Å; E479-T482 VanDerWaalsContact CA-OG1 3.27Å; E479-T482 WeakPolarHBondContact CA-OG1 3.48Å; E479-T482 PolarHBondContact O-OG1 3.34Å; T482-K485 PolarHBondContact O-N 2.83Å; T482-Q486 WeakPolarHBondContact O-CB 3.49Å; T482-Q486 VanDerWaalsContact O-CG 3.25Å; T482-Q486 WeakPolarHBondContact O-CG 3.49Å; T482-Q486 PolarHBondContact O-N 3.09Å
483K86.7Confident85Confident131 Ų131108.3 Ų108.357%0.5752%0.518SS*.Hα-helixtrans-62.7-41.8171.6-78175.8-176.7175.80112.7E479 S480 K485 Q486 Q487E479-K483 WeakPolarHBondContact O-CB 3.42Å; E479-K483 VanDerWaalsContact O-CG 3.3Å; E479-K483 WeakPolarHBondContact O-CG 3.48Å; E479-K483 PolarHBondContact O-N 3.05Å; S480-K483 PolarHBondContact O-N 3.32Å; K483-K485 VanDerWaalsContact C-N 3.34Å; K483-Q486 WeakPolarHBondContact O-CB 3.29Å; K483-Q486 PolarHBondContact O-N 3.34Å; K483-Q487 PolarHBondContact O-N 2.91Å
484L83.4Confident84.6Confident96 Ų96106.3 Ų106.350%0.50352%0.52SS..Hα-helixtrans-62.3-44.6175.5-178.568.9000110.4S480 E481 Q486 Q487 Q488S480-L484 WeakPolarHBondContact O-CB 3.48Å; S480-L484 PolarHBondContact O-N 2.68Å; E481-L484 PolarHBondContact O-N 2.97Å; L484-Q486 VanDerWaalsContact C-N 3.33Å; L484-Q486 PolarHBondContact O-N 2.87Å; L484-Q487 PolarHBondContact O-N 3.29Å; L484-Q488 WeakPolarHBondContact O-CB 3.49Å; L484-Q488 VanDerWaalsContact O-CG 3.32Å; L484-Q488 WeakPolarHBondContact O-CG 3.41Å; L484-Q488 PolarHBondContact O-N 2.92Å
485K86.7Confident84.2Confident127 Ų127104.8 Ų104.855%0.55252%0.515SS*.Hα-helixtrans-60.8-42.6175.3-159.779.4-179.8179.10111.1E481 T482 K483 Q488 N489E481-K485 WeakPolarHBondContact O-CB 3.39Å; E481-K485 PolarHBondContact O-N 3.48Å; T482-K485 PolarHBondContact O-N 2.83Å; K483-K485 VanDerWaalsContact C-N 3.34Å; K485-Q488 PolarHBondContact O-N 3.49Å; K485-N489 WeakPolarHBondContact O-CB 3.44Å; K485-N489 PolarHBondContact O-N 2.93Å; K485-N489 PolarHBondContact O-ND2 3.38Å; K485-N489 PolarHBondContact O-OD1 3.21Å
486Q85.6Confident83.7Confident117 Ų117102 Ų10255%0.54751%0.51SS..Hα-helixtrans-62.5-42.9174.5-73.8169.1-1.400111.9T482 K483 L484 N489 L490T482-Q486 WeakPolarHBondContact O-CB 3.49Å; T482-Q486 VanDerWaalsContact O-CG 3.25Å; T482-Q486 WeakPolarHBondContact O-CG 3.49Å; T482-Q486 PolarHBondContact O-N 3.09Å; K483-Q486 WeakPolarHBondContact O-CB 3.29Å; K483-Q486 PolarHBondContact O-N 3.34Å; L484-Q486 VanDerWaalsContact C-N 3.33Å; L484-Q486 PolarHBondContact O-N 2.87Å; Q486-N489 PolarHBondContact O-N 2.88Å; Q486-L490 WeakPolarHBondContact O-CB 3.33Å; Q486-L490 VanDerWaalsContact O-CG 3.28Å; Q486-L490 WeakPolarHBondContact O-CG 3.29Å; Q486-L490 PolarHBondContact O-N 3.02Å
487Q82.8Confident83.2Confident135 Ų13599.2 Ų99.263%0.63150%0.501SS*.Hα-helixtrans-67.7-39.3175.9-77.3-167.8-10.500112.8K483 L484 N489 L490 Y491K483-Q487 PolarHBondContact O-N 2.91Å; L484-Q487 PolarHBondContact O-N 3.29Å; Q487-N489 VanDerWaalsContact C-N 3.34Å; Q487-L490 PolarHBondContact O-N 3.37Å; Q487-Y491 WeakPolarHBondContact O-CB 3.41Å; Q487-Y491 PolarHBondContact O-N 3.4Å
488Q81.1Confident82.6Confident86 Ų86103 Ų10340%0.40251%0.509SS..Hα-helixtrans-60.1-47.3172.5-76.7175.4-15.100110.3L484 K485 L490 Y491 E492L484-Q488 WeakPolarHBondContact O-CB 3.49Å; L484-Q488 VanDerWaalsContact O-CG 3.32Å; L484-Q488 WeakPolarHBondContact O-CG 3.41Å; L484-Q488 PolarHBondContact O-N 2.92Å; K485-Q488 PolarHBondContact O-N 3.49Å; Q488-L490 VanDerWaalsContact C-N 3.33Å; Q488-L490 PolarHBondContact O-N 3.45Å; Q488-Y491 PolarHBondContact O-N 3.08Å; Q488-E492 WeakPolarHBondContact O-CB 3.48Å; Q488-E492 WeakPolarHBondContact O-CG 3.43Å; Q488-E492 PolarHBondContact O-N 3.3Å
489N82.8Confident82.1Confident82 Ų82104.4 Ų104.444%0.43951%0.51SS..Hα-helixtrans-62.2-39.4176.6-67.1-3.9000111.7K485 Q486 Q487 A493K485-N489 WeakPolarHBondContact O-CB 3.44Å; K485-N489 PolarHBondContact O-N 2.93Å; K485-N489 PolarHBondContact O-ND2 3.38Å; K485-N489 PolarHBondContact O-OD1 3.21Å; Q486-N489 PolarHBondContact O-N 2.88Å; Q487-N489 VanDerWaalsContact C-N 3.34Å; N489-A493 WeakPolarHBondContact O-CB 3.47Å; N489-A493 PolarHBondContact O-N 2.72Å
490L83.1Confident81.3Confident114 Ų114103.6 Ų103.660%0.59751%0.509SS*.Hα-helixtrans-67-40.6175.5-75.4168.2000111.9Q486 Q487 Q488 A493 V494Q486-L490 WeakPolarHBondContact O-CB 3.33Å; Q486-L490 VanDerWaalsContact O-CG 3.28Å; Q486-L490 WeakPolarHBondContact O-CG 3.29Å; Q486-L490 PolarHBondContact O-N 3.02Å; Q487-L490 PolarHBondContact O-N 3.37Å; Q488-L490 VanDerWaalsContact C-N 3.33Å; Q488-L490 PolarHBondContact O-N 3.45Å; L490-A493 PolarHBondContact O-N 2.86Å; L490-V494 WeakPolarHBondContact O-CG2 3.43Å; L490-V494 PolarHBondContact O-N 3.14Å
491Y82.4Confident80.6Confident163 Ų163107.9 Ų107.964%0.63951%0.514SS*.Hα-helixtrans-66.2-42.8175.6-178.8-94.9000111.5Q487 Q488 A493 V494 R495Q487-Y491 WeakPolarHBondContact O-CB 3.41Å; Q487-Y491 PolarHBondContact O-N 3.4Å; Q488-Y491 PolarHBondContact O-N 3.08Å; Y491-A493 VanDerWaalsContact C-N 3.33Å; Y491-V494 PolarHBondContact O-N 3.49Å; Y491-R495 VanDerWaalsContact O-CB 3.23Å; Y491-R495 WeakPolarHBondContact O-CB 3.3Å; Y491-R495 PolarHBondContact O-N 3.31Å
492E81Confident79.9Confident117 Ų117106.2 Ų106.255%0.54752%0.516SS..Hα-helixtrans-63.2-39.1173-75.4178.1-178.100111.5Q488 R495 S496Q488-E492 WeakPolarHBondContact O-CB 3.48Å; Q488-E492 WeakPolarHBondContact O-CG 3.43Å; Q488-E492 PolarHBondContact O-N 3.3Å; E492-R495 PolarHBondContact O-N 2.97Å; E492-S496 WeakPolarHBondContact O-CA 3.44Å; E492-S496 VanDerWaalsContact O-CB 3.24Å; E492-S496 WeakPolarHBondContact O-CB 3.49Å; E492-S496 PolarHBondContact O-N 3.42Å; E492-S496 PolarHBondContact O-OG 3.49Å
493A78.9Confident78.9Confident40 Ų40108 Ų10833%0.33152%0.518SS..Hα-helixtrans-64.8-45.4174.700000111.8N489 L490 Y491 R495 S496 D497N489-A493 WeakPolarHBondContact O-CB 3.47Å; N489-A493 PolarHBondContact O-N 2.72Å; L490-A493 PolarHBondContact O-N 2.86Å; Y491-A493 VanDerWaalsContact C-N 3.33Å; A493-R495 VanDerWaalsContact C-N 3.34Å; A493-R495 PolarHBondContact O-N 3.43Å; A493-S496 VanDerWaalsContact CA-OG 3.31Å; A493-S496 WeakPolarHBondContact CA-OG 3.41Å; A493-S496 PolarHBondContact O-N 3.06Å; A493-S496 PolarHBondContact O-OG 3.25Å; A493-D497 VanDerWaalsContact O-CB 3.26Å; A493-D497 WeakPolarHBondContact O-CB 3.36Å; A493-D497 PolarHBondContact O-N 2.78Å
494V78.5Confident78Confident100 Ų100104.6 Ų104.661%0.60651%0.506SS*.Hα-helixtrans-65.8-39175.9172.20000111.2L490 Y491 D497 R498L490-V494 WeakPolarHBondContact O-CG2 3.43Å; L490-V494 PolarHBondContact O-N 3.14Å; Y491-V494 PolarHBondContact O-N 3.49Å; V494-D497 PolarHBondContact O-N 3.38Å; V494-R498 WeakPolarHBondContact O-CB 3.41Å; V494-R498 PolarHBondContact O-N 3.25Å
495R80.4Confident77.1Confident150 Ų150105.9 Ų105.957%0.56651%0.513SS*.Hα-helixtrans-66.5-41.7175.3-172.6-175.8-175.7-163.21.3111.2Y491 E492 A493 N499Y491-R495 VanDerWaalsContact O-CB 3.23Å; Y491-R495 WeakPolarHBondContact O-CB 3.3Å; Y491-R495 PolarHBondContact O-N 3.31Å; E492-R495 PolarHBondContact O-N 2.97Å; A493-R495 VanDerWaalsContact C-N 3.34Å; A493-R495 PolarHBondContact O-N 3.43Å; R495-N499 PolarHBondContact O-N 2.94Å; R495-N499 VanDerWaalsContact O-N 3.1Å; R495-N499 PolarHBondContact O-ND2 2.99Å
496S77.5Confident76Confident59 Ų59103.5 Ų103.541%0.41351%0.508SS..Hα-helixtrans-66.5-43.4176.268.10000110.1E492 A493 R498 N499 L500E492-S496 WeakPolarHBondContact O-CA 3.44Å; E492-S496 VanDerWaalsContact O-CB 3.24Å; E492-S496 WeakPolarHBondContact O-CB 3.49Å; E492-S496 PolarHBondContact O-N 3.42Å; E492-S496 PolarHBondContact O-OG 3.49Å; A493-S496 VanDerWaalsContact CA-OG 3.31Å; A493-S496 WeakPolarHBondContact CA-OG 3.41Å; A493-S496 PolarHBondContact O-N 3.06Å; A493-S496 PolarHBondContact O-OG 3.25Å; S496-R498 PolarHBondContact O-N 3.13Å; S496-N499 CarbonylContact O-C 3.59Å; S496-N499 PolarHBondContact O-N 3.31Å; S496-N499 VanDerWaalsContact O-N 3.15Å; S496-L500 WeakPolarHBondContact O-CA 3.35Å; S496-L500 WeakPolarHBondContact O-CB 3.5Å; S496-L500 PolarHBondContact O-N 2.88Å
497D77.5Confident74.6Confident66 Ų66100.2 Ų100.235%0.35349%0.493SS..Hα-helixtrans-62.1-43.7177.5-76.7-3.3000111.2A493 V494 N499 L500 Y501A493-D497 VanDerWaalsContact O-CB 3.26Å; A493-D497 WeakPolarHBondContact O-CB 3.36Å; A493-D497 PolarHBondContact O-N 2.78Å; V494-D497 PolarHBondContact O-N 3.38Å; D497-N499 VanDerWaalsContact C-N 3.3Å; D497-N499 PolarHBondContact O-N 3.09Å; D497-L500 CarbonylContact O-C 3.58Å; D497-L500 PolarHBondContact O-N 3.47Å; D497-L500 VanDerWaalsContact O-N 3.16Å; D497-Y501 HydrophobicContact CB-CD2 4.4Å; D497-Y501 HydrophobicContact CB-CE2 4Å; D497-Y501 WeakPolarHBondContact O-CD2 3.39Å; D497-Y501 PolarHBondContact O-N 2.89Å
498R74.2Confident73.4Confident175 Ų17596.3 Ų96.366%0.6648%0.484SS*.Hα-helixtrans-57.2-46173.3-170.5-163.577.8159.77.7111.5V494 S496 L500 S502V494-R498 WeakPolarHBondContact O-CB 3.41Å; V494-R498 PolarHBondContact O-N 3.25Å; S496-R498 PolarHBondContact O-N 3.13Å; R498-L500 VanDerWaalsContact C-N 3.34Å; R498-S502 PolarHBondContact O-N 3.26Å
499N77.3Confident72.2Confident76 Ų7698.7 Ų98.741%0.40650%0.495SS..Hα-helixtrans-69.9-35.5178.3-65.9-13000111.2R495 S496 D497 S502 K503R495-N499 PolarHBondContact O-N 2.94Å; R495-N499 VanDerWaalsContact O-N 3.1Å; R495-N499 PolarHBondContact O-ND2 2.99Å; S496-N499 CarbonylContact O-C 3.59Å; S496-N499 PolarHBondContact O-N 3.31Å; S496-N499 VanDerWaalsContact O-N 3.15Å; D497-N499 VanDerWaalsContact C-N 3.3Å; D497-N499 PolarHBondContact O-N 3.09Å; N499-S502 CarbonylContact O-C 3.58Å; N499-S502 WeakPolarHBondContact O-CB 3.47Å; N499-S502 PolarHBondContact O-N 2.98Å; N499-K503 VanDerWaalsContact O-CB 3.28Å; N499-K503 WeakPolarHBondContact O-CB 3.48Å; N499-K503 PolarHBondContact O-N 2.86Å
500L71.1Confident71.2Confident71 Ų7199 Ų9937%0.37250%0.496SS..Hα-helixtrans-70.9-40.5-179.5-174.173000110.5S496 D497 R498 S502 K503 N504S496-L500 WeakPolarHBondContact O-CA 3.35Å; S496-L500 WeakPolarHBondContact O-CB 3.5Å; S496-L500 PolarHBondContact O-N 2.88Å; D497-L500 CarbonylContact O-C 3.58Å; D497-L500 PolarHBondContact O-N 3.47Å; D497-L500 VanDerWaalsContact O-N 3.16Å; R498-L500 VanDerWaalsContact C-N 3.34Å; L500-S502 VanDerWaalsContact C-N 3.28Å; L500-S502 PolarHBondContact O-N 3.4Å; L500-K503 CarbonylContact O-C 3.54Å; L500-K503 PolarHBondContact O-N 3.06Å; L500-K503 VanDerWaalsContact O-N 3.16Å; L500-N504 VanDerWaalsContact CD1-OD1 3.31Å; L500-N504 WeakPolarHBondContact CD1-OD1 3.05Å; L500-N504 WeakPolarHBondContact O-CA 3.5Å; L500-N504 WeakPolarHBondContact O-CB 3.38Å; L500-N504 PolarHBondContact O-N 2.9Å; L500-N504 PolarHBondContact O-OD1 3.12Å
501Y70.2Confident69.7Low162 Ų16297.2 Ų97.264%0.63549%0.485SS*.Hα-helixtrans-65.8-34.5172.8-68.6-58.5000112D497 K503 L505D497-Y501 HydrophobicContact CB-CD2 4.4Å; D497-Y501 HydrophobicContact CB-CE2 4Å; D497-Y501 WeakPolarHBondContact O-CD2 3.39Å; D497-Y501 PolarHBondContact O-N 2.89Å; Y501-K503 VanDerWaalsContact C-N 3.34Å; Y501-L505 PolarHBondContact O-N 3.4Å
502S70.6Confident68.2Low87 Ų8795.6 Ų95.661%0.60849%0.486SS*.Hα-helixtrans-69.1-34172.9-151.70000112.2R498 N499 L500R498-S502 PolarHBondContact O-N 3.26Å; N499-S502 CarbonylContact O-C 3.58Å; N499-S502 WeakPolarHBondContact O-CB 3.47Å; N499-S502 PolarHBondContact O-N 2.98Å; L500-S502 VanDerWaalsContact C-N 3.28Å; L500-S502 PolarHBondContact O-N 3.4Å
503K66.3Low67.1Low114 Ų11495 Ų9550%0.49649%0.49SS..Hα-helixtrans-79.7-48.8178.5-158.8-169.1-175.9-141.70111.5N499 L500 Y501 L505 V506 E507N499-K503 VanDerWaalsContact O-CB 3.28Å; N499-K503 WeakPolarHBondContact O-CB 3.48Å; N499-K503 PolarHBondContact O-N 2.86Å; L500-K503 CarbonylContact O-C 3.54Å; L500-K503 PolarHBondContact O-N 3.06Å; L500-K503 VanDerWaalsContact O-N 3.16Å; Y501-K503 VanDerWaalsContact C-N 3.34Å; K503-L505 PolarHBondContact O-N 3.08Å; K503-L505 VanDerWaalsContact O-N 3.17Å; K503-V506 CarbonylContact O-C 3.6Å; K503-V506 WeakPolarHBondContact O-CA 3.39Å; K503-V506 WeakPolarHBondContact O-CB 3.49Å; K503-V506 PolarHBondContact O-N 3.36Å; K503-E507 HydrophobicContact CD-CG 4.5Å; K503-E507 VanDerWaalsContact CD-OE2 3.27Å; K503-E507 WeakPolarHBondContact CD-OE2 3.44Å; K503-E507 VanDerWaalsContact CE-CD 3.46Å; K503-E507 WeakPolarHBondContact CE-OE1 3.46Å; K503-E507 HydrophobicContact CG-CG 3.99Å; K503-E507 WeakPolarHBondContact CG-OE2 3.44Å; K503-E507 IonicContact NZ-OE1 3.47Å; K503-E507 PolarHBondContact NZ-OE1 3.12Å; K503-E507 IonicContact NZ-OE2 3.11Å; K503-E507 PolarHBondContact O-N 3.29Å
504N67.5Low65.9Low60 Ų6097.5 Ų97.532%0.32150%0.496SS..Hα-helixtrans-55.4-27.4173.6-71-0.2000113.1L500 V506 A508L500-N504 VanDerWaalsContact CD1-OD1 3.31Å; L500-N504 WeakPolarHBondContact CD1-OD1 3.05Å; L500-N504 WeakPolarHBondContact O-CA 3.5Å; L500-N504 WeakPolarHBondContact O-CB 3.38Å; L500-N504 PolarHBondContact O-N 2.9Å; L500-N504 PolarHBondContact O-OD1 3.12Å; N504-V506 VanDerWaalsContact C-N 3.31Å; N504-A508 WeakPolarHBondContact O-CA 3.49Å; N504-A508 WeakPolarHBondContact O-CB 3.39Å; N504-A508 PolarHBondContact O-N 2.99Å
505L63.4Low64.5Low123 Ų12398.4 Ų98.464%0.64449%0.494SS*.Hα-helixtrans-67.1-36.3171.2-174.467.4000111.7Y501 K503 Q509Y501-L505 PolarHBondContact O-N 3.4Å; K503-L505 PolarHBondContact O-N 3.08Å; K503-L505 VanDerWaalsContact O-N 3.17Å; L505-Q509 WeakPolarHBondContact O-CG 3.48Å
506V64.3Low63.2Low76 Ų76100 Ų10046%0.46151%0.505SS..Hα-helixtrans-83.3-42.9176.8-177.60000110.5K503 N504 Q509 D510K503-V506 CarbonylContact O-C 3.6Å; K503-V506 WeakPolarHBondContact O-CA 3.39Å; K503-V506 WeakPolarHBondContact O-CB 3.49Å; K503-V506 PolarHBondContact O-N 3.36Å; N504-V506 VanDerWaalsContact C-N 3.31Å; V506-Q509 WeakPolarHBondContact O-CA 3.4Å; V506-Q509 VanDerWaalsContact O-CB 3.28Å; V506-Q509 WeakPolarHBondContact O-CB 3.37Å; V506-Q509 PolarHBondContact O-N 3.48Å; V506-D510 PolarHBondContact O-N 3.04Å; V506-D510 VanDerWaalsContact O-N 3.1Å
507E56.5Low62Low48 Ų48106.7 Ų106.722%0.22452%0.522CS..Hα-helixtrans-70.8-31.3178-71.9-179146.300111.7K503 Q509 D510 E511K503-E507 HydrophobicContact CD-CG 4.5Å; K503-E507 VanDerWaalsContact CD-OE2 3.27Å; K503-E507 WeakPolarHBondContact CD-OE2 3.44Å; K503-E507 VanDerWaalsContact CE-CD 3.46Å; K503-E507 WeakPolarHBondContact CE-OE1 3.46Å; K503-E507 HydrophobicContact CG-CG 3.99Å; K503-E507 WeakPolarHBondContact CG-OE2 3.44Å; K503-E507 IonicContact NZ-OE1 3.47Å; K503-E507 PolarHBondContact NZ-OE1 3.12Å; K503-E507 IonicContact NZ-OE2 3.11Å; K503-E507 PolarHBondContact O-N 3.29Å; E507-Q509 PolarHBondContact O-N 3.39Å; E507-D510 CarbonylContact O-C 3.59Å; E507-D510 PolarHBondContact O-N 3.19Å; E507-D510 VanDerWaalsContact O-N 3.08Å; E507-E511 HydrophobicContact CB-CG 4.3Å; E507-E511 WeakPolarHBondContact O-CA 3.48Å; E507-E511 WeakPolarHBondContact O-CB 3.37Å; E507-E511 WeakPolarHBondContact O-CG 3.08Å; E507-E511 PolarHBondContact O-N 2.95Å
508A56.4Low60.7Low53 Ų53108 Ų10844%0.43852%0.524SS..Hα-helixtrans-64-23170.200000112.1N504 I512N504-A508 WeakPolarHBondContact O-CA 3.49Å; N504-A508 WeakPolarHBondContact O-CB 3.39Å; N504-A508 PolarHBondContact O-N 2.99Å; A508-I512 WeakPolarHBondContact O-CG1 3.3Å
509Q57.6Low59.7Low136 Ų136106.4 Ų106.464%0.63653%0.528SS*.Hα-helixtrans-79.2-36.7172.7-60.7173.1-18.800111L505 V506 E507L505-Q509 WeakPolarHBondContact O-CG 3.48Å; V506-Q509 WeakPolarHBondContact O-CA 3.4Å; V506-Q509 VanDerWaalsContact O-CB 3.28Å; V506-Q509 WeakPolarHBondContact O-CB 3.37Å; V506-Q509 PolarHBondContact O-N 3.48Å; E507-Q509 PolarHBondContact O-N 3.39Å
510D61.4Low58.7Low88 Ų88111.4 Ų111.447%0.47155%0.546SS..Hα-helixtrans-85.5-32.2179.6-67.1-27.3000113.9V506 E507 I512 T513 E514V506-D510 PolarHBondContact O-N 3.04Å; V506-D510 VanDerWaalsContact O-N 3.1Å; E507-D510 CarbonylContact O-C 3.59Å; E507-D510 PolarHBondContact O-N 3.19Å; E507-D510 VanDerWaalsContact O-N 3.08Å; D510-I512 VanDerWaalsContact C-N 3.3Å; D510-I512 PolarHBondContact O-N 3.44Å; D510-T513 CarbonylContact O-C 3.57Å; D510-T513 WeakPolarHBondContact O-CA 3.43Å; D510-T513 WeakPolarHBondContact O-CB 3.49Å; D510-T513 PolarHBondContact O-N 2.93Å; D510-T513 PolarHBondContact O-OG1 2.93Å; D510-E514 PolarHBondContact O-N 3.31Å
511E50Low58.3Low77 Ų77113 Ų11336%0.3655%0.554SS.*Hα-helixtrans-69-26.6-177.8-79.5-175.115100111.9E507 T513 E514 M515E507-E511 HydrophobicContact CB-CG 4.3Å; E507-E511 WeakPolarHBondContact O-CA 3.48Å; E507-E511 WeakPolarHBondContact O-CB 3.37Å; E507-E511 WeakPolarHBondContact O-CG 3.08Å; E507-E511 PolarHBondContact O-N 2.95Å; E511-T513 PolarHBondContact O-N 3.08Å; E511-E514 PolarHBondContact O-N 3.33Å; E511-M515 HydrophobicContact CB-CG 4.42Å; E511-M515 WeakPolarHBondContact O-CB 3.41Å; E511-M515 WeakPolarHBondContact O-CG 3.48Å; E511-M515 PolarHBondContact O-N 3.19Å
512I52.1Low58Low130 Ų130111.1 Ų111.167%0.66755%0.552SS**Hα-helixtrans-59.9-34.5168-68.2172.8000110.2A508 D510A508-I512 WeakPolarHBondContact O-CG1 3.3Å; D510-I512 VanDerWaalsContact C-N 3.3Å; D510-I512 PolarHBondContact O-N 3.44Å
513T58.5Low57.7Low103 Ų103111.6 Ų111.663%0.63255%0.552SS**Hα-helixtrans-83.9-33.1178720000112.5D510 E511D510-T513 CarbonylContact O-C 3.57Å; D510-T513 WeakPolarHBondContact O-CA 3.43Å; D510-T513 WeakPolarHBondContact O-CB 3.49Å; D510-T513 PolarHBondContact O-N 2.93Å; D510-T513 PolarHBondContact O-OG1 2.93Å; E511-T513 PolarHBondContact O-N 3.08Å
514E53.4Low57.9Low94 Ų94113.1 Ų113.144%0.43956%0.56SS.*Hα-helixtrans-92.1-23-173.6-160.4166.3-152.700114.9D510 E511 K516 R517 K518D510-E514 PolarHBondContact O-N 3.31Å; E511-E514 PolarHBondContact O-N 3.33Å; E514-K516 PolarHBondContact O-N 3.46Å; E514-R517 WeakPolarHBondContact O-CA 3.46Å; E514-R517 WeakPolarHBondContact O-CB 3.47Å; E514-R517 PolarHBondContact O-N 2.87Å; E514-K518 PolarHBondContact O-N 2.85Å; E514-K518 VanDerWaalsContact O-N 3.14Å
515M49.2Very low58.1Low118 Ų118114.7 Ų114.758%0.58157%0.566SS**Hα-helixtrans-62.1-23173.2-76-65.3-84.400112.7E511 R517E511-M515 HydrophobicContact CB-CG 4.42Å; E511-M515 WeakPolarHBondContact O-CB 3.41Å; E511-M515 WeakPolarHBondContact O-CG 3.48Å; E511-M515 PolarHBondContact O-N 3.19Å; M515-R517 PolarHBondContact O-N 2.99Å
516K52.2Low58.4Low183 Ų183112.6 Ų112.680%0.79656%0.558SS**Hα-helixtrans-67.7-20.6169.2-70.8-176.7177.8177.50113.4E514E514-K516 PolarHBondContact O-N 3.46Å
517R52.7Low58.9Low201 Ų201113.3 Ų113.376%0.75856%0.559SS**Hα-helixtrans-97.1-40.5-178.7-128177.2179.1167.1-0.9112.6E514 M515 L519 K520E514-R517 WeakPolarHBondContact O-CA 3.46Å; E514-R517 WeakPolarHBondContact O-CB 3.47Å; E514-R517 PolarHBondContact O-N 2.87Å; M515-R517 PolarHBondContact O-N 2.99Å; R517-L519 VanDerWaalsContact C-N 3.33Å; R517-L519 PolarHBondContact O-N 3.07Å; R517-K520 PolarHBondContact O-N 3.29Å
518K50.6Low59.8Low92 Ų92116.9 Ų116.940%0.458%0.576SS.*Hα-helixtrans-66.7-25.3-175.9-75.1178.7-178.7167.70114.9E514 K520 I521 M522E514-K518 PolarHBondContact O-N 2.85Å; E514-K518 VanDerWaalsContact O-N 3.14Å; K518-K520 PolarHBondContact O-N 3.42Å; K518-K520 VanDerWaalsContact O-N 3.14Å; K518-I521 PolarHBondContact O-N 3.2Å; K518-M522 PolarHBondContact O-N 3.38Å
519L52.5Low60.8Low143 Ų143119.1 Ų119.175%0.74958%0.58SS**THydrogen-bonded Turntrans-63.3-21.2179.1-150.8140.3000113.1R517R517-L519 VanDerWaalsContact C-N 3.33Å; R517-L519 PolarHBondContact O-N 3.07Å
520K56Low61.7Low180 Ų180119.1 Ų119.178%0.78358%0.578SS**THydrogen-bonded Turntrans-81.7-17.9174.8-73.8-175.9176.2-178.20114.5R517 K518R517-K520 PolarHBondContact O-N 3.29Å; K518-K520 PolarHBondContact O-N 3.42Å; K518-K520 VanDerWaalsContact O-N 3.14Å
521I63Low62.5Low105 Ų105122.1 Ų122.154%0.53859%0.589SS.*THydrogen-bonded Turntrans-94.9-35.4-173.8-63.5168.1000111.5K518 T523 H524K518-I521 PolarHBondContact O-N 3.2Å; I521-T523 PolarHBondContact O-N 3.04Å; I521-H524 PolarHBondContact O-N 3.11Å
522M63.3Low63.9Low122 Ų122123.9 Ų123.960%0.60160%0.597SS**Hα-helixtrans-58.6-30.7-179.2-93.4-90.3158.100113.9K518 H524 Q525K518-M522 PolarHBondContact O-N 3.38Å; M522-H524 PolarHBondContact O-N 3.34Å; M522-Q525 PolarHBondContact O-N 3.34Å
523T65.8Low65.2Low97 Ų97122.6 Ų122.660%0.59559%0.591SS**Hα-helixtrans-63.4-28.9176.5-0.80000113I521I521-T523 PolarHBondContact O-N 3.04Å
524H69.8Low66.4Low146 Ų146121.3 Ų121.368%0.67659%0.586SS**Hα-helixtrans-82.2-28.6-179.2-119.234000113.5I521 M522I521-H524 PolarHBondContact O-N 3.11Å; M522-H524 PolarHBondContact O-N 3.34Å
525Q70.8Confident67.7Low93 Ų93120 Ų12044%0.43559%0.591SS.*Hα-helixtrans-75.4-29.4-178.4-72.6179.4-34.600113M522 D527 Q528 L529M522-Q525 PolarHBondContact O-N 3.34Å; Q525-D527 VanDerWaalsContact C-N 3.27Å; Q525-D527 PolarHBondContact O-N 3.41Å; Q525-Q528 PolarHBondContact O-N 2.98Å; Q525-L529 PolarHBondContact O-N 3.11Å
526V70.6Confident69.4Low79 Ų79121.4 Ų121.448%0.47959%0.594SS.*Hα-helixtrans-65.4-32.9177.7173.40000111.6
527D75.3Confident70.9Confident91 Ų91118.7 Ų118.749%0.48758%0.584SS.*Hα-helixtrans-75-37179.4-68.6-27.7000111.9Q525 L529 K530Q525-D527 VanDerWaalsContact C-N 3.27Å; Q525-D527 PolarHBondContact O-N 3.41Å; D527-L529 PolarHBondContact O-N 3.35Å; D527-K530 PolarHBondContact O-N 2.88Å
528Q73.8Confident72.4Confident123 Ų123111.9 Ų111.958%0.57557%0.571SS**Hα-helixtrans-61.9-43.1175.3-75.6-179.6-23.700113Q525 K530 E531 E532Q525-Q528 PolarHBondContact O-N 2.98Å; Q528-K530 VanDerWaalsContact C-N 3.26Å; Q528-K530 PolarHBondContact O-N 3.47Å; Q528-E531 PolarHBondContact O-N 3.41Å; Q528-E532 PolarHBondContact O-N 2.82Å
529L77.4Confident74Confident101 Ų101110.2 Ų110.253%0.52957%0.574SS.*Hα-helixtrans-67-27-178.2-70.4171.5000113.1Q525 D527 I533Q525-L529 PolarHBondContact O-N 3.11Å; D527-L529 PolarHBondContact O-N 3.35Å; L529-I533 WeakPolarHBondContact O-CG1 3.07Å; L529-I533 PolarHBondContact O-N 2.95Å
530K76.4Confident75.5Confident136 Ų136109.3 Ų109.359%0.59157%0.569SS**Hα-helixtrans-69-38.2174.9-73.2175-178.6168.40112D527 Q528 S534D527-K530 PolarHBondContact O-N 2.88Å; Q528-K530 VanDerWaalsContact C-N 3.26Å; Q528-K530 PolarHBondContact O-N 3.47Å; K530-S534 PolarHBondContact O-N 2.84Å
531E78.3Confident77Confident151 Ų151105 Ų10571%0.70656%0.558SS**Hα-helixtrans-67.3-39.8176.8-68.6-174.6166.800111.8Q528 I533 S534 A535Q528-E531 PolarHBondContact O-N 3.41Å; E531-I533 PolarHBondContact O-N 2.97Å; E531-S534 PolarHBondContact O-N 3.5Å; E531-A535 PolarHBondContact O-N 3.36Å
532E79.9Confident78.1Confident113 Ų113107.6 Ų107.653%0.52857%0.565SS.*Hα-helixtrans-64.4-39.3178.6-70.5-173.6-178.600113.4Q528 A535 K536Q528-E532 PolarHBondContact O-N 2.82Å; E532-A535 PolarHBondContact O-N 3.32Å; E532-K536 PolarHBondContact O-N 3.22Å; E532-K536 VanDerWaalsContact O-N 3.13Å
533I80.5Confident79.1Confident103 Ų103107.6 Ų107.653%0.52857%0.567SS.*Hα-helixtrans-63.9-46.4177.4-69169.2000110L529 E531 A535 K536 E537L529-I533 WeakPolarHBondContact O-CG1 3.07Å; L529-I533 PolarHBondContact O-N 2.95Å; E531-I533 PolarHBondContact O-N 2.97Å; I533-A535 VanDerWaalsContact C-N 3.31Å; I533-A535 PolarHBondContact O-N 3.49Å; I533-K536 PolarHBondContact O-N 3.38Å; I533-K536 VanDerWaalsContact O-N 3.13Å; I533-E537 PolarHBondContact O-N 3.38Å
534S82.4Confident80Confident77 Ų77108.2 Ų108.254%0.53856%0.563SS.*Hα-helixtrans-59.2-41.1178-172.70000112.1K530 E531 K536 E537 A538K530-S534 PolarHBondContact O-N 2.84Å; E531-S534 PolarHBondContact O-N 3.5Å; S534-K536 PolarHBondContact O-N 3.16Å; S534-E537 PolarHBondContact O-N 3.06Å; S534-A538 PolarHBondContact O-N 3.43Å; S534-A538 VanDerWaalsContact O-N 3.13Å
535A82.1Confident80.9Confident65 Ų65106.4 Ų106.454%0.53756%0.558SS.*Hα-helixtrans-63.8-39.2176.100000113E531 E532 I533 A539E531-A535 PolarHBondContact O-N 3.36Å; E532-A535 PolarHBondContact O-N 3.32Å; I533-A535 VanDerWaalsContact C-N 3.31Å; I533-A535 PolarHBondContact O-N 3.49Å; A535-A539 PolarHBondContact O-N 3Å; A535-A539 VanDerWaalsContact O-N 3.15Å
536K84.1Confident81.7Confident149 Ų149107 Ų10765%0.64856%0.561SS**Hα-helixtrans-71.4-37.7178.3-73.1-171.5-178178.10112.7E532 I533 S534 A538 A539 L540E532-K536 PolarHBondContact O-N 3.22Å; E532-K536 VanDerWaalsContact O-N 3.13Å; I533-K536 PolarHBondContact O-N 3.38Å; I533-K536 VanDerWaalsContact O-N 3.13Å; S534-K536 PolarHBondContact O-N 3.16Å; K536-A538 VanDerWaalsContact C-N 3.34Å; K536-A539 PolarHBondContact O-N 3.2Å; K536-L540 PolarHBondContact O-N 3.05Å
537E84.1Confident82.5Confident126 Ų126107.8 Ų107.859%0.58956%0.559SS**Hα-helixtrans-61.3-43.7174.1-72.9-178.9165.800111.3I533 S534 A539 L540 V541I533-E537 PolarHBondContact O-N 3.38Å; S534-E537 PolarHBondContact O-N 3.06Å; E537-A539 VanDerWaalsContact C-N 3.32Å; E537-A539 PolarHBondContact O-N 2.89Å; E537-L540 PolarHBondContact O-N 3.34Å; E537-V541 WeakPolarHBondContact O-CG2 3.38Å; E537-V541 PolarHBondContact O-N 3.09Å; E537-V541 VanDerWaalsContact O-N 3.13Å
538A83.2Confident83Confident58 Ų58107.8 Ų107.848%0.47956%0.556SS.*Hα-helixtrans-62-37.5175.300000112.9S534 K536 K542S534-A538 PolarHBondContact O-N 3.43Å; S534-A538 VanDerWaalsContact O-N 3.13Å; K536-A538 VanDerWaalsContact C-N 3.34Å; A538-K542 PolarHBondContact O-N 3.07Å
539A84.8Confident83.7Confident57 Ų57108.9 Ų108.947%0.47156%0.555SS.*Hα-helixtrans-67.1-40.4176.100000112.4A535 K536 E537 K542 L543A535-A539 PolarHBondContact O-N 3Å; A535-A539 VanDerWaalsContact O-N 3.15Å; K536-A539 PolarHBondContact O-N 3.2Å; E537-A539 VanDerWaalsContact C-N 3.32Å; E537-A539 PolarHBondContact O-N 2.89Å; A539-K542 PolarHBondContact O-N 3.25Å; A539-L543 PolarHBondContact O-N 3.3Å; A539-L543 VanDerWaalsContact O-N 3.07Å
540L84Confident84.2Confident123 Ų123108.7 Ų108.764%0.64455%0.554SS**Hα-helixtrans-61.6-43.5176.7-102.6152.6000112.3K536 E537 K542 L543 H544K536-L540 PolarHBondContact O-N 3.05Å; E537-L540 PolarHBondContact O-N 3.34Å; L540-K542 PolarHBondContact O-N 3Å; L540-L543 PolarHBondContact O-N 3.18Å; L540-H544 PolarHBondContact O-N 3.09Å
541V87Confident84.7Confident91 Ų91106.9 Ų106.955%0.55255%0.547SS*.Hα-helixtrans-62.1-42.2177.2174.70000111.4E537 L543 H544 L545E537-V541 WeakPolarHBondContact O-CG2 3.38Å; E537-V541 PolarHBondContact O-N 3.09Å; E537-V541 VanDerWaalsContact O-N 3.13Å; V541-L543 PolarHBondContact O-N 3.37Å; V541-H544 PolarHBondContact O-N 3.09Å; V541-L545 HydrophobicContact CG1-CD1 4.43Å; V541-L545 PolarHBondContact O-N 3.1Å; V541-L545 VanDerWaalsContact O-N 3.16Å
542K86.2Confident85.2Confident158 Ų158106.5 Ų106.569%0.68754%0.543SS*.Hα-helixtrans-61.2-44.3175.5-77.5-175.1177.5-179.40112.2A538 A539 L540 H544 L545 E546A538-K542 PolarHBondContact O-N 3.07Å; A539-K542 PolarHBondContact O-N 3.25Å; L540-K542 PolarHBondContact O-N 3Å; K542-H544 VanDerWaalsContact C-N 3.3Å; K542-H544 PolarHBondContact O-N 3.05Å; K542-L545 PolarHBondContact O-N 3.02Å; K542-E546 PolarHBondContact O-N 2.9Å; K542-E546 VanDerWaalsContact O-N 3.07Å
543L84.6Confident85.5Confident123 Ų123105.1 Ų105.164%0.64454%0.537SS*.Hα-helixtrans-64.9-36.6-179-136.4150.9000111.6A539 L540 V541 E546 Q547A539-L543 PolarHBondContact O-N 3.3Å; A539-L543 VanDerWaalsContact O-N 3.07Å; L540-L543 PolarHBondContact O-N 3.18Å; V541-L543 PolarHBondContact O-N 3.37Å; L543-E546 PolarHBondContact O-N 3.48Å; L543-Q547 PolarHBondContact O-N 3.48Å
544H85.6Confident85.9Confident110 Ų110106.3 Ų106.351%0.50954%0.538SS..Hα-helixtrans-68.5-38.1176.9-15846.6000112.8L540 V541 K542 Q547 Q548L540-H544 PolarHBondContact O-N 3.09Å; V541-H544 PolarHBondContact O-N 3.09Å; K542-H544 VanDerWaalsContact C-N 3.3Å; K542-H544 PolarHBondContact O-N 3.05Å; H544-Q547 PolarHBondContact O-N 2.82Å; H544-Q548 PolarHBondContact O-N 3.32Å; H544-Q548 VanDerWaalsContact O-N 3.16Å
545L88.6Confident86.2Confident108 Ų108109.2 Ų109.257%0.56554%0.543SS*.Hα-helixtrans-65.2-39.9173.4-73169.1000112.3V541 K542 Q548 R549V541-L545 HydrophobicContact CG1-CD1 4.43Å; V541-L545 PolarHBondContact O-N 3.1Å; V541-L545 VanDerWaalsContact O-N 3.16Å; K542-L545 PolarHBondContact O-N 3.02Å; L545-Q548 PolarHBondContact O-N 2.94Å; L545-R549 PolarHBondContact O-N 3.37Å; L545-R549 VanDerWaalsContact O-N 3.14Å
546E86.5Confident86.4Confident106 Ų106110 Ų11050%0.49554%0.541SS..Hα-helixtrans-62.7-43.1175.9-157.478.8-151.500111.1K542 L543 Q548 R549 I550K542-E546 PolarHBondContact O-N 2.9Å; K542-E546 VanDerWaalsContact O-N 3.07Å; L543-E546 PolarHBondContact O-N 3.48Å; E546-Q548 PolarHBondContact O-N 3.15Å; E546-R549 WeakPolarHBondContact O-CB 3.49Å; E546-R549 PolarHBondContact O-N 2.94Å; E546-I550 HydrophobicContact CG-CD1 4.38Å; E546-I550 WeakPolarHBondContact O-CG1 3.35Å; E546-I550 PolarHBondContact O-N 3.41Å
547Q86.8Confident86.6Confident94 Ų94107.9 Ų107.944%0.43954%0.537SS..Hα-helixtrans-59.9-46.6176.9-176.2-176.4-12.600112L543 H544 R549 I550 E551L543-Q547 PolarHBondContact O-N 3.48Å; H544-Q547 PolarHBondContact O-N 2.82Å; Q547-R549 VanDerWaalsContact C-N 3.26Å; Q547-R549 PolarHBondContact O-N 2.69Å; Q547-I550 PolarHBondContact O-N 3.37Å; Q547-E551 PolarHBondContact NE2-OE1 3.05Å; Q547-E551 PolarHBondContact O-N 2.79Å
548Q87.4Confident86.7Confident91 Ų91108.5 Ų108.543%0.42554%0.537SS..Hα-helixtrans-62-34.3177.8-73.4-176.23.300112.5H544 L545 E546 K552H544-Q548 PolarHBondContact O-N 3.32Å; H544-Q548 VanDerWaalsContact O-N 3.16Å; L545-Q548 PolarHBondContact O-N 2.94Å; E546-Q548 PolarHBondContact O-N 3.15Å; Q548-K552 WeakPolarHBondContact O-CG 3.45Å; Q548-K552 PolarHBondContact O-N 3.05Å
549R88.5Confident87Confident147 Ų147108.6 Ų108.656%0.55554%0.538SS*.Hα-helixtrans-66.1-47175.1-177.5-173.1161.7-179.2-2.4111.3L545 E546 Q547 E551 K552 E553L545-R549 PolarHBondContact O-N 3.37Å; L545-R549 VanDerWaalsContact O-N 3.14Å; E546-R549 WeakPolarHBondContact O-CB 3.49Å; E546-R549 PolarHBondContact O-N 2.94Å; Q547-R549 VanDerWaalsContact C-N 3.26Å; Q547-R549 PolarHBondContact O-N 2.69Å; R549-E551 VanDerWaalsContact C-N 3.32Å; R549-E551 PolarHBondContact O-N 3.12Å; R549-K552 PolarHBondContact O-N 2.99Å; R549-E553 IonicContact CZ-OE1 2.84Å; R549-E553 IonicContact NE-OE1 3.38Å; R549-E553 PolarHBondContact NE-OE1 3.26Å; R549-E553 IonicContact NH2-OE1 2.79Å; R549-E553 PolarHBondContact NH2-OE1 3.46Å; R549-E553 PolarHBondContact O-N 3.37Å
550I87.4Confident87.1Confident96 Ų96111.3 Ų111.349%0.49254%0.541SS..Hα-helixtrans-63.3-37.9179.1-66.7168.1000111.4E546 Q547 E553 K554E546-I550 HydrophobicContact CG-CD1 4.38Å; E546-I550 WeakPolarHBondContact O-CG1 3.35Å; E546-I550 PolarHBondContact O-N 3.41Å; Q547-I550 PolarHBondContact O-N 3.37Å; I550-E553 PolarHBondContact O-N 3.18Å; I550-K554 WeakPolarHBondContact O-CB 3.29Å; I550-K554 PolarHBondContact O-N 2.97Å
551E87Confident87.2Confident99 Ų99109.9 Ų109.946%0.46353%0.534SS..Hα-helixtrans-62.7-41.5175.9-82.2169.6179.300112.3Q547 R549 K554 E555Q547-E551 PolarHBondContact NE2-OE1 3.05Å; Q547-E551 PolarHBondContact O-N 2.79Å; R549-E551 VanDerWaalsContact C-N 3.32Å; R549-E551 PolarHBondContact O-N 3.12Å; E551-K554 WeakPolarHBondContact O-CB 3.4Å; E551-K554 PolarHBondContact O-N 3.3Å; E551-E555 PolarHBondContact O-N 3.3Å; E551-E555 VanDerWaalsContact O-N 3.11Å
552K88.8Confident87.3Confident143 Ų143112.1 Ų112.162%0.62254%0.538SS*.Hα-helixtrans-64.1-43.8173.8-71.8177.8-179.3176.70112.3Q548 R549 K554 E555 T556Q548-K552 WeakPolarHBondContact O-CG 3.45Å; Q548-K552 PolarHBondContact O-N 3.05Å; R549-K552 PolarHBondContact O-N 2.99Å; K552-K554 VanDerWaalsContact C-N 3.29Å; K552-K554 PolarHBondContact O-N 2.99Å; K552-E555 PolarHBondContact O-N 3.49Å; K552-T556 PolarHBondContact O-N 2.92Å; K552-T556 PolarHBondContact O-OG1 3.04Å
553E86.7Confident87.5Confident83 Ų83111.3 Ų111.339%0.38854%0.535SS..Hα-helixtrans-62.6-36.2177.1-71.4175.9-171.800111.8R549 I550 T556 L557R549-E553 IonicContact CZ-OE1 2.84Å; R549-E553 IonicContact NE-OE1 3.38Å; R549-E553 PolarHBondContact NE-OE1 3.26Å; R549-E553 IonicContact NH2-OE1 2.79Å; R549-E553 PolarHBondContact NH2-OE1 3.46Å; R549-E553 PolarHBondContact O-N 3.37Å; I550-E553 PolarHBondContact O-N 3.18Å; E553-T556 WeakPolarHBondContact CA-OG1 3.48Å; E553-T556 PolarHBondContact O-N 3.41Å; E553-T556 PolarHBondContact O-OG1 3.2Å; E553-L557 WeakPolarHBondContact O-CB 3.37Å; E553-L557 VanDerWaalsContact O-CG 3.31Å; E553-L557 WeakPolarHBondContact O-CG 3.45Å; E553-L557 PolarHBondContact O-N 3.5Å
554K88.2Confident87.6Confident128 Ų128110.6 Ų110.656%0.55753%0.531SS*.Hα-helixtrans-65.7-39.6174.6-179.3-175.5176.5-176.60112.4I550 E551 K552 K558I550-K554 WeakPolarHBondContact O-CB 3.29Å; I550-K554 PolarHBondContact O-N 2.97Å; E551-K554 WeakPolarHBondContact O-CB 3.4Å; E551-K554 PolarHBondContact O-N 3.3Å; K552-K554 VanDerWaalsContact C-N 3.29Å; K552-K554 PolarHBondContact O-N 2.99Å; K554-K558 WeakPolarHBondContact O-CG 3.46Å; K554-K558 PolarHBondContact O-N 3.37Å
555E88.3Confident87.8Confident138 Ų138113.6 Ų113.665%0.64554%0.538SS*.Hα-helixtrans-66.6-42.6176.2-73.6-176.8166.800111.8E551 K552 K558 A559E551-E555 PolarHBondContact O-N 3.3Å; E551-E555 VanDerWaalsContact O-N 3.11Å; K552-E555 PolarHBondContact O-N 3.49Å; E555-K558 PolarHBondContact O-N 3.18Å; E555-A559 PolarHBondContact O-N 3.48Å; E555-A559 VanDerWaalsContact O-N 3.13Å
556T87.6Confident87.9Confident81 Ų81114 Ų11450%0.49754%0.537SS..Hα-helixtrans-63-44.4176.152.30000111.8K552 E553 K558 A559 E560K552-T556 PolarHBondContact O-N 2.92Å; K552-T556 PolarHBondContact O-OG1 3.04Å; E553-T556 WeakPolarHBondContact CA-OG1 3.48Å; E553-T556 PolarHBondContact O-N 3.41Å; E553-T556 PolarHBondContact O-OG1 3.2Å; T556-K558 VanDerWaalsContact C-N 3.34Å; T556-K558 PolarHBondContact O-N 3.18Å; T556-A559 PolarHBondContact O-N 3.16Å; T556-E560 PolarHBondContact O-N 3.18Å
557L86.5Confident88Confident106 Ų106113.5 Ų113.556%0.55553%0.534SS*.Hα-helixtrans-64.4-36.2177.6-74.5169.6000112.6E553 E560 L561E553-L557 WeakPolarHBondContact O-CB 3.37Å; E553-L557 VanDerWaalsContact O-CG 3.31Å; E553-L557 WeakPolarHBondContact O-CG 3.45Å; E553-L557 PolarHBondContact O-N 3.5Å; L557-E560 PolarHBondContact O-N 3.38Å; L557-L561 VanDerWaalsContact O-CB 3.31Å; L557-L561 WeakPolarHBondContact O-CB 3.49Å; L557-L561 PolarHBondContact O-N 2.79Å
558K87.1Confident88Confident138 Ų138111.7 Ų111.760%0.654%0.536SS*.Hα-helixtrans-62.7-42.3173.7-84.1-177.3174.9-174.70112.1K554 E555 T556 L561 Q562K554-K558 WeakPolarHBondContact O-CG 3.46Å; K554-K558 PolarHBondContact O-N 3.37Å; E555-K558 PolarHBondContact O-N 3.18Å; T556-K558 VanDerWaalsContact C-N 3.34Å; T556-K558 PolarHBondContact O-N 3.18Å; K558-L561 PolarHBondContact O-N 3.05Å; K558-Q562 PolarHBondContact O-N 3.41Å
559A88.4Confident88.3Confident60 Ų60112.5 Ų112.550%0.49654%0.542SS..Hα-helixtrans-65.3-41.7177.700000111.9E555 T556 Q562 K563E555-A559 PolarHBondContact O-N 3.48Å; E555-A559 VanDerWaalsContact O-N 3.13Å; T556-A559 PolarHBondContact O-N 3.16Å; A559-Q562 PolarHBondContact O-N 2.95Å; A559-K563 PolarHBondContact O-N 3.33Å
560E87.2Confident88.4Confident115 Ų115111.2 Ų111.254%0.53754%0.542SS..Hα-helixtrans-62.8-43.5174.9-72.7179.2175.500112.2T556 L557 Q562 K563 L564T556-E560 PolarHBondContact O-N 3.18Å; L557-E560 PolarHBondContact O-N 3.38Å; E560-Q562 VanDerWaalsContact C-N 3.33Å; E560-Q562 PolarHBondContact O-N 2.92Å; E560-K563 WeakPolarHBondContact O-CB 3.44Å; E560-K563 PolarHBondContact O-N 3.25Å; E560-L564 WeakPolarHBondContact O-CG 3.47Å; E560-L564 PolarHBondContact O-N 3.41Å
561L86.2Confident88.4Confident93 Ų93110.5 Ų110.549%0.48754%0.543SS..Hα-helixtrans-65.6-36.6179.4-162.8142.8000111.9L557 K558 R565L557-L561 VanDerWaalsContact O-CB 3.31Å; L557-L561 WeakPolarHBondContact O-CB 3.49Å; L557-L561 PolarHBondContact O-N 2.79Å; K558-L561 PolarHBondContact O-N 3.05Å; L561-R565 HydrophobicContact CD2-CG 4.44Å; L561-R565 WeakPolarHBondContact O-CG 3.45Å; L561-R565 PolarHBondContact O-N 3Å
562Q89.7Confident88.6Confident138 Ų138111.6 Ų111.665%0.64555%0.546SS*.Hα-helixtrans-65.8-42.1173.1-171.6171.8-0.800111.8K558 A559 E560 R565 Q566K558-Q562 PolarHBondContact O-N 3.41Å; A559-Q562 PolarHBondContact O-N 2.95Å; E560-Q562 VanDerWaalsContact C-N 3.33Å; E560-Q562 PolarHBondContact O-N 2.92Å; Q562-R565 PolarHBondContact O-N 2.94Å; Q562-Q566 PolarHBondContact O-N 3.41Å; Q562-Q566 VanDerWaalsContact O-N 3.1Å
563K89.4Confident88.7Confident141 Ų141110.2 Ų110.261%0.61354%0.541SS*.Hα-helixtrans-62.2-44.1175.8-171.7-180178.9-1770112.1A559 E560 Q566 Q567A559-K563 PolarHBondContact O-N 3.33Å; E560-K563 WeakPolarHBondContact O-CB 3.44Å; E560-K563 PolarHBondContact O-N 3.25Å; K563-Q566 PolarHBondContact O-N 3.28Å; K563-Q567 WeakPolarHBondContact O-CG 3.47Å; K563-Q567 PolarHBondContact O-N 2.92Å
564L88.2Confident88.9Confident108 Ų108111.3 Ų111.357%0.56555%0.545SS*.Hα-helixtrans-64.7-39.2177-74.1171.5000112.3E560 Q566 Q567 A568E560-L564 WeakPolarHBondContact O-CG 3.47Å; E560-L564 PolarHBondContact O-N 3.41Å; L564-Q566 VanDerWaalsContact C-N 3.32Å; L564-Q566 PolarHBondContact O-N 3.43Å; L564-Q567 PolarHBondContact O-N 3.4Å; L564-A568 WeakPolarHBondContact O-CB 3.39Å; L564-A568 PolarHBondContact O-N 2.85Å
565R89.3Confident89.1Confident173 Ų173109.6 Ų109.665%0.65354%0.541SS*.Hα-helixtrans-61.4-40.2174.1-80.1-179.9176.1174.40.1112.3L561 Q562 A568 L569L561-R565 HydrophobicContact CD2-CG 4.44Å; L561-R565 WeakPolarHBondContact O-CG 3.45Å; L561-R565 PolarHBondContact O-N 3Å; Q562-R565 PolarHBondContact O-N 2.94Å; R565-A568 PolarHBondContact O-N 3.33Å; R565-L569 PolarHBondContact O-N 2.94Å; R565-L569 VanDerWaalsContact O-N 3.09Å
566Q90.4Very high89.2Confident116 Ų116106.6 Ų106.654%0.54253%0.527SS..Hα-helixtrans-67.2-42.9178.1-169.1153.31000111.7Q562 K563 L564 A568 L569 E570Q562-Q566 PolarHBondContact O-N 3.41Å; Q562-Q566 VanDerWaalsContact O-N 3.1Å; K563-Q566 PolarHBondContact O-N 3.28Å; L564-Q566 VanDerWaalsContact C-N 3.32Å; L564-Q566 PolarHBondContact O-N 3.43Å; Q566-A568 VanDerWaalsContact C-N 3.33Å; Q566-A568 PolarHBondContact O-N 2.8Å; Q566-L569 PolarHBondContact O-N 3.08Å; Q566-E570 WeakPolarHBondContact O-CG 3.47Å; Q566-E570 PolarHBondContact O-N 3.41Å
567Q88.6Confident89.4Confident96 Ų96110.1 Ų110.145%0.44954%0.536SS..Hα-helixtrans-60.6-40.3173.5-71.6179.8-21.700112.5K563 L564 L569 E570 T571K563-Q567 WeakPolarHBondContact O-CG 3.47Å; K563-Q567 PolarHBondContact O-N 2.92Å; L564-Q567 PolarHBondContact O-N 3.4Å; Q567-L569 VanDerWaalsContact C-N 3.34Å; Q567-L569 PolarHBondContact O-N 2.98Å; Q567-E570 PolarHBondContact O-N 3.14Å; Q567-T571 WeakPolarHBondContact O-CG2 3.48Å; Q567-T571 PolarHBondContact O-N 2.9Å; Q567-T571 PolarHBondContact O-OG1 3.34Å
568A88Confident89.7Confident56 Ų56109.1 Ų109.146%0.46353%0.528SS..Hα-helixtrans-66-33.9177.100000113.2L564 R565 Q566 T571 K572L564-A568 WeakPolarHBondContact O-CB 3.39Å; L564-A568 PolarHBondContact O-N 2.85Å; R565-A568 PolarHBondContact O-N 3.33Å; Q566-A568 VanDerWaalsContact C-N 3.33Å; Q566-A568 PolarHBondContact O-N 2.8Å; A568-T571 WeakPolarHBondContact CA-OG1 3.47Å; A568-T571 PolarHBondContact O-OG1 2.89Å; A568-K572 WeakPolarHBondContact O-CB 3.48Å; A568-K572 PolarHBondContact O-N 3.18Å; A568-K572 VanDerWaalsContact O-N 3.1Å
569L92Very high89.8Confident107 Ų107107.1 Ų107.156%0.5652%0.521SS*.Hα-helixtrans-70.2-41.3173.8-77167.9000111.8R565 Q566 Q567 K572 H573R565-L569 PolarHBondContact O-N 2.94Å; R565-L569 VanDerWaalsContact O-N 3.09Å; Q566-L569 PolarHBondContact O-N 3.08Å; Q567-L569 VanDerWaalsContact C-N 3.34Å; Q567-L569 PolarHBondContact O-N 2.98Å; L569-K572 PolarHBondContact O-N 3.35Å; L569-H573 PolarHBondContact O-N 3.38Å
570E90.8Very high90Very high120 Ų120108.1 Ų108.156%0.56152%0.52SS*.Hα-helixtrans-63.3-42.9176.5-72.5171.1-172.700112Q566 Q567 H573 F574Q566-E570 WeakPolarHBondContact O-CG 3.47Å; Q566-E570 PolarHBondContact O-N 3.41Å; Q567-E570 PolarHBondContact O-N 3.14Å; E570-H573 PolarHBondContact O-N 3.23Å; E570-F574 PolarHBondContact O-N 2.93Å
571T87.6Confident90.2Very high82 Ų82106.3 Ų106.350%0.50351%0.512SS..Hα-helixtrans-66.7-39.1175.952.10000112.1Q567 A568 F574 I575Q567-T571 WeakPolarHBondContact O-CG2 3.48Å; Q567-T571 PolarHBondContact O-N 2.9Å; Q567-T571 PolarHBondContact O-OG1 3.34Å; A568-T571 WeakPolarHBondContact CA-OG1 3.47Å; A568-T571 PolarHBondContact O-OG1 2.89Å; T571-F574 WeakPolarHBondContact O-CB 3.47Å; T571-F574 PolarHBondContact O-N 3.47Å; T571-I575 WeakPolarHBondContact O-CG1 3.43Å; T571-I575 PolarHBondContact O-N 3.44Å
572K91.8Very high90.3Very high121 Ų121107.5 Ų107.553%0.52652%0.515SS..Hα-helixtrans-60-47.3174.2-173.4-178.6175.7-173.70111.8A568 L569 F574 I575 E576A568-K572 WeakPolarHBondContact O-CB 3.48Å; A568-K572 PolarHBondContact O-N 3.18Å; A568-K572 VanDerWaalsContact O-N 3.1Å; L569-K572 PolarHBondContact O-N 3.35Å; K572-F574 VanDerWaalsContact C-N 3.28Å; K572-F574 PolarHBondContact O-N 2.93Å; K572-I575 PolarHBondContact O-N 3.23Å; K572-E576 VanDerWaalsContact CE-OE1 3.32Å; K572-E576 WeakPolarHBondContact CE-OE1 3.25Å; K572-E576 WeakPolarHBondContact O-CG 3.44Å; K572-E576 PolarHBondContact O-N 2.92Å
573H91.7Very high90.4Very high114 Ų114108.5 Ų108.553%0.52851%0.513SS..Hα-helixtrans-64.6-31.2176-81.2-40.7000113.4L569 E570 E576 K577L569-H573 PolarHBondContact O-N 3.38Å; E570-H573 PolarHBondContact O-N 3.23Å; H573-E576 IonicContact CE1-OE2 3.07Å; H573-E576 IonicContact ND1-OE2 3.45Å; H573-E576 PolarHBondContact ND1-OE2 3.5Å; H573-K577 WeakPolarHBondContact O-CG 3.36Å; H573-K577 PolarHBondContact O-N 3.02Å
574F90.8Very high90.5Very high107 Ų107107 Ų10747%0.46951%0.506SS..Hα-helixtrans-67.3-43.6172.9-177.9-98.2000111.8E570 T571 K572 K577 Q578E570-F574 PolarHBondContact O-N 2.93Å; T571-F574 WeakPolarHBondContact O-CB 3.47Å; T571-F574 PolarHBondContact O-N 3.47Å; K572-F574 VanDerWaalsContact C-N 3.28Å; K572-F574 PolarHBondContact O-N 2.93Å; F574-K577 PolarHBondContact O-N 3.39Å; F574-Q578 HydrophobicContact CD1-CG 4.2Å; F574-Q578 HydrophobicContact CE1-CG 3.82Å; F574-Q578 HydrophobicContact CZ-CG 4.07Å; F574-Q578 WeakPolarHBondContact O-CG 3.48Å; F574-Q578 PolarHBondContact O-N 3.06Å
575I90.8Very high90.7Very high91 Ų91106.3 Ų106.347%0.46750%0.503SS..Hα-helixtrans-60.6-47.8175.9-67.4165.9000110.5T571 K572 K577 Q578 E579T571-I575 WeakPolarHBondContact O-CG1 3.43Å; T571-I575 PolarHBondContact O-N 3.44Å; K572-I575 PolarHBondContact O-N 3.23Å; I575-K577 VanDerWaalsContact C-N 3.25Å; I575-K577 PolarHBondContact O-N 3.2Å; I575-Q578 PolarHBondContact O-N 3.27Å; I575-E579 HydrophobicContact CG2-CG 4.36Å; I575-E579 WeakPolarHBondContact O-CG 3.48Å; I575-E579 PolarHBondContact O-N 3.31Å
576E92.4Very high90.6Very high76 Ų76102.7 Ų102.736%0.35550%0.496SS..Hα-helixtrans-56.9-38.3177.2-72.6168.9177.400112.1K572 H573 V580K572-E576 VanDerWaalsContact CE-OE1 3.32Å; K572-E576 WeakPolarHBondContact CE-OE1 3.25Å; K572-E576 WeakPolarHBondContact O-CG 3.44Å; K572-E576 PolarHBondContact O-N 2.92Å; H573-E576 IonicContact CE1-OE2 3.07Å; H573-E576 IonicContact ND1-OE2 3.45Å; H573-E576 PolarHBondContact ND1-OE2 3.5Å; E576-V580 WeakPolarHBondContact O-CG2 3.32Å; E576-V580 PolarHBondContact O-N 3.2Å
577K91.6Very high90.7Very high155 Ų155105.4 Ų105.467%0.67450%0.501SS*.Hα-helixtrans-66.8-41.3174.2-77.2179.2179.9179.60112.6H573 F574 I575 V580 E581H573-K577 WeakPolarHBondContact O-CG 3.36Å; H573-K577 PolarHBondContact O-N 3.02Å; F574-K577 PolarHBondContact O-N 3.39Å; I575-K577 VanDerWaalsContact C-N 3.25Å; I575-K577 PolarHBondContact O-N 3.2Å; K577-V580 PolarHBondContact O-N 3.45Å; K577-E581 PolarHBondContact O-N 2.68Å; K577-E581 VanDerWaalsContact O-N 3.15Å
578Q91.2Very high90.9Very high84 Ų84105.1 Ų105.139%0.39350%0.502SS..Hα-helixtrans-65.6-39.7177.5-67.5-65.8-15.600111.6F574 I575 V580 E581 E582F574-Q578 HydrophobicContact CD1-CG 4.2Å; F574-Q578 HydrophobicContact CE1-CG 3.82Å; F574-Q578 HydrophobicContact CZ-CG 4.07Å; F574-Q578 WeakPolarHBondContact O-CG 3.48Å; F574-Q578 PolarHBondContact O-N 3.06Å; I575-Q578 PolarHBondContact O-N 3.27Å; Q578-V580 VanDerWaalsContact C-N 3.27Å; Q578-V580 PolarHBondContact O-N 2.99Å; Q578-E581 PolarHBondContact O-N 3.07Å; Q578-E581 VanDerWaalsContact O-N 3.16Å; Q578-E582 WeakPolarHBondContact O-CB 3.32Å; Q578-E582 PolarHBondContact O-N 3.1Å
579E90.8Very high90.9Very high96 Ų96107.1 Ų107.145%0.44950%0.504SS..Hα-helixtrans-63.9-29.8175.4-71177.817300113.2I575 R583I575-E579 HydrophobicContact CG2-CG 4.36Å; I575-E579 WeakPolarHBondContact O-CG 3.48Å; I575-E579 PolarHBondContact O-N 3.31Å; E579-R583 WeakPolarHBondContact O-CG 3.49Å; E579-R583 PolarHBondContact O-N 3.23Å; E579-R583 PolarHBondContact O-NE 2.91Å; E579-R583 VanDerWaalsContact O-NE 3.15Å
580V92.2Very high90.9Very high81 Ų81105 Ų10549%0.49150%0.502SS..Hα-helixtrans-71.7-42.8172.6172.50000110.9E576 K577 Q578 R583 K584E576-V580 WeakPolarHBondContact O-CG2 3.32Å; E576-V580 PolarHBondContact O-N 3.2Å; K577-V580 PolarHBondContact O-N 3.45Å; Q578-V580 VanDerWaalsContact C-N 3.27Å; Q578-V580 PolarHBondContact O-N 2.99Å; V580-R583 PolarHBondContact O-N 3.32Å; V580-K584 PolarHBondContact O-N 2.92Å; V580-K584 VanDerWaalsContact O-N 3.13Å
581E90.4Very high91Very high77 Ų77104.4 Ų104.436%0.3650%0.499SS..Hα-helixtrans-69.1-37178.4-159.464.8-161.900111.6K577 Q578 R583 K584 L585K577-E581 PolarHBondContact O-N 2.68Å; K577-E581 VanDerWaalsContact O-N 3.15Å; Q578-E581 PolarHBondContact O-N 3.07Å; Q578-E581 VanDerWaalsContact O-N 3.16Å; E581-R583 PolarHBondContact O-N 2.99Å; E581-K584 WeakPolarHBondContact O-CB 3.47Å; E581-K584 PolarHBondContact O-N 2.92Å; E581-K584 VanDerWaalsContact O-N 3.17Å; E581-K584 IonicContact OE1-NZ 2.71Å; E581-K584 PolarHBondContact OE1-NZ 3.43Å; E581-K584 IonicContact OE2-NZ 2.7Å; E581-L585 WeakPolarHBondContact O-CG 3.21Å; E581-L585 PolarHBondContact O-N 3.02Å
582E89.1Confident91.1Very high118 Ų118103 Ų10355%0.55150%0.496SS*.Hα-helixtrans-57.8-48.3172.9-173.7-176.1166.300111.3Q578 K584 L585 L586Q578-E582 WeakPolarHBondContact O-CB 3.32Å; Q578-E582 PolarHBondContact O-N 3.1Å; E582-K584 VanDerWaalsContact C-N 3.27Å; E582-K584 PolarHBondContact O-N 2.82Å; E582-L585 PolarHBondContact O-N 3.34Å; E582-L586 HydrophobicContact CG-CD1 4.2Å; E582-L586 WeakPolarHBondContact O-CB 3.33Å; E582-L586 WeakPolarHBondContact O-CG 3.5Å; E582-L586 PolarHBondContact O-N 3.46Å
583R92Very high91.1Very high159 Ų159100.9 Ų100.960%0.649%0.491SS*.Hα-helixtrans-59.8-37.4176.2-78.9-177.1-78.1-173.2-6.4112.6E579 V580 E581 R587E579-R583 WeakPolarHBondContact O-CG 3.49Å; E579-R583 PolarHBondContact O-N 3.23Å; E579-R583 PolarHBondContact O-NE 2.91Å; E579-R583 VanDerWaalsContact O-NE 3.15Å; V580-R583 PolarHBondContact O-N 3.32Å; E581-R583 PolarHBondContact O-N 2.99Å; R583-R587 PolarHBondContact O-N 3.46Å; R583-R587 VanDerWaalsContact O-N 3.13Å
584K91.4Very high91.2Very high110 Ų11097 Ų9748%0.47848%0.481SS..Hα-helixtrans-68.5-43.3177-176.6-176.6162.1-150.80111.7V580 E581 E582 R587 I588V580-K584 PolarHBondContact O-N 2.92Å; V580-K584 VanDerWaalsContact O-N 3.13Å; E581-K584 WeakPolarHBondContact O-CB 3.47Å; E581-K584 PolarHBondContact O-N 2.92Å; E581-K584 VanDerWaalsContact O-N 3.17Å; E581-K584 IonicContact OE1-NZ 2.71Å; E581-K584 PolarHBondContact OE1-NZ 3.43Å; E581-K584 IonicContact OE2-NZ 2.7Å; E582-K584 VanDerWaalsContact C-N 3.27Å; E582-K584 PolarHBondContact O-N 2.82Å; K584-R587 WeakPolarHBondContact O-CB 3.48Å; K584-R587 PolarHBondContact O-N 3.36Å; K584-I588 WeakPolarHBondContact O-CG1 3.44Å; K584-I588 PolarHBondContact O-N 3.47Å; K584-I588 VanDerWaalsContact O-N 3.1Å
585L91.3Very high91.2Very high93 Ų9396.9 Ų96.949%0.48748%0.482SS..Hα-helixtrans-64.7-42.5176.1-70.4172.1000111.9E581 E582 R587 I588 I589E581-L585 WeakPolarHBondContact O-CG 3.21Å; E581-L585 PolarHBondContact O-N 3.02Å; E582-L585 PolarHBondContact O-N 3.34Å; L585-R587 VanDerWaalsContact C-N 3.26Å; L585-R587 PolarHBondContact O-N 3.48Å; L585-I588 PolarHBondContact O-N 3.49Å; L585-I588 VanDerWaalsContact O-N 3.17Å; L585-I589 WeakPolarHBondContact O-CG1 3.44Å; L585-I589 PolarHBondContact O-N 2.92Å
586L88.7Confident91.3Very high97 Ų97100.5 Ų100.551%0.50849%0.49SS..Hα-helixtrans-59.3-38.1174.7-74.4171.5000112.1E582 I589 A590E582-L586 HydrophobicContact CG-CD1 4.2Å; E582-L586 WeakPolarHBondContact O-CB 3.33Å; E582-L586 WeakPolarHBondContact O-CG 3.5Å; E582-L586 PolarHBondContact O-N 3.46Å; L586-I589 PolarHBondContact O-N 2.94Å; L586-A590 PolarHBondContact O-N 3.13Å
587R91.7Very high91.4Very high174 Ų174101.6 Ų101.666%0.65750%0.497SS*.Hα-helixtrans-65.2-43.5174.9-170.8180178.3166.17.7112.2R583 K584 L585 I589 A590 E591R583-R587 PolarHBondContact O-N 3.46Å; R583-R587 VanDerWaalsContact O-N 3.13Å; K584-R587 WeakPolarHBondContact O-CB 3.48Å; K584-R587 PolarHBondContact O-N 3.36Å; L585-R587 VanDerWaalsContact C-N 3.26Å; L585-R587 PolarHBondContact O-N 3.48Å; R587-I589 VanDerWaalsContact C-N 3.33Å; R587-I589 PolarHBondContact O-N 3.02Å; R587-A590 PolarHBondContact O-N 3.31Å; R587-E591 IonicContact CZ-OE1 3.55Å; R587-E591 IonicContact NE-OE1 3.06Å; R587-E591 PolarHBondContact NE-OE1 2.86Å; R587-E591 VanDerWaalsContact NE-OE1 3.11Å; R587-E591 WeakPolarHBondContact O-CG 3.33Å; R587-E591 PolarHBondContact O-N 3.25Å
588I92.3Very high91.4Very high90 Ų90101.8 Ų101.846%0.46249%0.494SS..Hα-helixtrans-61.5-42.6176.4-67.1166.9000110.7K584 L585 E591 A592K584-I588 WeakPolarHBondContact O-CG1 3.44Å; K584-I588 PolarHBondContact O-N 3.47Å; K584-I588 VanDerWaalsContact O-N 3.1Å; L585-I588 PolarHBondContact O-N 3.49Å; L585-I588 VanDerWaalsContact O-N 3.17Å; I588-E591 PolarHBondContact O-N 3.29Å; I588-A592 WeakPolarHBondContact O-CB 3.3Å; I588-A592 PolarHBondContact O-N 3.44Å
589I89.1Confident91.5Very high97 Ų97103 Ų10350%0.49750%0.499SS..Hα-helixtrans-61.9-45.9177.1-67.5167.6000110.5L585 L586 R587 E591 A592 D593L585-I589 WeakPolarHBondContact O-CG1 3.44Å; L585-I589 PolarHBondContact O-N 2.92Å; L586-I589 PolarHBondContact O-N 2.94Å; R587-I589 VanDerWaalsContact C-N 3.33Å; R587-I589 PolarHBondContact O-N 3.02Å; I589-E591 PolarHBondContact O-N 3.46Å; I589-A592 PolarHBondContact O-N 3.39Å; I589-D593 WeakPolarHBondContact O-CB 3.42Å; I589-D593 PolarHBondContact O-N 3.4Å
590A92.5Very high91.7Very high64 Ų64104.7 Ų104.753%0.52951%0.505SS..Hα-helixtrans-62.9-39.9178.200000112.8L586 R587 G594L586-A590 PolarHBondContact O-N 3.13Å; R587-A590 PolarHBondContact O-N 3.31Å; A590-G594 PolarHBondContact O-N 2.98Å
591E91.3Very high91.8Very high106 Ų106106.9 Ų106.950%0.49551%0.508SS..Hα-helixtrans-65.2-43.7175.4-73.2171.8-170.400111.3R587 I588 I589 G594 E595R587-E591 IonicContact CZ-OE1 3.55Å; R587-E591 IonicContact NE-OE1 3.06Å; R587-E591 PolarHBondContact NE-OE1 2.86Å; R587-E591 VanDerWaalsContact NE-OE1 3.11Å; R587-E591 WeakPolarHBondContact O-CG 3.33Å; R587-E591 PolarHBondContact O-N 3.25Å; I588-E591 PolarHBondContact O-N 3.29Å; I589-E591 PolarHBondContact O-N 3.46Å; E591-G594 PolarHBondContact O-N 3.27Å; E591-E595 PolarHBondContact O-N 3.07Å
592A89.9Confident91.9Very high54 Ų54108.7 Ų108.745%0.44652%0.517SS..Hα-helixtrans-65.6-40.9176.900000112.9I588 I589 G594 E595 R596I588-A592 WeakPolarHBondContact O-CB 3.3Å; I588-A592 PolarHBondContact O-N 3.44Å; I589-A592 PolarHBondContact O-N 3.39Å; A592-G594 VanDerWaalsContact C-N 3.34Å; A592-E595 PolarHBondContact O-N 3.15Å; A592-R596 WeakPolarHBondContact O-CB 3.48Å; A592-R596 PolarHBondContact O-N 3.31Å
593D91.8Very high92.1Very high76 Ų76107.9 Ų107.941%0.40652%0.515SS..Hα-helixtrans-64.8-38.6174-94-40.8000111.8I589 R596 L597I589-D593 WeakPolarHBondContact O-CB 3.42Å; I589-D593 PolarHBondContact O-N 3.4Å; D593-R596 PolarHBondContact O-N 3.17Å; D593-R596 IonicContact OD1-CZ 3.3Å; D593-R596 IonicContact OD1-NE 2.94Å; D593-R596 PolarHBondContact OD1-NE 3.23Å; D593-R596 IonicContact OD1-NH2 3.83Å; D593-R596 PolarHBondContact OD1-NH2 3.18Å; D593-L597 WeakPolarHBondContact O-CB 3.39Å; D593-L597 PolarHBondContact O-N 3.36Å
594G93.4Very high92.3Very high31 Ų31104.2 Ų104.232%0.3251%0.508SS..Hα-helixtrans-64.9-38173.700000113.3A590 E591 A592 R598A590-G594 PolarHBondContact O-N 2.98Å; E591-G594 PolarHBondContact O-N 3.27Å; A592-G594 VanDerWaalsContact C-N 3.34Å; G594-R598 PolarHBondContact O-N 2.97Å; G594-R598 PolarHBondContact O-NE 3.45Å
595E91.6Very high92.3Very high105 Ų105104.5 Ų104.549%0.49151%0.511SS..Hα-helixtrans-68.5-45.3173.5-169.5172.9-178.200112E591 A592 L597 R598 Q599E591-E595 PolarHBondContact O-N 3.07Å; A592-E595 PolarHBondContact O-N 3.15Å; E595-L597 VanDerWaalsContact C-N 3.28Å; E595-L597 PolarHBondContact O-N 3.46Å; E595-R598 WeakPolarHBondContact O-CB 3.48Å; E595-R598 PolarHBondContact O-N 3.46Å; E595-R598 VanDerWaalsContact O-N 3.08Å; E595-Q599 PolarHBondContact O-N 3Å
596R93.1Very high92.4Very high168 Ų168104.5 Ų104.563%0.63452%0.515SS*.Hα-helixtrans-56.6-41.8174.9-174.4-178.665139.3-6.9112A592 D593 K600A592-R596 WeakPolarHBondContact O-CB 3.48Å; A592-R596 PolarHBondContact O-N 3.31Å; D593-R596 PolarHBondContact O-N 3.17Å; D593-R596 IonicContact OD1-CZ 3.3Å; D593-R596 IonicContact OD1-NE 2.94Å; D593-R596 PolarHBondContact OD1-NE 3.23Å; D593-R596 IonicContact OD1-NH2 3.83Å; D593-R596 PolarHBondContact OD1-NH2 3.18Å; R596-K600 WeakPolarHBondContact O-CB 3.43Å; R596-K600 PolarHBondContact O-N 3.31Å
597L93.3Very high92.6Very high99 Ų99102.9 Ų102.952%0.51851%0.506SS..Hα-helixtrans-67.3-36.7177.6-172.565.7000112.3D593 E595 K601D593-L597 WeakPolarHBondContact O-CB 3.39Å; D593-L597 PolarHBondContact O-N 3.36Å; E595-L597 VanDerWaalsContact C-N 3.28Å; E595-L597 PolarHBondContact O-N 3.46Å; L597-K601 WeakPolarHBondContact O-CG 3.5Å; L597-K601 PolarHBondContact O-N 3.29Å
598R93Very high92.6Very high159 Ų15997.3 Ų97.360%0.649%0.493SS*.Hα-helixtrans-64.9-50.1174.4-80.8-177.1-79.2-1750.2111.6G594 E595 K600 K601 E602G594-R598 PolarHBondContact O-N 2.97Å; G594-R598 PolarHBondContact O-NE 3.45Å; E595-R598 WeakPolarHBondContact O-CB 3.48Å; E595-R598 PolarHBondContact O-N 3.46Å; E595-R598 VanDerWaalsContact O-N 3.08Å; R598-K600 VanDerWaalsContact C-N 3.26Å; R598-K600 PolarHBondContact O-N 3.35Å; R598-K601 WeakPolarHBondContact O-CB 3.44Å; R598-K601 PolarHBondContact O-N 2.93Å; R598-E602 PolarHBondContact O-N 2.78Å
599Q93.8Very high92.7Very high109 Ų10998.7 Ų98.751%0.50950%0.498SS..Hα-helixtrans-59.4-37.4177.4-70.4177.9-4.400112.2E595 E602 L603E595-Q599 PolarHBondContact O-N 3Å; Q599-E602 PolarHBondContact O-N 3.3Å; Q599-L603 WeakPolarHBondContact O-CB 3.45Å; Q599-L603 PolarHBondContact O-N 3.28Å
600K94.6Very high93Very high131 Ų131101.1 Ų101.157%0.5750%0.501SS*.Hα-helixtrans-62.5-43.9174.4-172.5178.1178-177.60112.2R596 R598 L603 D604R596-K600 WeakPolarHBondContact O-CB 3.43Å; R596-K600 PolarHBondContact O-N 3.31Å; R598-K600 VanDerWaalsContact C-N 3.26Å; R598-K600 PolarHBondContact O-N 3.35Å; K600-L603 PolarHBondContact O-N 3.47Å; K600-D604 VanDerWaalsContact O-CG 3.32Å; K600-D604 PolarHBondContact O-N 3.43Å
601K94.2Very high93.1Very high128 Ų128101.5 Ų101.556%0.55749%0.494SS*.Hα-helixtrans-63.9-40.6176.7-72.7-180179.7-176.60112.2L597 R598 D604 Q605L597-K601 WeakPolarHBondContact O-CG 3.5Å; L597-K601 PolarHBondContact O-N 3.29Å; R598-K601 WeakPolarHBondContact O-CB 3.44Å; R598-K601 PolarHBondContact O-N 2.93Å; K601-D604 PolarHBondContact O-N 2.87Å; K601-Q605 WeakPolarHBondContact O-CG 3.36Å; K601-Q605 PolarHBondContact O-N 2.88Å
602E93.1Very high93.1Very high114 Ų114101 Ų10153%0.53349%0.494SS..Hα-helixtrans-63.9-42.3175.3-71173-173.800111.4R598 Q599 Q605 V606R598-E602 PolarHBondContact O-N 2.78Å; Q599-E602 PolarHBondContact O-N 3.3Å; E602-Q605 WeakPolarHBondContact O-CB 3.31Å; E602-Q605 PolarHBondContact O-N 3.26Å; E602-V606 WeakPolarHBondContact O-CG2 3.36Å; E602-V606 PolarHBondContact O-N 3.04Å
603L92.8Very high93.2Very high101 Ų101103.6 Ų103.653%0.52950%0.5SS..Hα-helixtrans-62.2-43.1175.3-178.6140.8000112Q599 K600 Q605 V606 I607Q599-L603 WeakPolarHBondContact O-CB 3.45Å; Q599-L603 PolarHBondContact O-N 3.28Å; K600-L603 PolarHBondContact O-N 3.47Å; L603-Q605 VanDerWaalsContact C-N 3.32Å; L603-Q605 PolarHBondContact O-N 3Å; L603-V606 PolarHBondContact O-N 3.17Å; L603-I607 HydrophobicContact CD2-CD1 3.5Å; L603-I607 VanDerWaalsContact CD2-CD1 3.5Å; L603-I607 HydrophobicContact CD2-CG1 4.43Å; L603-I607 HydrophobicContact CG-CD1 4.23Å; L603-I607 VanDerWaalsContact O-CG1 3.29Å; L603-I607 WeakPolarHBondContact O-CG1 3.32Å; L603-I607 PolarHBondContact O-N 3.35Å
604D94.8Very high93.3Very high82 Ų82101.7 Ų101.744%0.43950%0.498SS..Hα-helixtrans-63.1-38.1175.7-69.7-26.1000111.6K600 K601 I607 S608K600-D604 VanDerWaalsContact O-CG 3.32Å; K600-D604 PolarHBondContact O-N 3.43Å; K601-D604 PolarHBondContact O-N 2.87Å; D604-I607 PolarHBondContact O-N 3.44Å; D604-S608 PolarHBondContact O-N 3.37Å
605Q92.4Very high93.3Very high116 Ų116103.3 Ų103.354%0.54250%0.504SS..Hα-helixtrans-62.9-49.4173.3-75.3174.8-2.300111.5K601 E602 L603 I607 S608 E609K601-Q605 WeakPolarHBondContact O-CG 3.36Å; K601-Q605 PolarHBondContact O-N 2.88Å; E602-Q605 WeakPolarHBondContact O-CB 3.31Å; E602-Q605 PolarHBondContact O-N 3.26Å; L603-Q605 VanDerWaalsContact C-N 3.32Å; L603-Q605 PolarHBondContact O-N 3Å; Q605-I607 VanDerWaalsContact C-N 3.29Å; Q605-I607 PolarHBondContact O-N 3.48Å; Q605-S608 PolarHBondContact O-N 3.41Å; Q605-S608 PolarHBondContact O-OG 3.38Å; Q605-E609 WeakPolarHBondContact O-CG 3.46Å; Q605-E609 PolarHBondContact O-N 3.12Å
606V93.3Very high93.4Very high94 Ų94103.2 Ų103.257%0.5750%0.504SS*.Hα-helixtrans-60.5-38.3177.9172.10000111.6E602 L603 E609 R610E602-V606 WeakPolarHBondContact O-CG2 3.36Å; E602-V606 PolarHBondContact O-N 3.04Å; L603-V606 PolarHBondContact O-N 3.17Å; V606-E609 PolarHBondContact O-N 3.17Å; V606-R610 WeakPolarHBondContact O-CB 3.45Å; V606-R610 PolarHBondContact O-N 3.3Å
607I92.7Very high93.3Very high62 Ų62101.4 Ų101.432%0.31851%0.506SS..Hα-helixtrans-63-45.2174-71.2171.5000110.6L603 D604 Q605 E609 R610 D611L603-I607 HydrophobicContact CD2-CD1 3.5Å; L603-I607 VanDerWaalsContact CD2-CD1 3.5Å; L603-I607 HydrophobicContact CD2-CG1 4.43Å; L603-I607 HydrophobicContact CG-CD1 4.23Å; L603-I607 VanDerWaalsContact O-CG1 3.29Å; L603-I607 WeakPolarHBondContact O-CG1 3.32Å; L603-I607 PolarHBondContact O-N 3.35Å; D604-I607 PolarHBondContact O-N 3.44Å; Q605-I607 VanDerWaalsContact C-N 3.29Å; Q605-I607 PolarHBondContact O-N 3.48Å; I607-E609 VanDerWaalsContact C-N 3.35Å; I607-E609 PolarHBondContact O-N 3.19Å; I607-R610 WeakPolarHBondContact O-CB 3.47Å; I607-R610 PolarHBondContact O-N 3.24Å; I607-D611 VanDerWaalsContact O-CG 3.24Å; I607-D611 PolarHBondContact O-N 2.95Å
608S92.7Very high93.3Very high57 Ų57100.9 Ų100.940%0.39951%0.507SS..Hα-helixtrans-63.1-40.2178.677.20000112.4D604 Q605 D611 I612D604-S608 PolarHBondContact O-N 3.37Å; Q605-S608 PolarHBondContact O-N 3.41Å; Q605-S608 PolarHBondContact O-OG 3.38Å; S608-D611 PolarHBondContact O-N 3.32Å; S608-I612 VanDerWaalsContact O-CG1 3.28Å; S608-I612 WeakPolarHBondContact O-CG1 3.06Å; S608-I612 PolarHBondContact O-N 3.37Å
609E93.6Very high93.4Very high119 Ų119101.4 Ų101.456%0.55651%0.508SS*.Hα-helixtrans-65.4-44.8175.3-71.9-179.9-176.900111.4Q605 V606 I607 D611 I612 L613Q605-E609 WeakPolarHBondContact O-CG 3.46Å; Q605-E609 PolarHBondContact O-N 3.12Å; V606-E609 PolarHBondContact O-N 3.17Å; I607-E609 VanDerWaalsContact C-N 3.35Å; I607-E609 PolarHBondContact O-N 3.19Å; E609-D611 VanDerWaalsContact C-N 3.26Å; E609-D611 PolarHBondContact O-N 2.9Å; E609-I612 PolarHBondContact O-N 3.45Å; E609-L613 WeakPolarHBondContact O-CB 3.43Å; E609-L613 WeakPolarHBondContact O-CG 3.46Å; E609-L613 PolarHBondContact O-N 2.84Å
610R94.6Very high93.3Very high148 Ų148103.8 Ų103.856%0.55851%0.513SS*.Hα-helixtrans-56-42.6173.3-179.5-14967.5-172.8-3.4111.1V606 I607 L613 G614V606-R610 WeakPolarHBondContact O-CB 3.45Å; V606-R610 PolarHBondContact O-N 3.3Å; I607-R610 WeakPolarHBondContact O-CB 3.47Å; I607-R610 PolarHBondContact O-N 3.24Å; R610-L613 PolarHBondContact O-N 3.47Å; R610-G614 PolarHBondContact O-N 3.27Å
611D94.5Very high93.2Very high72 Ų72102.8 Ų102.839%0.38551%0.514SS..Hα-helixtrans-70.2-38.2-178.3-70.6-13.4000112.6I607 S608 E609 S615I607-D611 VanDerWaalsContact O-CG 3.24Å; I607-D611 PolarHBondContact O-N 2.95Å; S608-D611 PolarHBondContact O-N 3.32Å; E609-D611 VanDerWaalsContact C-N 3.26Å; E609-D611 PolarHBondContact O-N 2.9Å; D611-S615 WeakPolarHBondContact O-CB 3.46Å; D611-S615 PolarHBondContact O-N 3.22Å; D611-S615 PolarHBondContact O-OG 2.87Å
612I92.5Very high93.2Very high97 Ų97101.1 Ų101.150%0.49751%0.511SS..Hα-helixtrans-63.6-49172.7-67.6164.3000110S608 E609 S615 Q616S608-I612 VanDerWaalsContact O-CG1 3.28Å; S608-I612 WeakPolarHBondContact O-CG1 3.06Å; S608-I612 PolarHBondContact O-N 3.37Å; E609-I612 PolarHBondContact O-N 3.45Å; I612-S615 PolarHBondContact O-N 3.05Å; I612-Q616 WeakPolarHBondContact O-CG 3.37Å; I612-Q616 PolarHBondContact O-N 3.06Å
613L92.2Very high93.2Very high108 Ų10899.7 Ų99.757%0.56550%0.504SS*.Hα-helixtrans-63.5-41.4178.5-72.2173.4000111.7E609 R610 S615 Q616 L617E609-L613 WeakPolarHBondContact O-CB 3.43Å; E609-L613 WeakPolarHBondContact O-CG 3.46Å; E609-L613 PolarHBondContact O-N 2.84Å; R610-L613 PolarHBondContact O-N 3.47Å; L613-S615 VanDerWaalsContact C-N 3.34Å; L613-S615 PolarHBondContact O-N 3.28Å; L613-Q616 PolarHBondContact O-N 3.17Å; L613-L617 WeakPolarHBondContact O-CB 3.35Å; L613-L617 PolarHBondContact O-N 3.13Å
614G92.4Very high93.1Very high35 Ų3598.9 Ų98.936%0.36150%0.5SS..Hα-helixtrans-59.1-45.4174.300000111.7R610 Q616 L617 V618R610-G614 PolarHBondContact O-N 3.27Å; G614-Q616 PolarHBondContact O-N 3.22Å; G614-L617 WeakPolarHBondContact O-CB 3.37Å; G614-L617 PolarHBondContact O-N 3.28Å; G614-V618 WeakPolarHBondContact O-CG2 3.04Å; G614-V618 PolarHBondContact O-N 3.13Å
615S93.4Very high92.9Very high65 Ų6597.4 Ų97.446%0.45550%0.5SS..Hα-helixtrans-64-39.8175.7-61.20000112.6D611 I612 L613 R619D611-S615 WeakPolarHBondContact O-CB 3.46Å; D611-S615 PolarHBondContact O-N 3.22Å; D611-S615 PolarHBondContact O-OG 2.87Å; I612-S615 PolarHBondContact O-N 3.05Å; L613-S615 VanDerWaalsContact C-N 3.34Å; L613-S615 PolarHBondContact O-N 3.28Å; S615-R619 WeakPolarHBondContact O-CG 3.49Å; S615-R619 PolarHBondContact O-N 3.38Å; S615-R619 VanDerWaalsContact O-N 3.14Å
616Q93.7Very high93Very high103 Ų10398 Ų9848%0.48151%0.505SS..Hα-helixtrans-65.2-40.8174.9-72.51799.100111.7I612 L613 G614 V618 R619 R620I612-Q616 WeakPolarHBondContact O-CG 3.37Å; I612-Q616 PolarHBondContact O-N 3.06Å; L613-Q616 PolarHBondContact O-N 3.17Å; G614-Q616 PolarHBondContact O-N 3.22Å; Q616-V618 VanDerWaalsContact C-N 3.35Å; Q616-V618 PolarHBondContact O-N 2.85Å; Q616-R619 PolarHBondContact O-N 3.37Å; Q616-R620 WeakPolarHBondContact O-CB 3.22Å; Q616-R620 VanDerWaalsContact O-CG 3.26Å; Q616-R620 WeakPolarHBondContact O-CG 3.44Å; Q616-R620 PolarHBondContact O-N 2.99Å
617L92Very high92.9Very high130 Ų13098.2 Ų98.268%0.68150%0.503SS*.Hα-helixtrans-61.3-44178-160.389.5000111.2L613 G614 R620 N621L613-L617 WeakPolarHBondContact O-CB 3.35Å; L613-L617 PolarHBondContact O-N 3.13Å; G614-L617 WeakPolarHBondContact O-CB 3.37Å; G614-L617 PolarHBondContact O-N 3.28Å; L617-R620 PolarHBondContact O-N 3.34Å; L617-N621 WeakPolarHBondContact O-CB 3.41Å; L617-N621 PolarHBondContact O-N 3.24Å
618V94.2Very high92.9Very high88 Ų88102.6 Ų102.653%0.53352%0.517SS..Hα-helixtrans-59.8-50.7175.6173.70000110.6G614 Q616 R620 N621 D622G614-V618 WeakPolarHBondContact O-CG2 3.04Å; G614-V618 PolarHBondContact O-N 3.13Å; Q616-V618 VanDerWaalsContact C-N 3.35Å; Q616-V618 PolarHBondContact O-N 2.85Å; V618-R620 VanDerWaalsContact C-N 3.3Å; V618-R620 PolarHBondContact O-N 3.1Å; V618-N621 WeakPolarHBondContact O-CB 3.49Å; V618-N621 PolarHBondContact O-N 2.95Å; V618-N621 VanDerWaalsContact O-N 3.08Å; V618-D622 PolarHBondContact O-N 3.44Å
619R93.1Very high93Very high170 Ų170104.6 Ų104.664%0.64252%0.52SS*.Hα-helixtrans-58.4-40.9177.5-70178.4-171.31734.1112.6S615 Q616 N621 D622 E623S615-R619 WeakPolarHBondContact O-CG 3.49Å; S615-R619 PolarHBondContact O-N 3.38Å; S615-R619 VanDerWaalsContact O-N 3.14Å; Q616-R619 PolarHBondContact O-N 3.37Å; R619-N621 VanDerWaalsContact C-N 3.32Å; R619-D622 PolarHBondContact O-N 2.98Å; R619-E623 WeakPolarHBondContact O-CG 3.35Å; R619-E623 PolarHBondContact O-N 3.44Å
620R91.9Very high93Very high160 Ų160104.8 Ų104.860%0.60452%0.519SS*.Hα-helixtrans-67-34.9177.7-69.7-69.2159.1-173.81.1112.2Q616 L617 V618 E623 L624Q616-R620 WeakPolarHBondContact O-CB 3.22Å; Q616-R620 VanDerWaalsContact O-CG 3.26Å; Q616-R620 WeakPolarHBondContact O-CG 3.44Å; Q616-R620 PolarHBondContact O-N 2.99Å; L617-R620 PolarHBondContact O-N 3.34Å; V618-R620 VanDerWaalsContact C-N 3.3Å; V618-R620 PolarHBondContact O-N 3.1Å; R620-E623 WeakPolarHBondContact CD-OE2 3.29Å; R620-E623 IonicContact CZ-OE1 3Å; R620-E623 IonicContact CZ-OE2 3.78Å; R620-E623 VanDerWaalsContact CZ-OE2 3.31Å; R620-E623 IonicContact NE-OE2 3.93Å; R620-E623 IonicContact NH1-OE1 3.79Å; R620-E623 IonicContact NH1-OE2 3.99Å; R620-E623 PolarHBondContact NH1-OE2 3.21Å; R620-L624 WeakPolarHBondContact O-CB 3.33Å; R620-L624 PolarHBondContact O-N 3.49Å
621N93Very high92.9Very high110 Ų110102.4 Ų102.459%0.58852%0.516SS*.Hα-helixtrans-67.6-41.6175-155.9-2.9000111.2L617 V618 R619 L624 A625L617-N621 WeakPolarHBondContact O-CB 3.41Å; L617-N621 PolarHBondContact O-N 3.24Å; V618-N621 WeakPolarHBondContact O-CB 3.49Å; V618-N621 PolarHBondContact O-N 2.95Å; V618-N621 VanDerWaalsContact O-N 3.08Å; R619-N621 VanDerWaalsContact C-N 3.32Å; N621-L624 WeakPolarHBondContact O-CB 3.35Å; N621-L624 PolarHBondContact O-N 3.14Å; N621-A625 PolarHBondContact O-N 2.91Å
622D94.6Very high92.9Very high93 Ų93105.2 Ų105.250%0.49753%0.525SS..Hα-helixtrans-63-43.3174.2-64.9-24.5000111.9V618 R619 L624 A625 L626V618-D622 PolarHBondContact O-N 3.44Å; R619-D622 PolarHBondContact O-N 2.98Å; D622-L624 VanDerWaalsContact C-N 3.33Å; D622-L624 PolarHBondContact O-N 3.31Å; D622-A625 PolarHBondContact O-N 3.32Å; D622-L626 WeakPolarHBondContact O-CG 3.38Å; D622-L626 PolarHBondContact O-N 3.32Å
623E92.2Very high92.9Very high83 Ų83105.7 Ų105.739%0.38853%0.527SS..Hα-helixtrans-59.7-42.4173.3-75174.3-173.300111.9R619 R620 L626 L627R619-E623 WeakPolarHBondContact O-CG 3.35Å; R619-E623 PolarHBondContact O-N 3.44Å; R620-E623 WeakPolarHBondContact CD-OE2 3.29Å; R620-E623 IonicContact CZ-OE1 3Å; R620-E623 IonicContact CZ-OE2 3.78Å; R620-E623 VanDerWaalsContact CZ-OE2 3.31Å; R620-E623 IonicContact NE-OE2 3.93Å; R620-E623 IonicContact NH1-OE1 3.79Å; R620-E623 IonicContact NH1-OE2 3.99Å; R620-E623 PolarHBondContact NH1-OE2 3.21Å; E623-L626 PolarHBondContact O-N 3.49Å; E623-L627 WeakPolarHBondContact O-CG 3.47Å; E623-L627 PolarHBondContact O-N 3.49Å
624L90.9Very high93Very high84 Ų84105.4 Ų105.444%0.4452%0.523SS..Hα-helixtrans-62.3-44.3176-115.3156.3000111.6R620 N621 D622 L626 L627 Y628R620-L624 WeakPolarHBondContact O-CB 3.33Å; R620-L624 PolarHBondContact O-N 3.49Å; N621-L624 WeakPolarHBondContact O-CB 3.35Å; N621-L624 PolarHBondContact O-N 3.14Å; D622-L624 VanDerWaalsContact C-N 3.33Å; D622-L624 PolarHBondContact O-N 3.31Å; L624-L626 PolarHBondContact O-N 3.44Å; L624-L627 PolarHBondContact O-N 3.49Å; L624-Y628 HydrophobicContact CD2-CD2 4.08Å; L624-Y628 HydrophobicContact CD2-CE2 3.47Å; L624-Y628 VanDerWaalsContact CD2-CE2 3.47Å; L624-Y628 VanDerWaalsContact O-CD2 3.22Å; L624-Y628 WeakPolarHBondContact O-CD2 3.47Å; L624-Y628 PolarHBondContact O-N 2.94Å
625A92.2Very high93.1Very high52 Ų52108.4 Ų108.443%0.4353%0.527SS..Hα-helixtrans-61-43.8175.800000111.7N621 D622 L627 Y628 E629N621-A625 PolarHBondContact O-N 2.91Å; D622-A625 PolarHBondContact O-N 3.32Å; A625-L627 VanDerWaalsContact C-N 3.33Å; A625-L627 PolarHBondContact O-N 3.49Å; A625-Y628 PolarHBondContact O-N 3.31Å; A625-E629 PolarHBondContact O-N 2.96Å
626L92.7Very high93.1Very high127 Ų127109 Ų10967%0.66553%0.532SS*.Hα-helixtrans-62.3-39174.9-72.7172.2000112.4D622 E623 L624 K630D622-L626 WeakPolarHBondContact O-CG 3.38Å; D622-L626 PolarHBondContact O-N 3.32Å; E623-L626 PolarHBondContact O-N 3.49Å; L624-L626 PolarHBondContact O-N 3.44Å; L626-K630 WeakPolarHBondContact O-CB 2.9Å; L626-K630 PolarHBondContact O-N 3.32Å
627L92.8Very high93.2Very high100 Ų100108.7 Ų108.752%0.52454%0.537SS..Hα-helixtrans-65.8-41.6175.4-73.5172.5000111.8E623 L624 A625 K630 I631E623-L627 WeakPolarHBondContact O-CG 3.47Å; E623-L627 PolarHBondContact O-N 3.49Å; L624-L627 PolarHBondContact O-N 3.49Å; A625-L627 VanDerWaalsContact C-N 3.33Å; A625-L627 PolarHBondContact O-N 3.49Å; L627-K630 WeakPolarHBondContact O-CB 3.4Å; L627-K630 PolarHBondContact O-N 3.14Å; L627-I631 VanDerWaalsContact O-CG1 3.31Å; L627-I631 WeakPolarHBondContact O-CG1 3.45Å; L627-I631 PolarHBondContact O-N 3.08Å
628Y92.6Very high93.3Very high154 Ų154107.7 Ų107.760%0.60453%0.531SS*.Hα-helixtrans-61.6-44.8175.1-80.9-58.6000112.3L624 A625 K630 I631 K632L624-Y628 HydrophobicContact CD2-CD2 4.08Å; L624-Y628 HydrophobicContact CD2-CE2 3.47Å; L624-Y628 VanDerWaalsContact CD2-CE2 3.47Å; L624-Y628 VanDerWaalsContact O-CD2 3.22Å; L624-Y628 WeakPolarHBondContact O-CD2 3.47Å; L624-Y628 PolarHBondContact O-N 2.94Å; A625-Y628 PolarHBondContact O-N 3.31Å; Y628-K630 VanDerWaalsContact C-N 3.32Å; Y628-K630 PolarHBondContact O-N 3.49Å; Y628-I631 PolarHBondContact O-N 2.87Å; Y628-K632 WeakPolarHBondContact O-CB 3.49Å; Y628-K632 PolarHBondContact O-N 3.32Å
629E93.6Very high93.3Very high99 Ų99107 Ų10746%0.46353%0.525SS..Hα-helixtrans-63.6-38.9174.8-77.3-59.7145.100111.7A625 K632 I633A625-E629 PolarHBondContact O-N 2.96Å; E629-K632 WeakPolarHBondContact O-CB 3.46Å; E629-K632 PolarHBondContact O-N 2.97Å; E629-K632 IonicContact OE1-NZ 3.22Å; E629-I633 WeakPolarHBondContact O-CG1 3.28Å; E629-I633 PolarHBondContact O-N 3.46Å
630K93.7Very high93.4Very high123 Ų123105.4 Ų105.454%0.53552%0.523SS..Hα-helixtrans-62.5-44.7175.2-169.6176.4-176.3-179.70112.3L626 L627 Y628 K632 I633 Q634L626-K630 WeakPolarHBondContact O-CB 2.9Å; L626-K630 PolarHBondContact O-N 3.32Å; L627-K630 WeakPolarHBondContact O-CB 3.4Å; L627-K630 PolarHBondContact O-N 3.14Å; Y628-K630 VanDerWaalsContact C-N 3.32Å; Y628-K630 PolarHBondContact O-N 3.49Å; K630-K632 VanDerWaalsContact C-N 3.33Å; K630-I633 PolarHBondContact O-N 3Å; K630-Q634 WeakPolarHBondContact O-CB 3.33Å; K630-Q634 WeakPolarHBondContact O-CG 3.41Å; K630-Q634 PolarHBondContact O-N 3.18Å
631I93Very high93.5Very high97 Ų9799.4 Ų99.450%0.49751%0.511SS..Hα-helixtrans-61.2-44.2176-70.7166.1000110.1L627 Y628 I633 Q634 Q635L627-I631 VanDerWaalsContact O-CG1 3.31Å; L627-I631 WeakPolarHBondContact O-CG1 3.45Å; L627-I631 PolarHBondContact O-N 3.08Å; Y628-I631 PolarHBondContact O-N 2.87Å; I631-I633 PolarHBondContact O-N 2.93Å; I631-Q634 PolarHBondContact O-N 3.34Å; I631-Q635 WeakPolarHBondContact O-CB 3.36Å; I631-Q635 PolarHBondContact O-N 3.32Å
632K94.6Very high93.6Very high132 Ų13299.7 Ų99.757%0.57451%0.508SS*.Hα-helixtrans-60.8-43.9178.5-173.3-179.3176.2-1720112.2Y628 E629 K630 S636Y628-K632 WeakPolarHBondContact O-CB 3.49Å; Y628-K632 PolarHBondContact O-N 3.32Å; E629-K632 WeakPolarHBondContact O-CB 3.46Å; E629-K632 PolarHBondContact O-N 2.97Å; E629-K632 IonicContact OE1-NZ 3.22Å; K630-K632 VanDerWaalsContact C-N 3.33Å; K632-S636 WeakPolarHBondContact O-CB 3.42Å; K632-S636 PolarHBondContact O-N 2.92Å
633I93.1Very high93.6Very high106 Ų10699 Ų9954%0.54451%0.507SS..Hα-helixtrans-63.9-46.4174.9-66.8166.6000110.5E629 K630 I631 Q635 S636 V637E629-I633 WeakPolarHBondContact O-CG1 3.28Å; E629-I633 PolarHBondContact O-N 3.46Å; K630-I633 PolarHBondContact O-N 3Å; I631-I633 PolarHBondContact O-N 2.93Å; I633-Q635 PolarHBondContact O-N 2.74Å; I633-S636 WeakPolarHBondContact O-CB 3.35Å; I633-S636 PolarHBondContact O-N 3.34Å; I633-V637 WeakPolarHBondContact O-CG2 3.48Å; I633-V637 PolarHBondContact O-N 3.07Å
634Q94.2Very high93.7Very high103 Ų10399.9 Ų99.948%0.48151%0.511SS..Hα-helixtrans-61.9-41.4178.9-75.1179.3-2100112.3K630 I631 S636 V637 L638K630-Q634 WeakPolarHBondContact O-CB 3.33Å; K630-Q634 WeakPolarHBondContact O-CG 3.41Å; K630-Q634 PolarHBondContact O-N 3.18Å; I631-Q634 PolarHBondContact O-N 3.34Å; Q634-S636 VanDerWaalsContact C-N 3.35Å; Q634-S636 PolarHBondContact O-N 3.35Å; Q634-V637 PolarHBondContact O-N 2.96Å; Q634-L638 WeakPolarHBondContact O-CB 3.39Å; Q634-L638 WeakPolarHBondContact O-CG 3.4Å; Q634-L638 PolarHBondContact O-N 3.01Å
635Q94.2Very high94Very high97 Ų97103.1 Ų103.145%0.45352%0.519SS..Hα-helixtrans-63.3-41.4175.6-168.665.141.500111.6I631 I633 V637 L638 N639I631-Q635 WeakPolarHBondContact O-CB 3.36Å; I631-Q635 PolarHBondContact O-N 3.32Å; I633-Q635 PolarHBondContact O-N 2.74Å; Q635-V637 PolarHBondContact O-N 3.3Å; Q635-L638 PolarHBondContact O-N 3.43Å; Q635-N639 PolarHBondContact NE2-OD1 3.18Å; Q635-N639 WeakPolarHBondContact O-CB 3.49Å; Q635-N639 PolarHBondContact O-N 3.4Å; Q635-N639 PolarHBondContact O-OD1 2.87Å
636S94.1Very high94.2Very high79 Ų79104.7 Ų104.755%0.55252%0.52SS*.Hα-helixtrans-60.7-43.7174.6-179.70000112K632 I633 Q634 K640K632-S636 WeakPolarHBondContact O-CB 3.42Å; K632-S636 PolarHBondContact O-N 2.92Å; I633-S636 WeakPolarHBondContact O-CB 3.35Å; I633-S636 PolarHBondContact O-N 3.34Å; Q634-S636 VanDerWaalsContact C-N 3.35Å; Q634-S636 PolarHBondContact O-N 3.35Å; S636-K640 WeakPolarHBondContact O-CB 3.46Å; S636-K640 PolarHBondContact O-N 3.15Å
637V94.2Very high94.3Very high95 Ų95103.5 Ų103.558%0.57651%0.511SS*.Hα-helixtrans-65.4-42.6176.4173.60000111.6I633 Q634 Q635 K640 G641I633-V637 WeakPolarHBondContact O-CG2 3.48Å; I633-V637 PolarHBondContact O-N 3.07Å; Q634-V637 PolarHBondContact O-N 2.96Å; Q635-V637 PolarHBondContact O-N 3.3Å; V637-K640 PolarHBondContact O-N 3.48Å; V637-G641 PolarHBondContact O-N 3.38Å
638L94.1Very high94.4Very high109 Ų109105.5 Ų105.557%0.57151%0.512SS*.Hα-helixtrans-61.7-49.5176.3-78.4169.7000111.4Q634 Q635 K640 G641 E642Q634-L638 WeakPolarHBondContact O-CB 3.39Å; Q634-L638 WeakPolarHBondContact O-CG 3.4Å; Q634-L638 PolarHBondContact O-N 3.01Å; Q635-L638 PolarHBondContact O-N 3.43Å; L638-K640 VanDerWaalsContact C-N 3.26Å; L638-K640 PolarHBondContact O-N 3.48Å; L638-G641 CarbonylContact O-C 3.43Å; L638-G641 PolarHBondContact O-N 3.43Å; L638-G641 VanDerWaalsContact O-N 3.09Å; L638-E642 WeakPolarHBondContact O-CB 3.48Å; L638-E642 PolarHBondContact O-N 3.25Å
639N95.5Very high94.5Very high73 Ų73100.9 Ų100.939%0.3950%0.5SS..Hα-helixtrans-59.1-39.7177.8-68-1.9000111.4Q635 T643Q635-N639 PolarHBondContact NE2-OD1 3.18Å; Q635-N639 WeakPolarHBondContact O-CB 3.49Å; Q635-N639 PolarHBondContact O-N 3.4Å; Q635-N639 PolarHBondContact O-OD1 2.87Å; N639-T643 WeakPolarHBondContact O-CB 3.3Å; N639-T643 PolarHBondContact O-N 3.15Å; N639-T643 PolarHBondContact O-OG1 3.46Å
640K94.5Very high94.5Very high138 Ų13899.9 Ų99.960%0.650%0.495SS*.Hα-helixtrans-65.3-44.6174.8-171.2178-178.1179.70111.6S636 V637 L638 T643 Q644S636-K640 WeakPolarHBondContact O-CB 3.46Å; S636-K640 PolarHBondContact O-N 3.15Å; V637-K640 PolarHBondContact O-N 3.48Å; L638-K640 VanDerWaalsContact C-N 3.26Å; L638-K640 PolarHBondContact O-N 3.48Å; K640-T643 PolarHBondContact O-N 2.69Å; K640-Q644 WeakPolarHBondContact O-CG 3.5Å; K640-Q644 PolarHBondContact O-N 3.24Å
641G94Very high94.6Very high34 Ų3496.9 Ų96.935%0.35149%0.485SS..Hα-helixtrans-63.1-41.8176.800000112.7V637 L638 Q644 Y645V637-G641 PolarHBondContact O-N 3.38Å; L638-G641 CarbonylContact O-C 3.43Å; L638-G641 PolarHBondContact O-N 3.43Å; L638-G641 VanDerWaalsContact O-N 3.09Å; G641-Q644 PolarHBondContact O-N 3.34Å; G641-Y645 WeakPolarHBondContact O-CB 3.42Å; G641-Y645 PolarHBondContact O-N 3.44Å
642E95.1Very high94.6Very high116 Ų11696.9 Ų96.954%0.54248%0.484SS..Hα-helixtrans-62.6-45.1175-176.6177.1-169.700111.4L638 Q644 Y645 N646L638-E642 WeakPolarHBondContact O-CB 3.48Å; L638-E642 PolarHBondContact O-N 3.25Å; E642-Q644 VanDerWaalsContact C-N 3.34Å; E642-Q644 PolarHBondContact O-N 3.45Å; E642-Y645 PolarHBondContact O-N 3.09Å; E642-N646 WeakPolarHBondContact O-CB 3.46Å; E642-N646 VanDerWaalsContact O-CG 3.29Å; E642-N646 PolarHBondContact O-N 3.36Å; E642-N646 PolarHBondContact O-ND2 3.38Å
643T94.9Very high94.7Very high77 Ų7796.6 Ų96.647%0.47248%0.479SS..Hα-helixtrans-58.9-46.7175.3-56.30000111.2N639 K640 N646 Q647N639-T643 WeakPolarHBondContact O-CB 3.3Å; N639-T643 PolarHBondContact O-N 3.15Å; N639-T643 PolarHBondContact O-OG1 3.46Å; K640-T643 PolarHBondContact O-N 2.69Å; T643-N646 PolarHBondContact O-N 2.9Å; T643-Q647 WeakPolarHBondContact O-CG 3.42Å; T643-Q647 PolarHBondContact O-N 3.38Å
644Q94.7Very high94.7Very high102 Ų10295.5 Ų95.548%0.47747%0.473SS..Hα-helixtrans-64.4-41177.7-72.6177.1-12.700112.2K640 G641 E642 Q647 R648K640-Q644 WeakPolarHBondContact O-CG 3.5Å; K640-Q644 PolarHBondContact O-N 3.24Å; G641-Q644 PolarHBondContact O-N 3.34Å; E642-Q644 VanDerWaalsContact C-N 3.34Å; E642-Q644 PolarHBondContact O-N 3.45Å; Q644-Q647 WeakPolarHBondContact O-CB 3.26Å; Q644-Q647 PolarHBondContact O-N 2.89Å; Q644-R648 WeakPolarHBondContact O-CG 3.45Å; Q644-R648 PolarHBondContact O-N 2.97Å
645Y95.8Very high94.7Very high152 Ų15295.8 Ų95.860%0.59648%0.478SS*.Hα-helixtrans-61.6-47.6176.2177.8-96.7000111.3G641 E642 Q647 R648 V649G641-Y645 WeakPolarHBondContact O-CB 3.42Å; G641-Y645 PolarHBondContact O-N 3.44Å; E642-Y645 PolarHBondContact O-N 3.09Å; Y645-Q647 VanDerWaalsContact C-N 3.3Å; Y645-Q647 PolarHBondContact O-N 2.93Å; Y645-R648 WeakPolarHBondContact O-CB 3.41Å; Y645-R648 PolarHBondContact O-N 2.94Å; Y645-V649 HydrophobicContact CD1-CG2 4.02Å; Y645-V649 HydrophobicContact CE1-CG2 3.58Å; Y645-V649 HydrophobicContact CE2-CG2 4.33Å; Y645-V649 WeakPolarHBondContact O-CG2 3.36Å; Y645-V649 PolarHBondContact O-N 3.36Å
646N96.4Very high94.7Very high85 Ų8597.9 Ų97.946%0.45549%0.485SS..Hα-helixtrans-60.4-39.5177.6-72.3-24.3000111.9E642 T643 R648 V649 E650E642-N646 WeakPolarHBondContact O-CB 3.46Å; E642-N646 VanDerWaalsContact O-CG 3.29Å; E642-N646 PolarHBondContact O-N 3.36Å; E642-N646 PolarHBondContact O-ND2 3.38Å; T643-N646 PolarHBondContact O-N 2.9Å; N646-R648 PolarHBondContact O-N 3.03Å; N646-V649 PolarHBondContact O-N 2.98Å; N646-E650 PolarHBondContact O-N 3.46Å
647Q95.1Very high94.7Very high102 Ų10298.3 Ų98.348%0.47748%0.481SS..Hα-helixtrans-60.2-43.5171.6-71.9172.6-3.900112.2T643 Q644 Y645 V649 E650 D651T643-Q647 WeakPolarHBondContact O-CG 3.42Å; T643-Q647 PolarHBondContact O-N 3.38Å; Q644-Q647 WeakPolarHBondContact O-CB 3.26Å; Q644-Q647 PolarHBondContact O-N 2.89Å; Y645-Q647 VanDerWaalsContact C-N 3.3Å; Y645-Q647 PolarHBondContact O-N 2.93Å; Q647-V649 PolarHBondContact O-N 2.91Å; Q647-E650 PolarHBondContact O-N 2.85Å; Q647-D651 PolarHBondContact O-N 3.48Å
648R94.2Very high94.7Very high143 Ų14397.6 Ų97.654%0.5447%0.471SS..Hα-helixtrans-66.1-36.8176.9-64.2-57.3112.8-158.7-5.5112.4Q644 Y645 N646 E650 D651 M652Q644-R648 WeakPolarHBondContact O-CG 3.45Å; Q644-R648 PolarHBondContact O-N 2.97Å; Y645-R648 WeakPolarHBondContact O-CB 3.41Å; Y645-R648 PolarHBondContact O-N 2.94Å; N646-R648 PolarHBondContact O-N 3.03Å; R648-E650 VanDerWaalsContact C-N 3.32Å; R648-D651 IonicContact CZ-OD2 2.93Å; R648-D651 IonicContact NE-OD2 3.9Å; R648-D651 IonicContact NH1-OD2 3.63Å; R648-D651 PolarHBondContact NH1-OD2 3.31Å; R648-D651 IonicContact NH2-OD2 2.93Å; R648-D651 PolarHBondContact NH2-OD2 3.43Å; R648-D651 PolarHBondContact O-N 2.88Å; R648-M652 WeakPolarHBondContact O-CB 3.37Å; R648-M652 WeakPolarHBondContact O-CG 3.39Å; R648-M652 PolarHBondContact O-N 2.9Å
649V95.3Very high94.6Very high57 Ų5796.4 Ų96.435%0.34546%0.464SS..Hα-helixtrans-63.3-41.7175172.70000110.6Y645 N646 Q647 M652 R653Y645-V649 HydrophobicContact CD1-CG2 4.02Å; Y645-V649 HydrophobicContact CE1-CG2 3.58Å; Y645-V649 HydrophobicContact CE2-CG2 4.33Å; Y645-V649 WeakPolarHBondContact O-CG2 3.36Å; Y645-V649 PolarHBondContact O-N 3.36Å; N646-V649 PolarHBondContact O-N 2.98Å; Q647-V649 PolarHBondContact O-N 2.91Å; V649-M652 HydrophobicContact CG2-CE 4.12Å; V649-M652 PolarHBondContact O-N 3.33Å; V649-R653 PolarHBondContact O-N 2.75Å
650E94.7Very high94.5Very high77 Ų7799.1 Ų99.136%0.3647%0.473SS..Hα-helixtrans-66.8-43.9175.8-174.254.7-155.400111.9N646 Q647 R648 M652 R653 I654N646-E650 PolarHBondContact O-N 3.46Å; Q647-E650 PolarHBondContact O-N 2.85Å; R648-E650 VanDerWaalsContact C-N 3.32Å; E650-M652 VanDerWaalsContact C-N 3.3Å; E650-M652 PolarHBondContact O-N 2.93Å; E650-R653 VanDerWaalsContact CD-NE 3.29Å; E650-R653 WeakPolarHBondContact O-CA 3.49Å; E650-R653 VanDerWaalsContact O-CB 3.28Å; E650-R653 WeakPolarHBondContact O-CB 3.48Å; E650-R653 PolarHBondContact O-N 3.25Å; E650-R653 IonicContact OE1-CZ 3.61Å; E650-R653 IonicContact OE1-NE 3.9Å; E650-R653 PolarHBondContact OE1-NE 3.16Å; E650-R653 IonicContact OE1-NH2 3.51Å; E650-R653 PolarHBondContact OE1-NH2 3.44Å; E650-R653 WeakPolarHBondContact OE2-CD 3.4Å; E650-R653 IonicContact OE2-CZ 3.21Å; E650-R653 IonicContact OE2-NE 2.92Å; E650-R653 PolarHBondContact OE2-NE 3.1Å; E650-R653 IonicContact OE2-NH2 2.73Å; E650-I654 HydrophobicContact CG-CD1 4.2Å; E650-I654 WeakPolarHBondContact O-CG1 3.31Å; E650-I654 PolarHBondContact O-N 3.15Å
651D95.6Very high94.4Very high61 Ų6197.2 Ų97.233%0.32647%0.465SS..Hα-helixtrans-56.6-44.8172.7-73.7-11.2000111.2Q647 R648 R653 I654 L655Q647-D651 PolarHBondContact O-N 3.48Å; R648-D651 IonicContact CZ-OD2 2.93Å; R648-D651 IonicContact NE-OD2 3.9Å; R648-D651 IonicContact NH1-OD2 3.63Å; R648-D651 PolarHBondContact NH1-OD2 3.31Å; R648-D651 IonicContact NH2-OD2 2.93Å; R648-D651 PolarHBondContact NH2-OD2 3.43Å; R648-D651 PolarHBondContact O-N 2.88Å; D651-R653 VanDerWaalsContact C-N 3.3Å; D651-R653 PolarHBondContact O-N 2.99Å; D651-I654 PolarHBondContact O-N 3.35Å; D651-L655 WeakPolarHBondContact O-CB 3.47Å; D651-L655 VanDerWaalsContact O-CG 3.28Å; D651-L655 WeakPolarHBondContact O-CG 3.47Å; D651-L655 PolarHBondContact O-N 3.09Å
652M92.6Very high94.3Very high97 Ų97100 Ų10048%0.47847%0.471SS..Hα-helixtrans-62.7-36.8175-77.5-169-67.500112.3R648 V649 E650 K656R648-M652 WeakPolarHBondContact O-CB 3.37Å; R648-M652 WeakPolarHBondContact O-CG 3.39Å; R648-M652 PolarHBondContact O-N 2.9Å; V649-M652 HydrophobicContact CG2-CE 4.12Å; V649-M652 PolarHBondContact O-N 3.33Å; E650-M652 VanDerWaalsContact C-N 3.3Å; E650-M652 PolarHBondContact O-N 2.93Å; M652-K656 WeakPolarHBondContact O-CB 3.41Å; M652-K656 VanDerWaalsContact O-CG 3.25Å; M652-K656 WeakPolarHBondContact O-CG 3.37Å; M652-K656 PolarHBondContact O-N 2.94Å
653R95.7Very high94.3Very high126 Ų126103.2 Ų103.248%0.47548%0.478SS..Hα-helixtrans-63.8-47.2175.7-167.9-170.174.986.44.7110.4V649 E650 D651 K656 L657V649-R653 PolarHBondContact O-N 2.75Å; E650-R653 VanDerWaalsContact CD-NE 3.29Å; E650-R653 WeakPolarHBondContact O-CA 3.49Å; E650-R653 VanDerWaalsContact O-CB 3.28Å; E650-R653 WeakPolarHBondContact O-CB 3.48Å; E650-R653 PolarHBondContact O-N 3.25Å; E650-R653 IonicContact OE1-CZ 3.61Å; E650-R653 IonicContact OE1-NE 3.9Å; E650-R653 PolarHBondContact OE1-NE 3.16Å; E650-R653 IonicContact OE1-NH2 3.51Å; E650-R653 PolarHBondContact OE1-NH2 3.44Å; E650-R653 WeakPolarHBondContact OE2-CD 3.4Å; E650-R653 IonicContact OE2-CZ 3.21Å; E650-R653 IonicContact OE2-NE 2.92Å; E650-R653 PolarHBondContact OE2-NE 3.1Å; E650-R653 IonicContact OE2-NH2 2.73Å; D651-R653 VanDerWaalsContact C-N 3.3Å; D651-R653 PolarHBondContact O-N 2.99Å; R653-K656 PolarHBondContact O-N 3.36Å; R653-L657 WeakPolarHBondContact O-CG 3.41Å; R653-L657 PolarHBondContact O-N 3.03Å
654I94.5Very high94.1Very high83 Ų83108.3 Ų108.343%0.42649%0.489SS..Hα-helixtrans-60.9-48.3176.9-65.6167.7000110.2E650 D651 K656 L657 E658E650-I654 HydrophobicContact CG-CD1 4.2Å; E650-I654 WeakPolarHBondContact O-CG1 3.31Å; E650-I654 PolarHBondContact O-N 3.15Å; D651-I654 PolarHBondContact O-N 3.35Å; I654-K656 VanDerWaalsContact C-N 3.34Å; I654-K656 PolarHBondContact O-N 2.95Å; I654-L657 WeakPolarHBondContact O-CB 3.42Å; I654-L657 PolarHBondContact O-N 3.28Å; I654-L657 VanDerWaalsContact O-N 3.08Å; I654-E658 PolarHBondContact O-N 3.49Å
655L93.7Very high93.9Very high109 Ų109107.4 Ų107.457%0.57149%0.485SS*.Hα-helixtrans-61.8-39177.8-72.5170.7000112.4D651 L657 E658 I659D651-L655 WeakPolarHBondContact O-CB 3.47Å; D651-L655 VanDerWaalsContact O-CG 3.28Å; D651-L655 WeakPolarHBondContact O-CG 3.47Å; D651-L655 PolarHBondContact O-N 3.09Å; L655-L657 VanDerWaalsContact C-N 3.31Å; L655-L657 PolarHBondContact O-N 3.4Å; L655-E658 PolarHBondContact O-N 3.28Å; L655-I659 WeakPolarHBondContact O-CB 3.32Å; L655-I659 VanDerWaalsContact O-CG1 3.25Å; L655-I659 WeakPolarHBondContact O-CG1 3.46Å; L655-I659 PolarHBondContact O-N 3.24Å
656K94.7Very high93.6Very high141 Ų141107.7 Ų107.761%0.61349%0.489SS*.Hα-helixtrans-62.6-38.4173.9-79.3174.2-178.9176.70112M652 R653 I654 K660M652-K656 WeakPolarHBondContact O-CB 3.41Å; M652-K656 VanDerWaalsContact O-CG 3.25Å; M652-K656 WeakPolarHBondContact O-CG 3.37Å; M652-K656 PolarHBondContact O-N 2.94Å; R653-K656 PolarHBondContact O-N 3.36Å; I654-K656 VanDerWaalsContact C-N 3.34Å; I654-K656 PolarHBondContact O-N 2.95Å; K656-K660 WeakPolarHBondContact O-CG 3.37Å; K656-K660 PolarHBondContact O-N 3.29Å
657L93.4Very high93.3Very high88 Ų88104.9 Ų104.946%0.46148%0.48SS..Hα-helixtrans-66.2-43.7174.4-71171.2000111.1R653 I654 L655 I659 K660 K661R653-L657 WeakPolarHBondContact O-CG 3.41Å; R653-L657 PolarHBondContact O-N 3.03Å; I654-L657 WeakPolarHBondContact O-CB 3.42Å; I654-L657 PolarHBondContact O-N 3.28Å; I654-L657 VanDerWaalsContact O-N 3.08Å; L655-L657 VanDerWaalsContact C-N 3.31Å; L655-L657 PolarHBondContact O-N 3.4Å; L657-I659 PolarHBondContact O-N 2.95Å; L657-K660 WeakPolarHBondContact O-CB 3.5Å; L657-K660 PolarHBondContact O-N 3.24Å; L657-K660 VanDerWaalsContact O-N 3.17Å; L657-K661 PolarHBondContact O-N 3.42Å
658E93.9Very high93Very high79 Ų79105 Ų10537%0.36948%0.483SS..Hα-helixtrans-64.9-41.1178.1-161.360.8-154.100111.6I654 L655 K660 K661 L662I654-E658 PolarHBondContact O-N 3.49Å; L655-E658 PolarHBondContact O-N 3.28Å; E658-K660 VanDerWaalsContact C-N 3.33Å; E658-K660 PolarHBondContact O-N 2.93Å; E658-K661 WeakPolarHBondContact O-CB 3.32Å; E658-K661 PolarHBondContact O-N 3.28Å; E658-K661 IonicContact OE1-NZ 3.95Å; E658-K661 PolarHBondContact OE1-NZ 2.88Å; E658-L662 HydrophobicContact CG-CD1 4.29Å; E658-L662 WeakPolarHBondContact O-CB 3.47Å; E658-L662 WeakPolarHBondContact O-CG 3.32Å; E658-L662 PolarHBondContact O-N 3.25Å
659I92.2Very high92.7Very high84 Ų84103.4 Ų103.443%0.43148%0.484SS..Hα-helixtrans-60.3-42.8172.9-70.1166.6000110.9L655 L657 K661 R663L655-I659 WeakPolarHBondContact O-CB 3.32Å; L655-I659 VanDerWaalsContact O-CG1 3.25Å; L655-I659 WeakPolarHBondContact O-CG1 3.46Å; L655-I659 PolarHBondContact O-N 3.24Å; L657-I659 PolarHBondContact O-N 2.95Å; I659-K661 VanDerWaalsContact C-N 3.34Å; I659-R663 HydrophobicContact CG2-CG 4.38Å; I659-R663 WeakPolarHBondContact O-CB 3.45Å; I659-R663 VanDerWaalsContact O-CG 3.23Å; I659-R663 WeakPolarHBondContact O-CG 3.35Å; I659-R663 PolarHBondContact O-N 3.45Å
660K93.7Very high92.3Very high131 Ų131103.5 Ų103.557%0.5749%0.491SS*.Hα-helixtrans-63-41.4176-79.8-178-179.7-178.30111.5K656 L657 E658 R663 R664K656-K660 WeakPolarHBondContact O-CG 3.37Å; K656-K660 PolarHBondContact O-N 3.29Å; L657-K660 WeakPolarHBondContact O-CB 3.5Å; L657-K660 PolarHBondContact O-N 3.24Å; L657-K660 VanDerWaalsContact O-N 3.17Å; E658-K660 VanDerWaalsContact C-N 3.33Å; E658-K660 PolarHBondContact O-N 2.93Å; K660-R663 PolarHBondContact O-N 3.5Å; K660-R664 WeakPolarHBondContact O-CG 3.33Å; K660-R664 PolarHBondContact O-N 2.95Å
661K92.6Very high91.9Very high98 Ų98108 Ų10843%0.42650%0.504SS..Hα-helixtrans-62.6-52176.4-178.7-173.6161.5-151.90111.2L657 E658 I659 R663 R664 E665L657-K661 PolarHBondContact O-N 3.42Å; E658-K661 WeakPolarHBondContact O-CB 3.32Å; E658-K661 PolarHBondContact O-N 3.28Å; E658-K661 IonicContact OE1-NZ 3.95Å; E658-K661 PolarHBondContact OE1-NZ 2.88Å; I659-K661 VanDerWaalsContact C-N 3.34Å; K661-R663 VanDerWaalsContact C-N 3.31Å; K661-R663 PolarHBondContact O-N 2.95Å; K661-R664 WeakPolarHBondContact O-CA 3.22Å; K661-R664 WeakPolarHBondContact O-CB 3.31Å; K661-R664 PolarHBondContact O-N 2.94Å; K661-E665 VanDerWaalsContact CE-OE1 3.28Å; K661-E665 WeakPolarHBondContact CE-OE1 3.45Å; K661-E665 PolarHBondContact O-N 3.22Å
662L92Very high91.3Very high92 Ų92107.9 Ų107.948%0.48251%0.509SS..Hα-helixtrans-60.3-37.9177.4-70.9170.7000112.5E658 E665 K666E658-L662 HydrophobicContact CG-CD1 4.29Å; E658-L662 WeakPolarHBondContact O-CB 3.47Å; E658-L662 WeakPolarHBondContact O-CG 3.32Å; E658-L662 PolarHBondContact O-N 3.25Å; L662-E665 PolarHBondContact O-N 2.91Å; L662-K666 WeakPolarHBondContact O-CB 3.5Å; L662-K666 PolarHBondContact O-N 3.49Å
663R94.2Very high90.9Very high184 Ų184108 Ų10869%0.69452%0.515SS*.Hα-helixtrans-64.9-39173.3-76.3177.6-177.6-168.51.9112.4I659 K660 K661 G667I659-R663 HydrophobicContact CG2-CG 4.38Å; I659-R663 WeakPolarHBondContact O-CB 3.45Å; I659-R663 VanDerWaalsContact O-CG 3.23Å; I659-R663 WeakPolarHBondContact O-CG 3.35Å; I659-R663 PolarHBondContact O-N 3.45Å; K660-R663 PolarHBondContact O-N 3.5Å; K661-R663 VanDerWaalsContact C-N 3.31Å; K661-R663 PolarHBondContact O-N 2.95Å; R663-G667 PolarHBondContact O-N 3.43Å
664R90.1Very high90.4Very high183 Ų183105.1 Ų105.169%0.69152%0.518SS*.Hα-helixtrans-64.8-47.3174-75.1173.7178.4173.2-1.8111K660 K661 K666 G667 I668K660-R664 WeakPolarHBondContact O-CG 3.33Å; K660-R664 PolarHBondContact O-N 2.95Å; K661-R664 WeakPolarHBondContact O-CA 3.22Å; K661-R664 WeakPolarHBondContact O-CB 3.31Å; K661-R664 PolarHBondContact O-N 2.94Å; R664-K666 PolarHBondContact O-N 3.44Å; R664-G667 CarbonylContact O-C 3.09Å; R664-G667 PolarHBondContact O-N 2.84Å; R664-G667 VanDerWaalsContact O-N 3.1Å; R664-I668 WeakPolarHBondContact O-CG1 3.38Å; R664-I668 PolarHBondContact O-N 3.44Å
665E91.6Very high89.8Confident84 Ų84105 Ų10539%0.39352%0.518SS..Hα-helixtrans-57.7-47.8175.8-75.1175.5-173.600111.4K661 L662 G667 I668 L669K661-E665 VanDerWaalsContact CE-OE1 3.28Å; K661-E665 WeakPolarHBondContact CE-OE1 3.45Å; K661-E665 PolarHBondContact O-N 3.22Å; L662-E665 PolarHBondContact O-N 2.91Å; E665-G667 VanDerWaalsContact C-N 3.3Å; E665-G667 PolarHBondContact O-N 3.49Å; E665-I668 PolarHBondContact O-N 2.85Å; E665-I668 VanDerWaalsContact O-N 3.17Å; E665-L669 WeakPolarHBondContact O-CB 3.36Å; E665-L669 WeakPolarHBondContact O-CG 3.39Å; E665-L669 PolarHBondContact O-N 2.88Å
666K89.5Confident89.3Confident157 Ų157102.9 Ų102.968%0.68351%0.509SS*.Hα-helixtrans-56.3-43.6173-178-177175.9-1800111.9L662 R664 I668 L669 A670L662-K666 WeakPolarHBondContact O-CB 3.5Å; L662-K666 PolarHBondContact O-N 3.49Å; R664-K666 PolarHBondContact O-N 3.44Å; K666-I668 VanDerWaalsContact C-N 3.35Å; K666-L669 PolarHBondContact O-N 3.22Å; K666-A670 WeakPolarHBondContact O-CB 3.27Å; K666-A670 PolarHBondContact O-N 3.27Å
667G91Very high88.7Confident26 Ų26103 Ų10327%0.26851%0.512SS..Hα-helixtrans-68.3-30.3179.100000114R663 R664 E665 R671R663-G667 PolarHBondContact O-N 3.43Å; R664-G667 CarbonylContact O-C 3.09Å; R664-G667 PolarHBondContact O-N 2.84Å; R664-G667 VanDerWaalsContact O-N 3.1Å; E665-G667 VanDerWaalsContact C-N 3.3Å; E665-G667 PolarHBondContact O-N 3.49Å; G667-R671 PolarHBondContact O-N 3.06Å; G667-R671 PolarHBondContact O-NE 2.99Å; G667-R671 VanDerWaalsContact O-NE 3.14Å
668I88.1Confident88.2Confident106 Ų106104.7 Ų104.754%0.54452%0.518SS..Hα-helixtrans-70.8-48.5171.5-66.7164.6000109.4R664 E665 K666 A670 R671 S672R664-I668 WeakPolarHBondContact O-CG1 3.38Å; R664-I668 PolarHBondContact O-N 3.44Å; E665-I668 PolarHBondContact O-N 2.85Å; E665-I668 VanDerWaalsContact O-N 3.17Å; K666-I668 VanDerWaalsContact C-N 3.35Å; I668-A670 VanDerWaalsContact C-N 3.35Å; I668-A670 PolarHBondContact O-N 3.5Å; I668-R671 PolarHBondContact O-N 3.43Å; I668-R671 VanDerWaalsContact O-N 3.17Å; I668-S672 PolarHBondContact O-N 3.47Å; I668-S672 PolarHBondContact O-OG 3.38Å
669L86.7Confident87.6Confident109 Ų109105.5 Ų105.557%0.57152%0.524SS*.Hα-helixtrans-60.1-42.1178.6-77163.5000112.4E665 K666 R671 S672 V673E665-L669 WeakPolarHBondContact O-CB 3.36Å; E665-L669 WeakPolarHBondContact O-CG 3.39Å; E665-L669 PolarHBondContact O-N 2.88Å; K666-L669 PolarHBondContact O-N 3.22Å; L669-R671 VanDerWaalsContact C-N 3.32Å; L669-R671 PolarHBondContact O-N 3.43Å; L669-S672 VanDerWaalsContact CA-OG 3.27Å; L669-S672 WeakPolarHBondContact CA-OG 3.35Å; L669-S672 PolarHBondContact O-N 3.4Å; L669-S672 PolarHBondContact O-OG 3.03Å; L669-V673 VanDerWaalsContact O-CG2 3.3Å; L669-V673 WeakPolarHBondContact O-CG2 3.44Å; L669-V673 PolarHBondContact O-N 2.85Å
670A87.5Confident87.3Confident58 Ų58109.2 Ų109.248%0.47953%0.533SS..Hα-helixtrans-61.7-39.6176.700000112.3K666 I668 V673 A674K666-A670 WeakPolarHBondContact O-CB 3.27Å; K666-A670 PolarHBondContact O-N 3.27Å; I668-A670 VanDerWaalsContact C-N 3.35Å; I668-A670 PolarHBondContact O-N 3.5Å; A670-V673 PolarHBondContact O-N 2.93Å; A670-A674 PolarHBondContact O-N 2.94Å
671R85.9Confident86.9Confident171 Ų171109.3 Ų109.365%0.64554%0.535SS*.Hα-helixtrans-67.3-42.4173.8-79-178.2-85-147.61.9112G667 I668 L669 V673 A674 N675G667-R671 PolarHBondContact O-N 3.06Å; G667-R671 PolarHBondContact O-NE 2.99Å; G667-R671 VanDerWaalsContact O-NE 3.14Å; I668-R671 PolarHBondContact O-N 3.43Å; I668-R671 VanDerWaalsContact O-N 3.17Å; L669-R671 VanDerWaalsContact C-N 3.32Å; L669-R671 PolarHBondContact O-N 3.43Å; R671-V673 VanDerWaalsContact C-N 3.25Å; R671-V673 PolarHBondContact O-N 3.27Å; R671-A674 PolarHBondContact O-N 3.39Å; R671-N675 PolarHBondContact O-N 2.95Å; R671-N675 VanDerWaalsContact O-N 3.08Å; R671-N675 PolarHBondContact O-OD1 3.29Å
672S83.9Confident86.5Confident59 Ų59110.2 Ų110.241%0.41354%0.541SS..Hα-helixtrans-62-35.3174.758.70000112.4I668 L669 V676I668-S672 PolarHBondContact O-N 3.47Å; I668-S672 PolarHBondContact O-OG 3.38Å; L669-S672 VanDerWaalsContact CA-OG 3.27Å; L669-S672 WeakPolarHBondContact CA-OG 3.35Å; L669-S672 PolarHBondContact O-N 3.4Å; L669-S672 PolarHBondContact O-OG 3.03Å; S672-V676 WeakPolarHBondContact O-CG2 3.44Å; S672-V676 PolarHBondContact O-N 2.82Å
673V84Confident86Confident101 Ų101110.8 Ų110.861%0.61254%0.544SS*.Hα-helixtrans-68.5-42.2175.7170.30000111.4L669 A670 R671 N675 V676L669-V673 VanDerWaalsContact O-CG2 3.3Å; L669-V673 WeakPolarHBondContact O-CG2 3.44Å; L669-V673 PolarHBondContact O-N 2.85Å; A670-V673 PolarHBondContact O-N 2.93Å; R671-V673 VanDerWaalsContact C-N 3.25Å; R671-V673 PolarHBondContact O-N 3.27Å; V673-N675 VanDerWaalsContact C-N 3.31Å; V673-N675 PolarHBondContact O-N 3.24Å; V673-V676 VanDerWaalsContact O-CB 3.24Å; V673-V676 WeakPolarHBondContact O-CB 3.33Å; V673-V676 WeakPolarHBondContact O-CG2 3.37Å; V673-V676 PolarHBondContact O-N 3.34Å; V673-V676 VanDerWaalsContact O-N 3.1Å
674A84.5Confident85.6Confident65 Ų65110.1 Ų110.154%0.53754%0.543SS..Hα-helixtrans-61-40.9176.600000112.1A670 R671 V676A670-A674 PolarHBondContact O-N 2.94Å; R671-A674 PolarHBondContact O-N 3.39Å; A674-V676 PolarHBondContact O-N 3.47Å
675N83.3Confident85.5Confident81 Ų81106.7 Ų106.743%0.43353%0.534SS..Hα-helixtrans-67.9-13.7177.2-69.316.2000113.2R671 V673 E677 E678 L679R671-N675 PolarHBondContact O-N 2.95Å; R671-N675 VanDerWaalsContact O-N 3.08Å; R671-N675 PolarHBondContact O-OD1 3.29Å; V673-N675 VanDerWaalsContact C-N 3.31Å; V673-N675 PolarHBondContact O-N 3.24Å; N675-E677 PolarHBondContact O-N 3.46Å; N675-E678 PolarHBondContact O-N 2.99Å; N675-L679 HydrophobicContact CB-CD1 4.2Å; N675-L679 WeakPolarHBondContact O-CB 3.36Å; N675-L679 WeakPolarHBondContact O-CD1 3.27Å; N675-L679 WeakPolarHBondContact O-CG 3.41Å; N675-L679 PolarHBondContact O-N 3.03Å
676V83.1Confident85.1Confident63 Ų63108.4 Ų108.438%0.38254%0.544SS..Hα-helixtrans-59.7-34.6-179.9173.50000111.4S672 V673 A674 R680S672-V676 WeakPolarHBondContact O-CG2 3.44Å; S672-V676 PolarHBondContact O-N 2.82Å; V673-V676 VanDerWaalsContact O-CB 3.24Å; V673-V676 WeakPolarHBondContact O-CB 3.33Å; V673-V676 WeakPolarHBondContact O-CG2 3.37Å; V673-V676 PolarHBondContact O-N 3.34Å; V673-V676 VanDerWaalsContact O-N 3.1Å; A674-V676 PolarHBondContact O-N 3.47Å; V676-R680 HydrophobicContact CG1-CG 4.38Å; V676-R680 WeakPolarHBondContact O-CB 3.46Å; V676-R680 WeakPolarHBondContact O-CG 3.4Å; V676-R680 PolarHBondContact O-N 3.27Å
677E82.2Confident84.8Confident143 Ų143105.9 Ų105.967%0.66853%0.534SS*.Hα-helixtrans-76.6-43.1-175.7-143.2147.9-147.400111.7N675 R680 Q681N675-E677 PolarHBondContact O-N 3.46Å; E677-R680 WeakPolarHBondContact O-CB 3.32Å; E677-R680 PolarHBondContact O-N 2.99Å; E677-Q681 WeakPolarHBondContact O-CG 3.22Å; E677-Q681 PolarHBondContact O-N 3.49Å
678E81.8Confident84.5Confident124 Ų124113.4 Ų113.458%0.57955%0.554SS**Hα-helixtrans-61.1-47.9169.5-68.5179.3172.100111N675 R680 Q681 E682N675-E678 PolarHBondContact O-N 2.99Å; E678-R680 VanDerWaalsContact C-N 3.27Å; E678-R680 PolarHBondContact O-N 3.18Å; E678-Q681 WeakPolarHBondContact O-CB 3.34Å; E678-Q681 PolarHBondContact O-N 3.04Å; E678-E682 PolarHBondContact O-N 3.45Å
679L82.3Confident84.3Confident97 Ų97111.6 Ų111.651%0.50854%0.544SS..Hα-helixtrans-60.3-36.3176.6-75.2168000111.8N675 L683N675-L679 HydrophobicContact CB-CD1 4.2Å; N675-L679 WeakPolarHBondContact O-CB 3.36Å; N675-L679 WeakPolarHBondContact O-CD1 3.27Å; N675-L679 WeakPolarHBondContact O-CG 3.41Å; N675-L679 PolarHBondContact O-N 3.03Å; L679-L683 VanDerWaalsContact O-CB 3.29Å; L679-L683 WeakPolarHBondContact O-CB 3.33Å; L679-L683 PolarHBondContact O-N 3.1Å
680R84.9Confident84Confident161 Ų161112.5 Ų112.561%0.60854%0.543SS*.Hα-helixtrans-64.7-42.9173.3-83173.5-178.3-147.21.2111.5V676 E677 E678 L683 Y684V676-R680 HydrophobicContact CG1-CG 4.38Å; V676-R680 WeakPolarHBondContact O-CB 3.46Å; V676-R680 WeakPolarHBondContact O-CG 3.4Å; V676-R680 PolarHBondContact O-N 3.27Å; E677-R680 WeakPolarHBondContact O-CB 3.32Å; E677-R680 PolarHBondContact O-N 2.99Å; E678-R680 VanDerWaalsContact C-N 3.27Å; E678-R680 PolarHBondContact O-N 3.18Å; R680-L683 WeakPolarHBondContact O-CB 3.49Å; R680-L683 PolarHBondContact O-N 2.98Å; R680-Y684 WeakPolarHBondContact O-CD2 3.36Å; R680-Y684 PolarHBondContact O-N 2.93Å
681Q85.1Confident83.9Confident134 Ų134114.6 Ų114.663%0.62655%0.546SS*.Hα-helixtrans-65.9-43.9176.9-69.8177.816.600111.6E677 E678 L683 Y684 H685E677-Q681 WeakPolarHBondContact O-CG 3.22Å; E677-Q681 PolarHBondContact O-N 3.49Å; E678-Q681 WeakPolarHBondContact O-CB 3.34Å; E678-Q681 PolarHBondContact O-N 3.04Å; Q681-L683 VanDerWaalsContact C-N 3.29Å; Q681-L683 PolarHBondContact O-N 3.45Å; Q681-Y684 PolarHBondContact O-N 3.43Å; Q681-H685 WeakPolarHBondContact O-CB 3.43Å; Q681-H685 PolarHBondContact O-N 3.32Å
682E84Confident83.7Confident116 Ų116112.2 Ų112.254%0.54254%0.54SS..Hα-helixtrans-59.7-40.2171.2-74.6-173.6168.600110.9E678 Y684 H685 M686E678-E682 PolarHBondContact O-N 3.45Å; E682-Y684 PolarHBondContact O-N 3.18Å; E682-H685 PolarHBondContact O-N 3.39Å; E682-M686 VanDerWaalsContact O-CB 3.23Å; E682-M686 WeakPolarHBondContact O-CB 3.47Å; E682-M686 WeakPolarHBondContact O-CG 3.27Å; E682-M686 PolarHBondContact O-N 2.92Å
683L82.5Confident83.4Confident104 Ų104113.1 Ų113.155%0.54554%0.538SS..Hα-helixtrans-61.4-44.2175.2-132.5168.8000111.3L679 R680 Q681 Q687L679-L683 VanDerWaalsContact O-CB 3.29Å; L679-L683 WeakPolarHBondContact O-CB 3.33Å; L679-L683 PolarHBondContact O-N 3.1Å; R680-L683 WeakPolarHBondContact O-CB 3.49Å; R680-L683 PolarHBondContact O-N 2.98Å; Q681-L683 VanDerWaalsContact C-N 3.29Å; Q681-L683 PolarHBondContact O-N 3.45Å; L683-Q687 HydrophobicContact CD2-CG 4.26Å; L683-Q687 VanDerWaalsContact O-CB 3.28Å; L683-Q687 WeakPolarHBondContact O-CB 3.42Å; L683-Q687 PolarHBondContact O-N 3.45Å
684Y86.8Confident83.1Confident171 Ų171115 Ų11567%0.67153%0.534SS*.Hα-helixtrans-64.8-41.2175-86.1-66.4000112.2R680 Q681 E682 Q687 R688R680-Y684 WeakPolarHBondContact O-CD2 3.36Å; R680-Y684 PolarHBondContact O-N 2.93Å; Q681-Y684 PolarHBondContact O-N 3.43Å; E682-Y684 PolarHBondContact O-N 3.18Å; Y684-Q687 PolarHBondContact O-N 2.9Å; Y684-R688 PolarHBondContact O-N 3.08Å
685H86.8Confident82.8Confident110 Ų110116.3 Ų116.351%0.50954%0.536SS..Hα-helixtrans-63.5-49.7176.1-177.467.7000110.8Q681 E682 Q687 R688 E689Q681-H685 WeakPolarHBondContact O-CB 3.43Å; Q681-H685 PolarHBondContact O-N 3.32Å; E682-H685 PolarHBondContact O-N 3.39Å; H685-Q687 VanDerWaalsContact C-N 3.33Å; H685-Q687 PolarHBondContact O-N 3.28Å; H685-R688 CarbonylContact O-C 3.44Å; H685-R688 WeakPolarHBondContact O-CA 3.32Å; H685-R688 WeakPolarHBondContact O-CB 3.46Å; H685-R688 PolarHBondContact O-N 3.38Å; H685-R688 VanDerWaalsContact O-N 3.08Å; H685-E689 WeakPolarHBondContact O-CG 3.41Å; H685-E689 PolarHBondContact O-N 3.35Å
686M83.6Confident82.5Confident121 Ų121119.4 Ų119.460%0.59654%0.541SS*.Hα-helixtrans-64.3-33.4175.8-70.2-58.5-67.800112.2E682 F690E682-M686 VanDerWaalsContact O-CB 3.23Å; E682-M686 WeakPolarHBondContact O-CB 3.47Å; E682-M686 WeakPolarHBondContact O-CG 3.27Å; E682-M686 PolarHBondContact O-N 2.92Å; M686-F690 WeakPolarHBondContact O-CA 3.44Å; M686-F690 WeakPolarHBondContact O-CB 3.49Å; M686-F690 PolarHBondContact O-N 2.88Å
687Q83.2Confident81.6Confident103 Ų103118.9 Ų118.948%0.48154%0.54SS..Hα-helixtrans-66.3-39.6170.5-94.1-178.5-20.900111.8L683 Y684 H685 L691L683-Q687 HydrophobicContact CD2-CG 4.26Å; L683-Q687 VanDerWaalsContact O-CB 3.28Å; L683-Q687 WeakPolarHBondContact O-CB 3.42Å; L683-Q687 PolarHBondContact O-N 3.45Å; Y684-Q687 PolarHBondContact O-N 2.9Å; H685-Q687 VanDerWaalsContact C-N 3.33Å; H685-Q687 PolarHBondContact O-N 3.28Å; Q687-L691 WeakPolarHBondContact O-CB 3.47Å; Q687-L691 WeakPolarHBondContact O-CG 3.4Å; Q687-L691 PolarHBondContact O-N 3.24Å
688R85.1Confident81.2Confident184 Ų184119.6 Ų119.669%0.69454%0.536SS*.Hα-helixtrans-65.7-49.3174.5-96.1-176.4166.1-164.4-2.6111.7Y684 H685 F690 L691 K692Y684-R688 PolarHBondContact O-N 3.08Å; H685-R688 CarbonylContact O-C 3.44Å; H685-R688 WeakPolarHBondContact O-CA 3.32Å; H685-R688 WeakPolarHBondContact O-CB 3.46Å; H685-R688 PolarHBondContact O-N 3.38Å; H685-R688 VanDerWaalsContact O-N 3.08Å; R688-F690 VanDerWaalsContact C-N 3.3Å; R688-L691 PolarHBondContact O-N 3.06Å; R688-K692 WeakPolarHBondContact O-CG 3.48Å; R688-K692 PolarHBondContact O-N 2.89Å
689E83.9Confident80.3Confident69 Ų69116 Ų11632%0.32253%0.527SS..Hα-helixtrans-62.7-39.6175.8-69.5-59.1121.400110.4H685 L691 K692 E693H685-E689 WeakPolarHBondContact O-CG 3.41Å; H685-E689 PolarHBondContact O-N 3.35Å; E689-L691 PolarHBondContact O-N 3.25Å; E689-K692 WeakPolarHBondContact O-CB 3.39Å; E689-K692 PolarHBondContact O-N 3.36Å; E689-K692 IonicContact OE1-NZ 3.24Å; E689-K692 PolarHBondContact OE1-NZ 2.95Å; E689-E693 VanDerWaalsContact O-CB 3.29Å; E689-E693 WeakPolarHBondContact O-CB 3.39Å; E689-E693 PolarHBondContact O-N 3.25Å
690F80.3Confident79Confident128 Ų128114.6 Ų114.656%0.56152%0.52SS*.Hα-helixtrans-63.5-39173.1177.3-99.8000112.2M686 R688 E693 R694M686-F690 WeakPolarHBondContact O-CA 3.44Å; M686-F690 WeakPolarHBondContact O-CB 3.49Å; M686-F690 PolarHBondContact O-N 2.88Å; R688-F690 VanDerWaalsContact C-N 3.3Å; F690-E693 PolarHBondContact O-N 3.49Å; F690-R694 WeakPolarHBondContact O-CA 3.44Å; F690-R694 WeakPolarHBondContact O-CB 3.5Å; F690-R694 PolarHBondContact O-N 3.23Å
691L84Confident77.6Confident101 Ų101112.6 Ų112.653%0.52952%0.518SS..Hα-helixtrans-66.1-43.6174-81.3164.2000111.2Q687 R688 E689 R694 T695Q687-L691 WeakPolarHBondContact O-CB 3.47Å; Q687-L691 WeakPolarHBondContact O-CG 3.4Å; Q687-L691 PolarHBondContact O-N 3.24Å; R688-L691 PolarHBondContact O-N 3.06Å; E689-L691 PolarHBondContact O-N 3.25Å; L691-R694 PolarHBondContact O-N 3.04Å; L691-T695 WeakPolarHBondContact O-CB 3.46Å; L691-T695 PolarHBondContact O-N 3.26Å; L691-T695 PolarHBondContact O-OG1 2.93Å
692K82.9Confident76.5Confident121 Ų121112.7 Ų112.753%0.52652%0.518SS..Hα-helixtrans-59.7-47.6173.8-73.7178.3-174.1169.10110.9R688 E689 T695 R696R688-K692 WeakPolarHBondContact O-CG 3.48Å; R688-K692 PolarHBondContact O-N 2.89Å; E689-K692 WeakPolarHBondContact O-CB 3.39Å; E689-K692 PolarHBondContact O-N 3.36Å; E689-K692 IonicContact OE1-NZ 3.24Å; E689-K692 PolarHBondContact OE1-NZ 2.95Å; K692-T695 CarbonylContact O-C 3.49Å; K692-T695 WeakPolarHBondContact O-CA 3.47Å; K692-T695 VanDerWaalsContact O-CB 3.31Å; K692-T695 WeakPolarHBondContact O-CB 3.34Å; K692-T695 PolarHBondContact O-N 2.86Å; K692-T695 VanDerWaalsContact O-N 3.07Å; K692-R696 WeakPolarHBondContact O-CB 3.47Å; K692-R696 PolarHBondContact O-N 3.3Å
693E77.2Confident75Confident78 Ų78113.7 Ų113.736%0.36452%0.523SS..Hα-helixtrans-74.5-28.1-177.5-150.764-179.800111.6E689 F690 T695 R696 C697E689-E693 VanDerWaalsContact O-CB 3.29Å; E689-E693 WeakPolarHBondContact O-CB 3.39Å; E689-E693 PolarHBondContact O-N 3.25Å; F690-E693 PolarHBondContact O-N 3.49Å; E693-T695 VanDerWaalsContact C-N 3.3Å; E693-R696 CarbonylContact O-C 3.52Å; E693-R696 PolarHBondContact O-N 3.28Å; E693-R696 WeakPolarHBondContact OE1-CD 3.39Å; E693-R696 IonicContact OE1-CZ 3.66Å; E693-R696 IonicContact OE1-NE 3.98Å; E693-R696 IonicContact OE1-NH1 2.92Å; E693-R696 PolarHBondContact OE1-NH1 3Å; E693-R696 WeakPolarHBondContact OE2-CD 3.46Å; E693-R696 IonicContact OE2-NH1 4Å; E693-C697 WeakPolarHBondContact O-CA 3.41Å; E693-C697 WeakPolarHBondContact O-CB 3.33Å; E693-C697 PolarHBondContact O-N 2.97Å; E693-C697 PolarHBondContact O-SG 3.49Å
694R78.3Confident73.3Confident140 Ų140114.4 Ų114.453%0.52853%0.527SS..Hα-helixtrans-67.7-33.8167.2-177.6177.7164.4176-3.2111.2F690 L691 R698F690-R694 WeakPolarHBondContact O-CA 3.44Å; F690-R694 WeakPolarHBondContact O-CB 3.5Å; F690-R694 PolarHBondContact O-N 3.23Å; L691-R694 PolarHBondContact O-N 3.04Å; R694-R698 WeakPolarHBondContact O-CB 3.47Å; R694-R698 PolarHBondContact O-N 3.45Å
695T78.4Confident71.7Confident94 Ų94114 Ų11458%0.57753%0.531SS*.Hα-helixtrans-71.8-41174.1-46.70000110.6L691 K692 E693 R698 A699L691-T695 WeakPolarHBondContact O-CB 3.46Å; L691-T695 PolarHBondContact O-N 3.26Å; L691-T695 PolarHBondContact O-OG1 2.93Å; K692-T695 CarbonylContact O-C 3.49Å; K692-T695 WeakPolarHBondContact O-CA 3.47Å; K692-T695 VanDerWaalsContact O-CB 3.31Å; K692-T695 WeakPolarHBondContact O-CB 3.34Å; K692-T695 PolarHBondContact O-N 2.86Å; K692-T695 VanDerWaalsContact O-N 3.07Å; E693-T695 VanDerWaalsContact C-N 3.3Å; T695-R698 WeakPolarHBondContact O-CB 3.39Å; T695-R698 PolarHBondContact O-N 3.39Å; T695-A699 PolarHBondContact O-N 3.34Å
696R75.4Confident69.7Low145 Ų145115.2 Ų115.255%0.54754%0.541SS..Hα-helixtrans-68.7-40.8175.4-166.2-169.3-175176.31.1111.9K692 E693 R698 A699 L700K692-R696 WeakPolarHBondContact O-CB 3.47Å; K692-R696 PolarHBondContact O-N 3.3Å; E693-R696 CarbonylContact O-C 3.52Å; E693-R696 PolarHBondContact O-N 3.28Å; E693-R696 WeakPolarHBondContact OE1-CD 3.39Å; E693-R696 IonicContact OE1-CZ 3.66Å; E693-R696 IonicContact OE1-NE 3.98Å; E693-R696 IonicContact OE1-NH1 2.92Å; E693-R696 PolarHBondContact OE1-NH1 3Å; E693-R696 WeakPolarHBondContact OE2-CD 3.46Å; E693-R696 IonicContact OE2-NH1 4Å; R696-R698 VanDerWaalsContact C-N 3.33Å; R696-A699 CarbonylContact O-C 3.54Å; R696-A699 WeakPolarHBondContact O-CB 3.38Å; R696-A699 PolarHBondContact O-N 3.35Å; R696-L700 HydrophobicContact CG-CD1 3.99Å; R696-L700 HydrophobicContact CG-CG 4.41Å; R696-L700 VanDerWaalsContact O-CB 3.28Å; R696-L700 WeakPolarHBondContact O-CB 3.46Å; R696-L700 VanDerWaalsContact O-CG 3.22Å; R696-L700 WeakPolarHBondContact O-CG 3.41Å; R696-L700 PolarHBondContact O-N 3.48Å
697C65.1Low67.5Low52 Ų52113.3 Ų113.335%0.35154%0.538SS..Hα-helixtrans-66-36.6171.2-75.40000110E693 A699 L700 E701E693-C697 WeakPolarHBondContact O-CA 3.41Å; E693-C697 WeakPolarHBondContact O-CB 3.33Å; E693-C697 PolarHBondContact O-N 2.97Å; E693-C697 PolarHBondContact O-SG 3.49Å; C697-A699 VanDerWaalsContact C-N 3.34Å; C697-A699 PolarHBondContact O-N 2.87Å; C697-L700 CarbonylContact O-C 3.6Å; C697-L700 PolarHBondContact O-N 3.39Å; C697-E701 WeakPolarHBondContact O-CA 3.43Å; C697-E701 WeakPolarHBondContact O-CB 3.46Å; C697-E701 WeakPolarHBondContact O-CG 3.27Å; C697-E701 PolarHBondContact O-N 3Å
698R73.4Confident65.5Low159 Ų159116.5 Ų116.560%0.656%0.555SS**Hα-helixtrans-60.4-43.9168.9-112179.9175175.6-5.4112.1R694 T695 R696 E701 E702R694-R698 WeakPolarHBondContact O-CB 3.47Å; R694-R698 PolarHBondContact O-N 3.45Å; T695-R698 WeakPolarHBondContact O-CB 3.39Å; T695-R698 PolarHBondContact O-N 3.39Å; R696-R698 VanDerWaalsContact C-N 3.33Å; R698-E701 PolarHBondContact O-N 3.31Å; R698-E702 WeakPolarHBondContact O-CB 3.44Å; R698-E702 WeakPolarHBondContact O-CG 3.49Å; R698-E702 PolarHBondContact O-N 3.17Å
699A63Low63.4Low47 Ų47115.1 Ų115.139%0.38856%0.561SS.*Hα-helixtrans-66.7-38.317600000112.2T695 R696 C697 E702 E703T695-A699 PolarHBondContact O-N 3.34Å; R696-A699 CarbonylContact O-C 3.54Å; R696-A699 WeakPolarHBondContact O-CB 3.38Å; R696-A699 PolarHBondContact O-N 3.35Å; C697-A699 VanDerWaalsContact C-N 3.34Å; C697-A699 PolarHBondContact O-N 2.87Å; A699-E702 PolarHBondContact O-N 2.85Å; A699-E703 WeakPolarHBondContact O-CG 3.43Å; A699-E703 PolarHBondContact O-N 2.87Å
700L55.8Low61.1Low69 Ų69117.3 Ų117.336%0.36158%0.579SS.*Hα-helixtrans-77.3-24.9176.5-71168.6000112R696 C697 E703 L704R696-L700 HydrophobicContact CG-CD1 3.99Å; R696-L700 HydrophobicContact CG-CG 4.41Å; R696-L700 VanDerWaalsContact O-CB 3.28Å; R696-L700 WeakPolarHBondContact O-CB 3.46Å; R696-L700 VanDerWaalsContact O-CG 3.22Å; R696-L700 WeakPolarHBondContact O-CG 3.41Å; R696-L700 PolarHBondContact O-N 3.48Å; C697-L700 CarbonylContact O-C 3.6Å; C697-L700 PolarHBondContact O-N 3.39Å; L700-E703 WeakPolarHBondContact CD2-OE2 3.37Å; L700-E703 CarbonylContact O-C 3.48Å; L700-E703 PolarHBondContact O-N 2.87Å; L700-L704 WeakPolarHBondContact O-CA 3.43Å; L700-L704 WeakPolarHBondContact O-CB 3.5Å; L700-L704 WeakPolarHBondContact O-CD1 3.43Å; L700-L704 WeakPolarHBondContact O-CG 3.41Å; L700-L704 PolarHBondContact O-N 3.36Å
701E55Low58.9Low119 Ų119119.5 Ų119.556%0.55659%0.591SS**Hα-helixtrans-74.1-38.2171-81.2169.8177.800109.2C697 R698 E703 L704 E705C697-E701 WeakPolarHBondContact O-CA 3.43Å; C697-E701 WeakPolarHBondContact O-CB 3.46Å; C697-E701 WeakPolarHBondContact O-CG 3.27Å; C697-E701 PolarHBondContact O-N 3Å; R698-E701 PolarHBondContact O-N 3.31Å; E701-E703 VanDerWaalsContact C-N 3.33Å; E701-L704 CarbonylContact O-C 3.56Å; E701-L704 PolarHBondContact O-N 3.46Å; E701-E705 WeakPolarHBondContact O-CB 3.49Å; E701-E705 PolarHBondContact O-N 3.34Å
702E61.3Low56.8Low136 Ų136126.3 Ų126.364%0.63661%0.609SS**Hα-helixtrans-64.5-35.6166.4-77.4175.7173.600111.7R698 A699R698-E702 WeakPolarHBondContact O-CB 3.44Å; R698-E702 WeakPolarHBondContact O-CG 3.49Å; R698-E702 PolarHBondContact O-N 3.17Å; A699-E702 PolarHBondContact O-N 2.85Å
703E52.4Low54.6Low136 Ų136133.5 Ų133.564%0.63663%0.633SS**Hα-helixtrans-76.9-22170.6-72.3-175.8166.700113.5A699 L700 E701 N706A699-E703 WeakPolarHBondContact O-CG 3.43Å; A699-E703 PolarHBondContact O-N 2.87Å; L700-E703 WeakPolarHBondContact CD2-OE2 3.37Å; L700-E703 CarbonylContact O-C 3.48Å; L700-E703 PolarHBondContact O-N 2.87Å; E701-E703 VanDerWaalsContact C-N 3.33Å; E703-N706 CarbonylContact O-C 3.58Å; E703-N706 PolarHBondContact O-N 3.4Å
704L48.6Very low53.1Low119 Ų119141.3 Ų141.362%0.62366%0.659SS**Hα-helixtrans-89-19.4175-79.3163.4000112.4L700 E701 N706 P707L700-L704 WeakPolarHBondContact O-CA 3.43Å; L700-L704 WeakPolarHBondContact O-CB 3.5Å; L700-L704 WeakPolarHBondContact O-CD1 3.43Å; L700-L704 WeakPolarHBondContact O-CG 3.41Å; L700-L704 PolarHBondContact O-N 3.36Å; E701-L704 CarbonylContact O-C 3.56Å; E701-L704 PolarHBondContact O-N 3.46Å; L704-N706 PolarHBondContact O-N 3.16Å; L704-P707 HydrophobicContact CD2-CB 4.34Å; L704-P707 WeakPolarHBondContact O-CB 3.21Å; L704-P707 WeakPolarHBondContact O-CD 3.32Å; L704-P707 VanDerWaalsContact O-CG 3.28Å; L704-P707 WeakPolarHBondContact O-CG 3.46Å
705E52Low51.2Low164 Ų164144.1 Ų144.177%0.76668%0.675SS**SBendtrans-66.1-20.5162.9-87.4-171.7162.300110.9E701E701-E705 WeakPolarHBondContact O-CB 3.49Å; E701-E705 PolarHBondContact O-N 3.34Å
706N44.5Very low49.4Very low135 Ų135148.1 Ų148.172%0.72269%0.692SS**SBendtrans-123.768.6166.1-78.9-43.4000112.2E703 L704 M708E703-N706 CarbonylContact O-C 3.58Å; E703-N706 PolarHBondContact O-N 3.4Å; L704-N706 PolarHBondContact O-N 3.16Å; N706-M708 PolarHBondContact O-N 3.37Å; N706-M708 VanDerWaalsContact O-N 3.11Å
707P37.7Very low47.6Very low81 Ų81150.6 Ų150.653%0.52671%0.71SS.*  trans-80.6102-165.131.1-29.1000111.4L704 N709L704-P707 HydrophobicContact CD2-CB 4.34Å; L704-P707 WeakPolarHBondContact O-CB 3.21Å; L704-P707 WeakPolarHBondContact O-CD 3.32Å; L704-P707 VanDerWaalsContact O-CG 3.28Å; L704-P707 WeakPolarHBondContact O-CG 3.46Å; P707-N709 PolarHBondContact O-N 2.91Å
708M41.9Very low46.5Very low170 Ų170152.6 Ų152.684%0.83773%0.731SS**  trans-96.663.2173.7-161.1171.274.600111.1N706N706-M708 PolarHBondContact O-N 3.37Å; N706-M708 VanDerWaalsContact O-N 3.11Å
709N39.3Very low45.1Very low155 Ų155151.1 Ų151.183%0.82975%0.745SS**  trans159105.3146.8-84.3-42.5000112.7P707P707-N709 PolarHBondContact O-N 2.91Å
710V37.3Very low44.8Very low115 Ų115156.1 Ų156.170%0.69777%0.765SS**  trans-84.7121172.4-178.60000108.2
711H33.6Very low44.7Very low174 Ų174156.9 Ų156.981%0.80677%0.774SS**  trans146.7107.3151.3-74.5-48.8000112.5
712R40.4Very low45Very low244 Ų244154.3 Ų154.392%0.92177%0.769SS**  trans-172.591.3151.1-105.3162-173.5-102.41.2109
713W36.7Very low45.5Very low271 Ų271153 Ų153100%1.02777%0.771SS**  trans-156142.3149.3-87.3-0.7000108.7
714R44.4Very low46.5Very low242 Ų242152.8 Ų152.891%0.91377%0.768SS**  trans-136.9134.5-179.9171.8-178.8-83.8166.3-5.9108.4
715K39.7Very low47.8Very low199 Ų199152.7 Ų152.787%0.86576%0.764SS**  trans-73.1136.9175.9-95.5173.9169.2177.40111.2
716L40.4Very low48.9Very low178 Ų178149.9 Ų149.993%0.93275%0.754SS**  trans-99.3127.1172.5-87.4149.2000109.1
717E38Very low50.6Low197 Ų197147.4 Ų147.492%0.92174%0.74SS**  trans-100.599.4-178.2-66.2-178.716800110.3
718A42.1Very low52.7Low95 Ų95148.6 Ų148.679%0.78574%0.738SS**  trans-163.7119.2156.200000108.4
719S43.1Very low54.6Low128 Ų128147.7 Ų147.790%0.89573%0.73SS**  trans-92.9113.5-179.4-66.90000110.4
720D56.5Low56.5Low152 Ų152144.1 Ų144.181%0.81371%0.71SS**PPolyproline II helixtrans-61.1137.5169.1-78.4-39.8000110.8S722D720-S722 PolarHBondContact O-N 3Å
721P54.5Low58.8Low85 Ų85143.6 Ų143.655%0.55270%0.7SS**PPolyproline II helixtrans-57.2131.4174.3-17.227.9000109.9
722S61.4Low61.2Low64 Ų64139.7 Ų139.745%0.44869%0.688SS.*PPolyproline II helixtrans-58.6143.6-172.573.60000111.3D720 F724 E725D720-S722 PolarHBondContact O-N 3Å; S722-F724 PolarHBondContact O-N 2.97Å; S722-E725 PolarHBondContact O-N 3.14Å
723T70.1Confident63.4Low110 Ų110133.3 Ų133.368%0.67567%0.671SS**Hα-helixtrans-47.4-30179.4-33.50000112.7L726 I727T723-L726 PolarHBondContact O-N 3.2Å; T723-I727 HydrophobicContact CG2-CD1 4.15Å; T723-I727 WeakPolarHBondContact O-CD1 3.48Å; T723-I727 WeakPolarHBondContact O-CG1 3.49Å; T723-I727 PolarHBondContact O-N 3.1Å
724F75.3Confident65.5Low131 Ų131125.4 Ų125.458%0.57565%0.646SS**Hα-helixtrans-65.1-41.7177.2-173.5-103.9000113.9S722 L726 I727 Q728S722-F724 PolarHBondContact O-N 2.97Å; F724-L726 VanDerWaalsContact C-N 3.35Å; F724-I727 PolarHBondContact O-N 2.79Å; F724-Q728 HydrophobicContact CD1-CG 4.45Å; F724-Q728 HydrophobicContact CE1-CG 4.07Å; F724-Q728 HydrophobicContact CZ-CG 4.2Å; F724-Q728 PolarHBondContact O-N 2.85Å
725E75.7Confident67.5Low117 Ų117121.6 Ų121.655%0.54764%0.636SS.*Hα-helixtrans-66.2-39.1177.1-68.1-176.4170.500111.3S722 Q728 K729S722-E725 PolarHBondContact O-N 3.14Å; E725-Q728 PolarHBondContact O-N 3.31Å; E725-K729 WeakPolarHBondContact O-CB 3.35Å; E725-K729 PolarHBondContact O-N 3.01Å
726L74.7Confident69.7Low104 Ų104121.3 Ų121.355%0.54563%0.629SS.*Hα-helixtrans-62.2-45.8174.1-121.188.1000111.2T723 F724 K729 I730T723-L726 PolarHBondContact O-N 3.2Å; F724-L726 VanDerWaalsContact C-N 3.35Å; L726-K729 PolarHBondContact O-N 3.06Å; L726-I730 VanDerWaalsContact O-CG1 3.28Å; L726-I730 WeakPolarHBondContact O-CG1 3.45Å; L726-I730 PolarHBondContact O-N 3.09Å
727I79.4Confident71.9Confident84 Ų84118.5 Ų118.543%0.43162%0.615SS.*Hα-helixtrans-64.2-42.4179.3-69.7165000111.1T723 F724 K729 I730 H731T723-I727 HydrophobicContact CG2-CD1 4.15Å; T723-I727 WeakPolarHBondContact O-CD1 3.48Å; T723-I727 WeakPolarHBondContact O-CG1 3.49Å; T723-I727 PolarHBondContact O-N 3.1Å; F724-I727 PolarHBondContact O-N 2.79Å; I727-K729 VanDerWaalsContact C-N 3.33Å; I727-K729 PolarHBondContact O-N 3.09Å; I727-I730 PolarHBondContact O-N 3.33Å; I727-H731 WeakPolarHBondContact O-CB 3.36Å; I727-H731 PolarHBondContact O-N 3.26Å; I727-H731 PolarHBondContact O-ND1 2.78Å
728Q82.7Confident74.3Confident105 Ų105113.9 Ų113.949%0.49160%0.595SS.*Hα-helixtrans-60.1-44.3174.7-83.3-167.6-15.700111.1F724 E725 I730 H731 T732F724-Q728 HydrophobicContact CD1-CG 4.45Å; F724-Q728 HydrophobicContact CE1-CG 4.07Å; F724-Q728 HydrophobicContact CZ-CG 4.2Å; F724-Q728 PolarHBondContact O-N 2.85Å; E725-Q728 PolarHBondContact O-N 3.31Å; Q728-I730 PolarHBondContact O-N 2.88Å; Q728-H731 PolarHBondContact O-N 3.43Å; Q728-T732 WeakPolarHBondContact O-CB 3.33Å; Q728-T732 PolarHBondContact O-N 2.99Å; Q728-T732 PolarHBondContact O-OG1 3.35Å
729K80.9Confident76.5Confident151 Ų151112.5 Ų112.566%0.65758%0.58SS**Hα-helixtrans-65.3-40.5179.6-156.5161.6-173.2176.50111.7E725 L726 I727 T732 L733E725-K729 WeakPolarHBondContact O-CB 3.35Å; E725-K729 PolarHBondContact O-N 3.01Å; L726-K729 PolarHBondContact O-N 3.06Å; I727-K729 VanDerWaalsContact C-N 3.33Å; I727-K729 PolarHBondContact O-N 3.09Å; K729-T732 PolarHBondContact O-N 3.39Å; K729-L733 WeakPolarHBondContact O-CB 3.5Å; K729-L733 WeakPolarHBondContact O-CG 3.49Å; K729-L733 PolarHBondContact O-N 3.17Å
730I80.3Confident78.7Confident80 Ų80112.1 Ų112.141%0.4156%0.562SS.*Hα-helixtrans-61-49.2173.5-69.8166.7000110.9L726 I727 Q728 T732 L733 Q734L726-I730 VanDerWaalsContact O-CG1 3.28Å; L726-I730 WeakPolarHBondContact O-CG1 3.45Å; L726-I730 PolarHBondContact O-N 3.09Å; I727-I730 PolarHBondContact O-N 3.33Å; Q728-I730 PolarHBondContact O-N 2.88Å; I730-T732 VanDerWaalsContact C-N 3.32Å; I730-T732 PolarHBondContact O-N 3.07Å; I730-L733 PolarHBondContact O-N 3.23Å; I730-Q734 HydrophobicContact CG2-CG 4.35Å; I730-Q734 WeakPolarHBondContact O-CB 3.33Å; I730-Q734 WeakPolarHBondContact O-CG 3.28Å; I730-Q734 PolarHBondContact O-N 3.5Å
731H84.5Confident80.3Confident105 Ų105108.6 Ų108.649%0.48655%0.547SS..Hα-helixtrans-61.9-40.2179.5-92.770000112.4I727 Q728 Q734 K735I727-H731 WeakPolarHBondContact O-CB 3.36Å; I727-H731 PolarHBondContact O-N 3.26Å; I727-H731 PolarHBondContact O-ND1 2.78Å; Q728-H731 PolarHBondContact O-N 3.43Å; H731-Q734 PolarHBondContact O-N 3.43Å; H731-K735 PolarHBondContact O-N 2.96Å
732T84.7Confident81.9Confident91 Ų91110.1 Ų110.156%0.55855%0.546SS*.Hα-helixtrans-65.8-42.9179.3-46.60000110.9Q728 K729 I730 R736Q728-T732 WeakPolarHBondContact O-CB 3.33Å; Q728-T732 PolarHBondContact O-N 2.99Å; Q728-T732 PolarHBondContact O-OG1 3.35Å; K729-T732 PolarHBondContact O-N 3.39Å; I730-T732 VanDerWaalsContact C-N 3.32Å; I730-T732 PolarHBondContact O-N 3.07Å; T732-R736 PolarHBondContact O-N 3.24Å
733L85.6Confident83.2Confident110 Ų110110.7 Ų110.758%0.57654%0.542SS*.Hα-helixtrans-67.6-40.8176.6-73171.1000112.3K729 I730 R736 L737K729-L733 WeakPolarHBondContact O-CB 3.5Å; K729-L733 WeakPolarHBondContact O-CG 3.49Å; K729-L733 PolarHBondContact O-N 3.17Å; I730-L733 PolarHBondContact O-N 3.23Å; L733-R736 PolarHBondContact O-N 2.67Å; L733-L737 WeakPolarHBondContact O-CB 3.45Å; L733-L737 PolarHBondContact O-N 3.27Å
734Q81.7Confident84.1Confident106 Ų106109.3 Ų109.350%0.49553%0.533SS..Hα-helixtrans-62.9-45.4177-78.6178.5-27.100112.1I730 H731 R736 L737 I738I730-Q734 HydrophobicContact CG2-CG 4.35Å; I730-Q734 WeakPolarHBondContact O-CB 3.33Å; I730-Q734 WeakPolarHBondContact O-CG 3.28Å; I730-Q734 PolarHBondContact O-N 3.5Å; H731-Q734 PolarHBondContact O-N 3.43Å; Q734-R736 VanDerWaalsContact C-N 3.29Å; Q734-R736 PolarHBondContact O-N 3.26Å; Q734-L737 PolarHBondContact O-N 3.47Å; Q734-I738 WeakPolarHBondContact O-CG1 3.49Å; Q734-I738 PolarHBondContact O-N 3.01Å
735K85.8Confident84.9Confident161 Ų161106.8 Ų106.870%0.753%0.528SS*.Hα-helixtrans-59.3-41174.9-80.1-174.4175.5-177.60112.1H731 S739H731-K735 PolarHBondContact O-N 2.96Å; K735-S739 WeakPolarHBondContact O-CB 3.41Å; K735-S739 PolarHBondContact O-N 3.45Å; K735-S739 VanDerWaalsContact O-N 3.1Å
736R87.2Confident85.5Confident193 Ų193108 Ų10873%0.72853%0.534SS*.Hα-helixtrans-66.5-38.8177.9-137.2176-164.2175.64.8112.1T732 L733 Q734 K740T732-R736 PolarHBondContact O-N 3.24Å; L733-R736 PolarHBondContact O-N 2.67Å; Q734-R736 VanDerWaalsContact C-N 3.29Å; Q734-R736 PolarHBondContact O-N 3.26Å; R736-K740 WeakPolarHBondContact O-CB 3.36Å; R736-K740 PolarHBondContact O-N 2.85Å; R736-K740 VanDerWaalsContact O-N 3.09Å
737L85.5Confident86.2Confident120 Ų120109.8 Ų109.863%0.62854%0.537SS*.Hα-helixtrans-66.7-46.9177.7-169.672.1000111.4L733 Q734 K740 T741L733-L737 WeakPolarHBondContact O-CB 3.45Å; L733-L737 PolarHBondContact O-N 3.27Å; Q734-L737 PolarHBondContact O-N 3.47Å; L737-K740 PolarHBondContact O-N 3.04Å; L737-T741 PolarHBondContact O-N 3.12Å; L737-T741 PolarHBondContact O-OG1 3.11Å
738I88.3Confident86.6Confident99 Ų99111.4 Ų111.451%0.50854%0.543SS..Hα-helixtrans-60.5-50.4178.8-66.9166000110.3Q734 K740 T741 E742Q734-I738 WeakPolarHBondContact O-CG1 3.49Å; Q734-I738 PolarHBondContact O-N 3.01Å; I738-K740 VanDerWaalsContact C-N 3.31Å; I738-K740 PolarHBondContact O-N 3.28Å; I738-T741 WeakPolarHBondContact O-CA 3.48Å; I738-T741 WeakPolarHBondContact O-CB 3.42Å; I738-T741 PolarHBondContact O-N 3.35Å; I738-E742 PolarHBondContact O-N 3.42Å
739S89.2Confident86.9Confident67 Ų67111 Ų11147%0.46954%0.544SS..Hα-helixtrans-57.9-411781700000112.6K735 T741 E743K735-S739 WeakPolarHBondContact O-CB 3.41Å; K735-S739 PolarHBondContact O-N 3.45Å; K735-S739 VanDerWaalsContact O-N 3.1Å; S739-T741 VanDerWaalsContact C-N 3.33Å; S739-E743 PolarHBondContact O-N 3.4Å; S739-E743 VanDerWaalsContact O-N 3.15Å
740K89.5Confident87.2Confident119 Ų119108.8 Ų108.852%0.51754%0.538SS..Hα-helixtrans-70.4-29175.6-85.5-70.7172.2-160.10113.5R736 L737 I738 E743 V744R736-K740 WeakPolarHBondContact O-CB 3.36Å; R736-K740 PolarHBondContact O-N 2.85Å; R736-K740 VanDerWaalsContact O-N 3.09Å; L737-K740 PolarHBondContact O-N 3.04Å; I738-K740 VanDerWaalsContact C-N 3.31Å; I738-K740 PolarHBondContact O-N 3.28Å; K740-E743 WeakPolarHBondContact CD-OE2 3.48Å; K740-E743 WeakPolarHBondContact CE-OE2 3.37Å; K740-E743 IonicContact NZ-OE1 2.69Å; K740-E743 IonicContact NZ-OE2 2.68Å; K740-E743 PolarHBondContact NZ-OE2 2.89Å; K740-V744 VanDerWaalsContact O-CG2 3.27Å; K740-V744 WeakPolarHBondContact O-CG2 3.48Å; K740-V744 PolarHBondContact O-N 3.45Å
741T88.6Confident87.6Confident79 Ų79110 Ų11049%0.48555%0.545SS..Hα-helixtrans-72.1-41.8176.8-45.80000110.4L737 I738 S739 V744 V745L737-T741 PolarHBondContact O-N 3.12Å; L737-T741 PolarHBondContact O-OG1 3.11Å; I738-T741 WeakPolarHBondContact O-CA 3.48Å; I738-T741 WeakPolarHBondContact O-CB 3.42Å; I738-T741 PolarHBondContact O-N 3.35Å; S739-T741 VanDerWaalsContact C-N 3.33Å; T741-V744 PolarHBondContact O-N 2.85Å; T741-V745 WeakPolarHBondContact O-CG2 3.28Å; T741-V745 PolarHBondContact O-N 3.4Å; T741-V745 VanDerWaalsContact O-N 3.07Å
742E88.7Confident87.8Confident116 Ų116111 Ų11154%0.54255%0.55SS.*Hα-helixtrans-60.4-45.4174.4-71.1170.7169.200111.8I738 V744 V745 E746I738-E742 PolarHBondContact O-N 3.42Å; E742-V744 VanDerWaalsContact C-N 3.27Å; E742-V744 PolarHBondContact O-N 2.84Å; E742-V745 PolarHBondContact O-N 3.43Å; E742-V745 VanDerWaalsContact O-N 3.17Å; E742-E746 PolarHBondContact O-N 3.01Å
743E88.4Confident88Confident77 Ų77112.3 Ų112.336%0.3655%0.55SS..Hα-helixtrans-63.3-32178.8-156-173.5175.300112.7S739 K740 K747S739-E743 PolarHBondContact O-N 3.4Å; S739-E743 VanDerWaalsContact O-N 3.15Å; K740-E743 WeakPolarHBondContact CD-OE2 3.48Å; K740-E743 WeakPolarHBondContact CE-OE2 3.37Å; K740-E743 IonicContact NZ-OE1 2.69Å; K740-E743 IonicContact NZ-OE2 2.68Å; K740-E743 PolarHBondContact NZ-OE2 2.89Å; E743-K747 WeakPolarHBondContact O-CG 3.45Å; E743-K747 PolarHBondContact O-N 3.33Å
744V90Very high88.1Confident80 Ų80113.5 Ų113.549%0.48555%0.55SS.*Hα-helixtrans-71.4-43.8174.4169.30000110.9K740 T741 E742 E746 K747 E748K740-V744 VanDerWaalsContact O-CG2 3.27Å; K740-V744 WeakPolarHBondContact O-CG2 3.48Å; K740-V744 PolarHBondContact O-N 3.45Å; T741-V744 PolarHBondContact O-N 2.85Å; E742-V744 VanDerWaalsContact C-N 3.27Å; E742-V744 PolarHBondContact O-N 2.84Å; V744-E746 PolarHBondContact O-N 3.2Å; V744-K747 PolarHBondContact O-N 3.08Å; V744-E748 PolarHBondContact O-N 3.34Å
745V91Very high88.3Confident79 Ų79113.9 Ų113.948%0.47955%0.552SS.*Hα-helixtrans-62.2-44178.5172.50000111.2T741 E742 K747 E748 L749T741-V745 WeakPolarHBondContact O-CG2 3.28Å; T741-V745 PolarHBondContact O-N 3.4Å; T741-V745 VanDerWaalsContact O-N 3.07Å; E742-V745 PolarHBondContact O-N 3.43Å; E742-V745 VanDerWaalsContact O-N 3.17Å; V745-K747 VanDerWaalsContact C-N 3.32Å; V745-K747 PolarHBondContact O-N 3.04Å; V745-E748 PolarHBondContact O-N 2.98Å; V745-L749 PolarHBondContact O-N 3.5Å
746E89.3Confident88.4Confident142 Ų142113 Ų11366%0.66455%0.548SS*.Hα-helixtrans-61-40.7175.9-74.3-176.5171.400112.1E742 V744 L749 L750E742-E746 PolarHBondContact O-N 3.01Å; V744-E746 PolarHBondContact O-N 3.2Å; E746-L749 PolarHBondContact O-N 3.36Å; E746-L750 WeakPolarHBondContact O-CB 3.43Å; E746-L750 PolarHBondContact O-N 3.05Å
747K88.7Confident88.3Confident141 Ų141107.8 Ų107.861%0.61354%0.535SS*.Hα-helixtrans-68.1-37.7176.8-76.5-169.2-178.9-175.20113E743 V744 V745 L749 L750 L751E743-K747 WeakPolarHBondContact O-CG 3.45Å; E743-K747 PolarHBondContact O-N 3.33Å; V744-K747 PolarHBondContact O-N 3.08Å; V745-K747 VanDerWaalsContact C-N 3.32Å; V745-K747 PolarHBondContact O-N 3.04Å; K747-L749 VanDerWaalsContact C-N 3.35Å; K747-L750 PolarHBondContact O-N 2.83Å; K747-L751 WeakPolarHBondContact O-CB 3.42Å; K747-L751 PolarHBondContact O-N 3.43Å
748E88.1Confident88.4Confident119 Ų119109.5 Ų109.556%0.55653%0.534SS*.Hα-helixtrans-64-40.9173.8-77.7-172.5163.100111.6V744 V745 L751 Q752V744-E748 PolarHBondContact O-N 3.34Å; V745-E748 PolarHBondContact O-N 2.98Å; E748-L751 WeakPolarHBondContact O-CB 3.37Å; E748-L751 PolarHBondContact O-N 3.31Å; E748-Q752 WeakPolarHBondContact O-CG 3.25Å; E748-Q752 PolarHBondContact O-N 3.03Å
749L88.3Confident88.3Confident96 Ų96108.4 Ų108.450%0.50353%0.532SS..Hα-helixtrans-64.1-44.8177.6-143.4113.1000111.3V745 E746 K747 L751 Q752 E753V745-L749 PolarHBondContact O-N 3.5Å; E746-L749 PolarHBondContact O-N 3.36Å; K747-L749 VanDerWaalsContact C-N 3.35Å; L749-L751 VanDerWaalsContact C-N 3.28Å; L749-L751 PolarHBondContact O-N 3.36Å; L749-Q752 PolarHBondContact O-N 2.9Å; L749-E753 PolarHBondContact O-N 3.05Å
750L88.5Confident88.1Confident104 Ų104110 Ų11055%0.54553%0.532SS..Hα-helixtrans-62.4-36.6176.1-155.285000111.7E746 K747 K754E746-L750 WeakPolarHBondContact O-CB 3.43Å; E746-L750 PolarHBondContact O-N 3.05Å; K747-L750 PolarHBondContact O-N 2.83Å; L750-K754 WeakPolarHBondContact O-CB 3.37Å; L750-K754 VanDerWaalsContact O-CG 3.22Å; L750-K754 WeakPolarHBondContact O-CG 3.41Å; L750-K754 PolarHBondContact O-N 2.65Å
751L88.6Confident87.6Confident106 Ų106108.7 Ų108.756%0.55553%0.53SS*.Hα-helixtrans-65.5-45.9176.4-15787000111.1K747 E748 L749 E753 K754 E755K747-L751 WeakPolarHBondContact O-CB 3.42Å; K747-L751 PolarHBondContact O-N 3.43Å; E748-L751 WeakPolarHBondContact O-CB 3.37Å; E748-L751 PolarHBondContact O-N 3.31Å; L749-L751 VanDerWaalsContact C-N 3.28Å; L749-L751 PolarHBondContact O-N 3.36Å; L751-E753 VanDerWaalsContact C-N 3.35Å; L751-E753 PolarHBondContact O-N 3Å; L751-K754 PolarHBondContact O-N 2.94Å; L751-E755 WeakPolarHBondContact O-CG 3.28Å; L751-E755 PolarHBondContact O-N 3.29Å
752Q88.6Confident87.3Confident126 Ų126111.1 Ų111.159%0.58953%0.534SS*.Hα-helixtrans-61-42.1177.3-74.4-179.1100112.1E748 L749 E755 K756E748-Q752 WeakPolarHBondContact O-CG 3.25Å; E748-Q752 PolarHBondContact O-N 3.03Å; L749-Q752 PolarHBondContact O-N 2.9Å; Q752-E755 PolarHBondContact O-N 3.31Å; Q752-K756 WeakPolarHBondContact O-CB 3.43Å; Q752-K756 PolarHBondContact O-N 3.15Å
753E88.2Confident86.8Confident118 Ų118111.6 Ų111.655%0.55154%0.536SS*.Hα-helixtrans-62.5-42.1174.7-73-177.9169.400111.8L749 L751 K756 L757L749-E753 PolarHBondContact O-N 3.05Å; L751-E753 VanDerWaalsContact C-N 3.35Å; L751-E753 PolarHBondContact O-N 3Å; E753-K756 PolarHBondContact O-N 2.99Å; E753-L757 WeakPolarHBondContact O-CB 3.4Å; E753-L757 PolarHBondContact O-N 3.09Å
754K86.9Confident86.3Confident135 Ų135112.5 Ų112.559%0.58754%0.542SS*.Hα-helixtrans-67.6-38.7177.7-70.9-67.8177-170.70112.6L750 L751 Y758L750-K754 WeakPolarHBondContact O-CB 3.37Å; L750-K754 VanDerWaalsContact O-CG 3.22Å; L750-K754 WeakPolarHBondContact O-CG 3.41Å; L750-K754 PolarHBondContact O-N 2.65Å; L751-K754 PolarHBondContact O-N 2.94Å; K754-Y758 VanDerWaalsContact O-CB 3.32Å; K754-Y758 WeakPolarHBondContact O-CB 3.39Å; K754-Y758 PolarHBondContact O-N 3.46Å
755E87.4Confident85.5Confident115 Ų115114.2 Ų114.254%0.53755%0.548SS..Hα-helixtrans-65-43.9174.1-76.3-178.516600111.5L751 Q752 L757 Y758 V759L751-E755 WeakPolarHBondContact O-CG 3.28Å; L751-E755 PolarHBondContact O-N 3.29Å; Q752-E755 PolarHBondContact O-N 3.31Å; E755-L757 PolarHBondContact O-N 3.3Å; E755-Y758 WeakPolarHBondContact O-CB 3.43Å; E755-Y758 PolarHBondContact O-N 3.38Å; E755-V759 WeakPolarHBondContact O-CG2 3.34Å; E755-V759 PolarHBondContact O-N 2.85Å
756K87.5Confident84.7Confident141 Ų141114.8 Ų114.861%0.61356%0.561SS**Hα-helixtrans-61.6-46.3177.4-161178.5-177.4-176.10111.3Q752 E753 Y758 V759 E760Q752-K756 WeakPolarHBondContact O-CB 3.43Å; Q752-K756 PolarHBondContact O-N 3.15Å; E753-K756 PolarHBondContact O-N 2.99Å; K756-Y758 VanDerWaalsContact C-N 3.33Å; K756-Y758 PolarHBondContact O-N 2.93Å; K756-V759 PolarHBondContact O-N 3.31Å; K756-E760 WeakPolarHBondContact O-CG 3.46Å; K756-E760 PolarHBondContact O-N 3.16Å
757L85.4Confident84Confident85 Ų85118.6 Ų118.645%0.44557%0.569SS.*Hα-helixtrans-61.5-40.1175.5-16576.4000111.8E753 E755 E760 L761E753-L757 WeakPolarHBondContact O-CB 3.4Å; E753-L757 PolarHBondContact O-N 3.09Å; E755-L757 PolarHBondContact O-N 3.3Å; L757-E760 PolarHBondContact O-N 3.23Å; L757-L761 HydrophobicContact CD2-CD1 4.41Å; L757-L761 HydrophobicContact CG-CD1 4.06Å; L757-L761 WeakPolarHBondContact O-CB 3.35Å; L757-L761 PolarHBondContact O-N 3.4Å
758Y87.1Confident82.8Confident156 Ų156118 Ų11861%0.61257%0.568SS**Hα-helixtrans-63.2-43.6176.5177.5-94.4000112.1K754 E755 K756 L761 K762K754-Y758 VanDerWaalsContact O-CB 3.32Å; K754-Y758 WeakPolarHBondContact O-CB 3.39Å; K754-Y758 PolarHBondContact O-N 3.46Å; E755-Y758 WeakPolarHBondContact O-CB 3.43Å; E755-Y758 PolarHBondContact O-N 3.38Å; K756-Y758 VanDerWaalsContact C-N 3.33Å; K756-Y758 PolarHBondContact O-N 2.93Å; Y758-L761 PolarHBondContact O-N 2.96Å; Y758-K762 HydrophobicContact CE1-CD 4.38Å; Y758-K762 VanDerWaalsContact O-CB 3.31Å; Y758-K762 WeakPolarHBondContact O-CB 3.48Å; Y758-K762 PolarHBondContact O-N 3.37Å
759V86.8Confident81.8Confident76 Ų76117.3 Ų117.346%0.46157%0.574SS.*Hα-helixtrans-65.9-41.4177.7173.50000111.5E755 K756 K762 H763E755-V759 WeakPolarHBondContact O-CG2 3.34Å; E755-V759 PolarHBondContact O-N 2.85Å; K756-V759 PolarHBondContact O-N 3.31Å; V759-K762 PolarHBondContact O-N 2.85Å; V759-H763 PolarHBondContact O-N 3.49Å; V759-H763 PolarHBondContact O-ND1 3.39Å
760E83.9Confident81Confident100 Ų100114.5 Ų114.547%0.46757%0.569SS.*Hα-helixtrans-63.6-47.8175.5-73.7174.9-172.400111.4K756 L757 K762 H763 I764K756-E760 WeakPolarHBondContact O-CG 3.46Å; K756-E760 PolarHBondContact O-N 3.16Å; L757-E760 PolarHBondContact O-N 3.23Å; E760-K762 VanDerWaalsContact C-N 3.31Å; E760-K762 PolarHBondContact O-N 3Å; E760-H763 PolarHBondContact O-N 3.23Å; E760-I764 VanDerWaalsContact O-CG1 3.32Å; E760-I764 WeakPolarHBondContact O-CG1 3.47Å; E760-I764 PolarHBondContact O-N 3.49Å
761L80.5Confident80.3Confident92 Ų92114.6 Ų114.648%0.48258%0.576SS.*Hα-helixtrans-58.7-41.2174.3-87.8156.8000112L757 Y758 I764 L765L757-L761 HydrophobicContact CD2-CD1 4.41Å; L757-L761 HydrophobicContact CG-CD1 4.06Å; L757-L761 WeakPolarHBondContact O-CB 3.35Å; L757-L761 PolarHBondContact O-N 3.4Å; Y758-L761 PolarHBondContact O-N 2.96Å; L761-I764 PolarHBondContact O-N 3.14Å; L761-L765 WeakPolarHBondContact O-CB 3.25Å; L761-L765 PolarHBondContact O-N 3.5Å
762K81.1Confident79.7Confident130 Ų130116.6 Ų116.657%0.56558%0.582SS**Hα-helixtrans-63.8-39.9176.9-168.6178-177.5179.10112Y758 V759 E760 A766Y758-K762 HydrophobicContact CE1-CD 4.38Å; Y758-K762 VanDerWaalsContact O-CB 3.31Å; Y758-K762 WeakPolarHBondContact O-CB 3.48Å; Y758-K762 PolarHBondContact O-N 3.37Å; V759-K762 PolarHBondContact O-N 2.85Å; E760-K762 VanDerWaalsContact C-N 3.31Å; E760-K762 PolarHBondContact O-N 3Å; K762-A766 WeakPolarHBondContact O-CB 3.37Å; K762-A766 PolarHBondContact O-N 3.4Å
763H78.3Confident79.1Confident126 Ų126112.2 Ų112.258%0.58357%0.568SS**Hα-helixtrans-67.6-39.7175.1-8568.5000112.4V759 E760 A766 R767V759-H763 PolarHBondContact O-N 3.49Å; V759-H763 PolarHBondContact O-ND1 3.39Å; E760-H763 PolarHBondContact O-N 3.23Å; H763-A766 PolarHBondContact O-N 3.32Å; H763-R767 PolarHBondContact O-N 2.9Å
764I78.6Confident78.5Confident95 Ų95109.5 Ų109.549%0.48757%0.565SS.*Hα-helixtrans-64.9-46.6176.3-66.8166.2000110E760 L761 A766 R767 Q768E760-I764 VanDerWaalsContact O-CG1 3.32Å; E760-I764 WeakPolarHBondContact O-CG1 3.47Å; E760-I764 PolarHBondContact O-N 3.49Å; L761-I764 PolarHBondContact O-N 3.14Å; I764-A766 PolarHBondContact O-N 3.31Å; I764-R767 PolarHBondContact O-N 3.48Å; I764-R767 VanDerWaalsContact O-N 3.13Å; I764-Q768 PolarHBondContact O-N 2.81Å; I764-Q768 VanDerWaalsContact O-N 3.13Å
765L71.9Confident78.1Confident117 Ų117109.1 Ų109.161%0.61357%0.565SS**Hα-helixtrans-60.4-41.9176.3-93.2151.4000112.5L761 R767 Q768L761-L765 WeakPolarHBondContact O-CB 3.25Å; L761-L765 PolarHBondContact O-N 3.5Å; L765-R767 PolarHBondContact O-N 3.13Å; L765-Q768 PolarHBondContact O-N 3.43Å
766A74.7Confident77.8Confident90 Ų90108.7 Ų108.774%0.74456%0.564SS**Hα-helixtrans-65.2-2417700000113.4K762 H763 I764K762-A766 WeakPolarHBondContact O-CB 3.37Å; K762-A766 PolarHBondContact O-N 3.4Å; H763-A766 PolarHBondContact O-N 3.32Å; I764-A766 PolarHBondContact O-N 3.31Å
767R74.3Confident77.4Confident223 Ų223106.7 Ų106.784%0.84256%0.559SS**Hα-helixtrans-87.7-17.8175.5-94.8-177.5165.6150.3-2.5113.8H763 I764 L765H763-R767 PolarHBondContact O-N 2.9Å; I764-R767 PolarHBondContact O-N 3.48Å; I764-R767 VanDerWaalsContact O-N 3.13Å; L765-R767 PolarHBondContact O-N 3.13Å
768Q64.1Low77.3Confident127 Ų127109.7 Ų109.759%0.59357%0.571SS**SBendtrans-78.9130.2177.2-72.5-165.4-0.400109.5I764 L765 G770I764-Q768 PolarHBondContact O-N 2.81Å; I764-Q768 VanDerWaalsContact O-N 3.13Å; L765-Q768 PolarHBondContact O-N 3.43Å; Q768-G770 PolarHBondContact O-N 3.44Å
769P67.2Low77.3Confident105 Ų105107.1 Ų107.168%0.68257%0.567SS**PPolyproline II helixtrans-52.9130.3174.1-22.431.7000109.4A773P769-A773 HydrophobicContact CB-CB 3.49Å; P769-A773 VanDerWaalsContact CB-CB 3.49Å
770G71.5Confident77.3Confident38 Ų38111 Ų11139%0.39257%0.574SS.*PPolyproline II helixtrans-57.4164.6-176.100000112.8Q768 E772 A773 A774Q768-G770 PolarHBondContact O-N 3.44Å; G770-E772 PolarHBondContact O-N 3.14Å; G770-A773 WeakPolarHBondContact O-CB 3.33Å; G770-A773 PolarHBondContact O-N 3.41Å; G770-A774 PolarHBondContact O-N 3.1Å
771P74.6Confident77.3Confident106 Ų106114.3 Ų114.369%0.68858%0.582SS**Hα-helixtrans-51.8-31.2-179.917.9-29.8000113.2A773 A774 E775P771-A773 VanDerWaalsContact C-N 3.31Å; P771-A773 PolarHBondContact O-N 3.4Å; P771-A774 WeakPolarHBondContact O-CB 3.46Å; P771-A774 PolarHBondContact O-N 3.45Å; P771-A774 VanDerWaalsContact O-N 3.13Å; P771-E775 PolarHBondContact O-N 2.9Å
772E74.6Confident77.7Confident147 Ų147117.1 Ų117.169%0.68759%0.588SS**Hα-helixtrans-57.4-38.8172.5-63.7175.1174.300113.3G770 E775 Q776G770-E772 PolarHBondContact O-N 3.14Å; E772-E775 PolarHBondContact O-N 3.24Å; E772-Q776 WeakPolarHBondContact O-CB 3.46Å; E772-Q776 VanDerWaalsContact O-CG 3.32Å; E772-Q776 WeakPolarHBondContact O-CG 3.28Å; E772-Q776 PolarHBondContact O-N 3.01Å
773A75.4Confident78.1Confident35 Ų35114 Ų11429%0.28958%0.579SS.*Hα-helixtrans-69.8-36.4177.300000111.3P769 G770 P771 Q776 L777P769-A773 HydrophobicContact CB-CB 3.49Å; P769-A773 VanDerWaalsContact CB-CB 3.49Å; G770-A773 WeakPolarHBondContact O-CB 3.33Å; G770-A773 PolarHBondContact O-N 3.41Å; P771-A773 VanDerWaalsContact C-N 3.31Å; P771-A773 PolarHBondContact O-N 3.4Å; A773-Q776 PolarHBondContact O-N 3.23Å; A773-L777 WeakPolarHBondContact O-CB 3.45Å; A773-L777 PolarHBondContact O-N 3.35Å
774A75.9Confident78.5Confident61 Ų61113.8 Ų113.850%0.50458%0.582SS.*Hα-helixtrans-66.5-41.6174.100000111.5G770 P771 L777 Q778G770-A774 PolarHBondContact O-N 3.1Å; P771-A774 WeakPolarHBondContact O-CB 3.46Å; P771-A774 PolarHBondContact O-N 3.45Å; P771-A774 VanDerWaalsContact O-N 3.13Å; A774-L777 PolarHBondContact O-N 3.3Å; A774-Q778 WeakPolarHBondContact O-CB 3.49Å; A774-Q778 PolarHBondContact O-N 3.45Å
775E78.6Confident78.9Confident126 Ų126117.9 Ų117.959%0.58959%0.591SS**Hα-helixtrans-62.1-45.7173.2-74.3-177.3177.300111.8P771 E772 L777 Q778 I779P771-E775 PolarHBondContact O-N 2.9Å; E772-E775 PolarHBondContact O-N 3.24Å; E775-L777 VanDerWaalsContact C-N 3.33Å; E775-L777 PolarHBondContact O-N 3.5Å; E775-Q778 PolarHBondContact O-N 3.42Å; E775-I779 VanDerWaalsContact O-CG1 3.3Å; E775-I779 WeakPolarHBondContact O-CG1 3.45Å; E775-I779 PolarHBondContact O-N 3.3Å
776Q81.4Confident79.9Confident107 Ų107115 Ų11550%0.558%0.575SS.*Hα-helixtrans-60-42.5174.9-76.6-179.78.300112E772 A773 Q778 I779 Y780E772-Q776 WeakPolarHBondContact O-CB 3.46Å; E772-Q776 VanDerWaalsContact O-CG 3.32Å; E772-Q776 WeakPolarHBondContact O-CG 3.28Å; E772-Q776 PolarHBondContact O-N 3.01Å; A773-Q776 PolarHBondContact O-N 3.23Å; Q776-Q778 VanDerWaalsContact C-N 3.29Å; Q776-Q778 PolarHBondContact O-N 2.92Å; Q776-I779 PolarHBondContact O-N 3.37Å; Q776-Y780 HydrophobicContact CB-CD2 4.43Å; Q776-Y780 HydrophobicContact CB-CE2 4.18Å; Q776-Y780 WeakPolarHBondContact O-CB 3.36Å; Q776-Y780 WeakPolarHBondContact O-CD2 3.47Å; Q776-Y780 PolarHBondContact O-N 2.91Å
777L80.4Confident80.6Confident99 Ų99116.3 Ų116.352%0.51856%0.563SS.*Hα-helixtrans-65.9-35.3178.3-138.8153.7000111.4A773 A774 E775 R781A773-L777 WeakPolarHBondContact O-CB 3.45Å; A773-L777 PolarHBondContact O-N 3.35Å; A774-L777 PolarHBondContact O-N 3.3Å; E775-L777 VanDerWaalsContact C-N 3.33Å; E775-L777 PolarHBondContact O-N 3.5Å; L777-R781 HydrophobicContact CD2-CG 4.3Å; L777-R781 WeakPolarHBondContact O-CB 3.36Å; L777-R781 WeakPolarHBondContact O-CG 3.46Å; L777-R781 PolarHBondContact O-N 2.88Å
778Q82.9Confident81.2Confident147 Ų147109 Ų10969%0.68754%0.544SS*.Hα-helixtrans-68.9-41.8174.2-169.6163.8-12.400111.9A774 E775 Q776 R781 Y782A774-Q778 WeakPolarHBondContact O-CB 3.49Å; A774-Q778 PolarHBondContact O-N 3.45Å; E775-Q778 PolarHBondContact O-N 3.42Å; Q776-Q778 VanDerWaalsContact C-N 3.29Å; Q776-Q778 PolarHBondContact O-N 2.92Å; Q778-R781 PolarHBondContact O-N 2.68Å; Q778-Y782 WeakPolarHBondContact O-CB 3.37Å; Q778-Y782 PolarHBondContact O-N 3.22Å
779I86.7Confident82.4Confident103 Ų103108.9 Ų108.953%0.52854%0.541SS..Hα-helixtrans-59.8-51.4171.7-67.6165.1000109.6E775 Q776 R781 Y782 T783E775-I779 VanDerWaalsContact O-CG1 3.3Å; E775-I779 WeakPolarHBondContact O-CG1 3.45Å; E775-I779 PolarHBondContact O-N 3.3Å; Q776-I779 PolarHBondContact O-N 3.37Å; I779-R781 VanDerWaalsContact C-N 3.33Å; I779-R781 PolarHBondContact O-N 2.9Å; I779-Y782 CarbonylContact O-C 3.48Å; I779-Y782 WeakPolarHBondContact O-CA 3.37Å; I779-Y782 WeakPolarHBondContact O-CB 3.28Å; I779-Y782 PolarHBondContact O-N 3.1Å; I779-T783 PolarHBondContact O-N 2.95Å; I779-T783 PolarHBondContact O-OG1 3.17Å
780Y87.3Confident83.3Confident157 Ų157108.2 Ų108.262%0.61653%0.529SS*.Hα-helixtrans-60.3-40.6179.1-71.4-48000112.5Q776 Y782 T783 L784Q776-Y780 HydrophobicContact CB-CD2 4.43Å; Q776-Y780 HydrophobicContact CB-CE2 4.18Å; Q776-Y780 WeakPolarHBondContact O-CB 3.36Å; Q776-Y780 WeakPolarHBondContact O-CD2 3.47Å; Q776-Y780 PolarHBondContact O-N 2.91Å; Y780-Y782 VanDerWaalsContact C-N 3.33Å; Y780-Y782 PolarHBondContact O-N 2.9Å; Y780-T783 PolarHBondContact O-N 2.94Å; Y780-L784 WeakPolarHBondContact O-CB 3.23Å; Y780-L784 PolarHBondContact O-N 2.89Å
781R82.9Confident84Confident170 Ų170112 Ų11264%0.64254%0.539SS*.Hα-helixtrans-62.5-40.4173.9-82.5179.2168.7-174.2-1.5112.1L777 Q778 I779 R785L777-R781 HydrophobicContact CD2-CG 4.3Å; L777-R781 WeakPolarHBondContact O-CB 3.36Å; L777-R781 WeakPolarHBondContact O-CG 3.46Å; L777-R781 PolarHBondContact O-N 2.88Å; Q778-R781 PolarHBondContact O-N 2.68Å; I779-R781 VanDerWaalsContact C-N 3.33Å; I779-R781 PolarHBondContact O-N 2.9Å; R781-R785 WeakPolarHBondContact O-CG 3.32Å; R781-R785 PolarHBondContact O-N 3.32Å
782Y89.1Confident84.6Confident151 Ų151114.2 Ų114.259%0.59254%0.538SS*.Hα-helixtrans-65.7-49175.5179.7-97.3000111.2Q778 I779 Y780 L784 R785 E786Q778-Y782 WeakPolarHBondContact O-CB 3.37Å; Q778-Y782 PolarHBondContact O-N 3.22Å; I779-Y782 CarbonylContact O-C 3.48Å; I779-Y782 WeakPolarHBondContact O-CA 3.37Å; I779-Y782 WeakPolarHBondContact O-CB 3.28Å; I779-Y782 PolarHBondContact O-N 3.1Å; Y780-Y782 VanDerWaalsContact C-N 3.33Å; Y780-Y782 PolarHBondContact O-N 2.9Å; Y782-L784 VanDerWaalsContact C-N 3.32Å; Y782-L784 PolarHBondContact O-N 2.92Å; Y782-R785 WeakPolarHBondContact O-CB 3.19Å; Y782-R785 PolarHBondContact O-N 2.85Å; Y782-R785 VanDerWaalsContact O-N 3.15Å; Y782-E786 HydrophobicContact CD1-CG 4.41Å; Y782-E786 HydrophobicContact CE1-CG 3.93Å; Y782-E786 HydrophobicContact CE2-CG 4.38Å; Y782-E786 PolarHBondContact O-N 2.69Å
783T89.8Confident85.3Confident63 Ų63110.9 Ų110.939%0.38753%0.528SS..Hα-helixtrans-59.7-41.3176.9-45.80000111.6I779 Y780 E786 K787I779-T783 PolarHBondContact O-N 2.95Å; I779-T783 PolarHBondContact O-OG1 3.17Å; Y780-T783 PolarHBondContact O-N 2.94Å; T783-E786 PolarHBondContact O-N 3.29Å; T783-K787 HydrophobicContact CG2-CG 4.4Å; T783-K787 WeakPolarHBondContact O-CB 3.49Å; T783-K787 VanDerWaalsContact O-CG 3.25Å; T783-K787 WeakPolarHBondContact O-CG 3.3Å; T783-K787 PolarHBondContact O-N 3.08Å
784L85.9Confident85.8Confident122 Ų122114 Ų11464%0.63954%0.539SS*.Hα-helixtrans-65.2-39.3177.1-16485000111.7Y780 Y782 T788Y780-L784 WeakPolarHBondContact O-CB 3.23Å; Y780-L784 PolarHBondContact O-N 2.89Å; Y782-L784 VanDerWaalsContact C-N 3.32Å; Y782-L784 PolarHBondContact O-N 2.92Å; L784-T788 WeakPolarHBondContact O-CB 3.4Å; L784-T788 PolarHBondContact O-N 2.9Å; L784-T788 PolarHBondContact O-OG1 3.38Å
785R88.7Confident86.2Confident182 Ų182114.3 Ų114.369%0.68754%0.538SS*.Hα-helixtrans-64.2-44.9174.1-80.1178.1178.3170.6-0.3111.5R781 Y782 T788 K789R781-R785 WeakPolarHBondContact O-CG 3.32Å; R781-R785 PolarHBondContact O-N 3.32Å; Y782-R785 WeakPolarHBondContact O-CB 3.19Å; Y782-R785 PolarHBondContact O-N 2.85Å; Y782-R785 VanDerWaalsContact O-N 3.15Å; R785-T788 PolarHBondContact O-N 3.38Å; R785-K789 PolarHBondContact O-N 3.31Å
786E91.8Very high86.6Confident56 Ų56111.6 Ų111.626%0.26253%0.533SS..Hα-helixtrans-65.5-41.6177.2-73.7-57.912400111.8Y782 T783 T788 K789 Q790Y782-E786 HydrophobicContact CD1-CG 4.41Å; Y782-E786 HydrophobicContact CE1-CG 3.93Å; Y782-E786 HydrophobicContact CE2-CG 4.38Å; Y782-E786 PolarHBondContact O-N 2.69Å; T783-E786 PolarHBondContact O-N 3.29Å; E786-T788 PolarHBondContact O-N 2.87Å; E786-K789 WeakPolarHBondContact O-CB 3.49Å; E786-K789 PolarHBondContact O-N 3.05Å; E786-K789 IonicContact OE1-NZ 3.82Å; E786-K789 PolarHBondContact OE1-NZ 3.29Å; E786-Q790 WeakPolarHBondContact O-CG 3.38Å; E786-Q790 PolarHBondContact O-N 3.02Å
787K89.3Confident86.8Confident117 Ų117110.4 Ų110.451%0.50953%0.527SS..Hα-helixtrans-64.5-38.7174.5-71.8-72.1168-161.90112.5T783 Q790 L791T783-K787 HydrophobicContact CG2-CG 4.4Å; T783-K787 WeakPolarHBondContact O-CB 3.49Å; T783-K787 VanDerWaalsContact O-CG 3.25Å; T783-K787 WeakPolarHBondContact O-CG 3.3Å; T783-K787 PolarHBondContact O-N 3.08Å; K787-Q790 PolarHBondContact O-N 3.05Å; K787-L791 WeakPolarHBondContact O-CB 3.24Å; K787-L791 PolarHBondContact O-N 2.85Å
788T86.8Confident87.1Confident70 Ų70110.6 Ų110.643%0.42953%0.528SS..Hα-helixtrans-64.5-38.3173.8-54.50000111.8L784 R785 E786 K792L784-T788 WeakPolarHBondContact O-CB 3.4Å; L784-T788 PolarHBondContact O-N 2.9Å; L784-T788 PolarHBondContact O-OG1 3.38Å; R785-T788 PolarHBondContact O-N 3.38Å; E786-T788 PolarHBondContact O-N 2.87Å; T788-K792 PolarHBondContact O-N 3.46Å
789K89.2Confident87.3Confident124 Ų124108.2 Ų108.254%0.53952%0.52SS..Hα-helixtrans-64.5-46.3172.3-74.6178.2-173.4165.40111.6R785 E786 L791 K792 V793R785-K789 PolarHBondContact O-N 3.31Å; E786-K789 WeakPolarHBondContact O-CB 3.49Å; E786-K789 PolarHBondContact O-N 3.05Å; E786-K789 IonicContact OE1-NZ 3.82Å; E786-K789 PolarHBondContact OE1-NZ 3.29Å; K789-L791 VanDerWaalsContact C-N 3.3Å; K789-L791 PolarHBondContact O-N 3.28Å; K789-K792 WeakPolarHBondContact O-CB 3.27Å; K789-K792 PolarHBondContact O-N 3.18Å; K789-K792 VanDerWaalsContact O-N 3.12Å; K789-V793 WeakPolarHBondContact O-CG2 3.16Å; K789-V793 PolarHBondContact O-N 3.45Å
790Q87.3Confident87.3Confident92 Ų92107.5 Ų107.543%0.4352%0.516SS..Hα-helixtrans-57.8-43.3176.5-73.1175.9-0.800111.5E786 K787 K792 V793 L794E786-Q790 WeakPolarHBondContact O-CG 3.38Å; E786-Q790 PolarHBondContact O-N 3.02Å; K787-Q790 PolarHBondContact O-N 3.05Å; Q790-K792 PolarHBondContact O-N 2.89Å; Q790-V793 PolarHBondContact O-N 2.99Å; Q790-L794 WeakPolarHBondContact O-CB 3.19Å; Q790-L794 PolarHBondContact O-N 2.91Å
791L86.2Confident87.2Confident116 Ų116106.6 Ų106.661%0.60751%0.512SS*.Hα-helixtrans-62.9-38.4175.3-85.1162.5000112.8K787 K789 S795K787-L791 WeakPolarHBondContact O-CB 3.24Å; K787-L791 PolarHBondContact O-N 2.85Å; K789-L791 VanDerWaalsContact C-N 3.3Å; K789-L791 PolarHBondContact O-N 3.28Å; L791-S795 VanDerWaalsContact O-CB 3.29Å; L791-S795 WeakPolarHBondContact O-CB 3.45Å; L791-S795 PolarHBondContact O-N 2.83Å
792K87.4Confident87.3Confident153 Ų153103.6 Ų103.667%0.66551%0.505SS*.Hα-helixtrans-64.6-41.6174.2-77.8-175.4176.3-1730112.1T788 K789 Q790 S795 S796T788-K792 PolarHBondContact O-N 3.46Å; K789-K792 WeakPolarHBondContact O-CB 3.27Å; K789-K792 PolarHBondContact O-N 3.18Å; K789-K792 VanDerWaalsContact O-N 3.12Å; Q790-K792 PolarHBondContact O-N 2.89Å; K792-S795 PolarHBondContact O-N 3.5Å; K792-S796 PolarHBondContact O-N 2.91Å; K792-S796 PolarHBondContact O-OG 3.5Å
793V88.7Confident87.2Confident77 Ų7799.1 Ų99.147%0.46750%0.496SS..Hα-helixtrans-63.7-49.4175.8175.70000110.5K789 Q790 S795 S796 E797K789-V793 WeakPolarHBondContact O-CG2 3.16Å; K789-V793 PolarHBondContact O-N 3.45Å; Q790-V793 PolarHBondContact O-N 2.99Å; V793-S795 VanDerWaalsContact C-N 3.29Å; V793-S795 PolarHBondContact O-N 3.02Å; V793-S796 WeakPolarHBondContact CA-OG 3.41Å; V793-S796 CarbonylContact O-C 3.52Å; V793-S796 PolarHBondContact O-N 3.41Å; V793-S796 PolarHBondContact O-OG 3.17Å; V793-E797 HydrophobicContact CG1-CG 4.39Å; V793-E797 WeakPolarHBondContact O-CG 3.46Å; V793-E797 PolarHBondContact O-N 3.39Å
794L86.4Confident87Confident100 Ų10099.3 Ų99.352%0.52449%0.492SS..Hα-helixtrans-58.4-39.7175.9-83158.1000112.3Q790 E797 L798Q790-L794 WeakPolarHBondContact O-CB 3.19Å; Q790-L794 PolarHBondContact O-N 2.91Å; L794-E797 PolarHBondContact O-N 3.43Å; L794-L798 VanDerWaalsContact O-CB 3.3Å; L794-L798 WeakPolarHBondContact O-CB 3.18Å; L794-L798 PolarHBondContact O-N 2.9Å
795S84.5Confident87Confident68 Ų6896.5 Ų96.548%0.47648%0.483SS..Hα-helixtrans-65.8-37.9175.5-174.80000112.1L791 K792 V793 N799L791-S795 VanDerWaalsContact O-CB 3.29Å; L791-S795 WeakPolarHBondContact O-CB 3.45Å; L791-S795 PolarHBondContact O-N 2.83Å; K792-S795 PolarHBondContact O-N 3.5Å; V793-S795 VanDerWaalsContact C-N 3.29Å; V793-S795 PolarHBondContact O-N 3.02Å; S795-N799 PolarHBondContact O-N 3.25Å; S795-N799 VanDerWaalsContact O-N 3.11Å
796S85.8Confident86.9Confident69 Ų6994.1 Ų94.148%0.48348%0.48SS..Hα-helixtrans-70.5-36.7174.257.80000112.8K792 V793 N799 M800K792-S796 PolarHBondContact O-N 2.91Å; K792-S796 PolarHBondContact O-OG 3.5Å; V793-S796 WeakPolarHBondContact CA-OG 3.41Å; V793-S796 CarbonylContact O-C 3.52Å; V793-S796 PolarHBondContact O-N 3.41Å; V793-S796 PolarHBondContact O-OG 3.17Å; S796-N799 PolarHBondContact O-N 2.68Å; S796-M800 WeakPolarHBondContact O-CB 3.48Å; S796-M800 PolarHBondContact O-N 3.47Å
797E86Confident86.6Confident82 Ų8297.2 Ų97.238%0.38349%0.494SS..Hα-helixtrans-64.4-42.9173.4-73.3175179.100111V793 L794 N799 M800 Y801V793-E797 HydrophobicContact CG1-CG 4.39Å; V793-E797 WeakPolarHBondContact O-CG 3.46Å; V793-E797 PolarHBondContact O-N 3.39Å; L794-E797 PolarHBondContact O-N 3.43Å; E797-N799 PolarHBondContact O-N 2.91Å; E797-M800 WeakPolarHBondContact O-CB 3.44Å; E797-M800 PolarHBondContact O-N 3.34Å; E797-M800 VanDerWaalsContact O-N 3.15Å; E797-Y801 HydrophobicContact CB-CD2 4.46Å; E797-Y801 HydrophobicContact CB-CE2 4.26Å; E797-Y801 WeakPolarHBondContact O-CD2 3.23Å; E797-Y801 PolarHBondContact O-N 3.32Å
798L85.9Confident86.5Confident104 Ų10498.4 Ų98.455%0.54550%0.497SS..Hα-helixtrans-63.1-43178.3-162.3134.2000111.5L794 M800 Y801 E802L794-L798 VanDerWaalsContact O-CB 3.3Å; L794-L798 WeakPolarHBondContact O-CB 3.18Å; L794-L798 PolarHBondContact O-N 2.9Å; L798-M800 VanDerWaalsContact C-N 3.33Å; L798-M800 PolarHBondContact O-N 3.49Å; L798-Y801 PolarHBondContact O-N 3.36Å; L798-E802 PolarHBondContact O-N 3.33Å
799N87.9Confident86.5Confident97 Ų97102.2 Ų102.252%0.51951%0.507SS..Hα-helixtrans-62.8-38.5172.6-77.4-2.2000112.3S795 S796 E797 E802 S803S795-N799 PolarHBondContact O-N 3.25Å; S795-N799 VanDerWaalsContact O-N 3.11Å; S796-N799 PolarHBondContact O-N 2.68Å; E797-N799 PolarHBondContact O-N 2.91Å; N799-E802 PolarHBondContact O-N 2.87Å; N799-S803 PolarHBondContact O-N 3.44Å
800M87.3Confident86.3Confident88 Ų88104.2 Ų104.243%0.43351%0.512SS..Hα-helixtrans-63.6-44.5174.9-174.4-164.373.100111.2S796 E797 L798 S803 Q804S796-M800 WeakPolarHBondContact O-CB 3.48Å; S796-M800 PolarHBondContact O-N 3.47Å; E797-M800 WeakPolarHBondContact O-CB 3.44Å; E797-M800 PolarHBondContact O-N 3.34Å; E797-M800 VanDerWaalsContact O-N 3.15Å; L798-M800 VanDerWaalsContact C-N 3.33Å; L798-M800 PolarHBondContact O-N 3.49Å; M800-S803 WeakPolarHBondContact O-CB 3.32Å; M800-S803 PolarHBondContact O-N 3Å; M800-Q804 WeakPolarHBondContact O-CG 3.21Å; M800-Q804 PolarHBondContact O-N 3.03Å
801Y85Confident86.2Confident138 Ų138103.9 Ų103.954%0.54151%0.511SS..Hα-helixtrans-66.7-35.8176.8-73.3-59.2000112.7E797 L798 Q804 S805E797-Y801 HydrophobicContact CB-CD2 4.46Å; E797-Y801 HydrophobicContact CB-CE2 4.26Å; E797-Y801 WeakPolarHBondContact O-CD2 3.23Å; E797-Y801 PolarHBondContact O-N 3.32Å; L798-Y801 PolarHBondContact O-N 3.36Å; Y801-Q804 PolarHBondContact O-N 2.97Å; Y801-S805 VanDerWaalsContact O-CB 3.29Å; Y801-S805 WeakPolarHBondContact O-CB 3.4Å; Y801-S805 PolarHBondContact O-N 2.88Å
802E83.8Confident86.2Confident107 Ų107103.9 Ų103.950%0.551%0.511SS..Hα-helixtrans-63-43.9171.3-81.9-169.4155.200111.6L798 N799 S805 Q806L798-E802 PolarHBondContact O-N 3.33Å; N799-E802 PolarHBondContact O-N 2.87Å; E802-S805 PolarHBondContact O-N 3.21Å; E802-Q806 WeakPolarHBondContact O-CG 3.2Å; E802-Q806 PolarHBondContact O-N 3.04Å
803S87.6Confident86.1Confident56 Ų56102.7 Ų102.739%0.39251%0.507SS..Hα-helixtrans-61.5-46175.6-166.20000111.6N799 M800 S805 Q806 E807N799-S803 PolarHBondContact O-N 3.44Å; M800-S803 WeakPolarHBondContact O-CB 3.32Å; M800-S803 PolarHBondContact O-N 3Å; S803-S805 VanDerWaalsContact C-N 3.34Å; S803-S805 PolarHBondContact O-N 2.9Å; S803-Q806 WeakPolarHBondContact O-CB 3.29Å; S803-Q806 PolarHBondContact O-N 3.32Å; S803-E807 PolarHBondContact O-N 2.9Å
804Q86.5Confident86.1Confident67 Ų67104.1 Ų104.131%0.31350%0.504SS..Hα-helixtrans-62.2-40175.9-74.7179.2-8.200112.2M800 Y801 Q806 E807 Y808M800-Q804 WeakPolarHBondContact O-CG 3.21Å; M800-Q804 PolarHBondContact O-N 3.03Å; Y801-Q804 PolarHBondContact O-N 2.97Å; Q804-Q806 VanDerWaalsContact C-N 3.3Å; Q804-Q806 PolarHBondContact O-N 3.48Å; Q804-E807 PolarHBondContact O-N 3.45Å; Q804-Y808 HydrophobicContact CB-CE2 4.33Å; Q804-Y808 WeakPolarHBondContact O-CD2 3.28Å; Q804-Y808 PolarHBondContact O-N 2.88Å
805S84.7Confident86.2Confident64 Ų64103.7 Ų103.745%0.44850%0.502SS..Hα-helixtrans-63.5-37176-173.50000112.1Y801 E802 S803 K809Y801-S805 VanDerWaalsContact O-CB 3.29Å; Y801-S805 WeakPolarHBondContact O-CB 3.4Å; Y801-S805 PolarHBondContact O-N 2.88Å; E802-S805 PolarHBondContact O-N 3.21Å; S803-S805 VanDerWaalsContact C-N 3.34Å; S803-S805 PolarHBondContact O-N 2.9Å; S805-K809 WeakPolarHBondContact O-CB 3.47Å; S805-K809 PolarHBondContact O-N 3.41Å
806Q86.3Confident86.2Confident132 Ų132103.6 Ų103.662%0.61750%0.501SS*.Hα-helixtrans-68-42.9173.4-71.3175.916.800112E802 S803 Q804 K809 Y810E802-Q806 WeakPolarHBondContact O-CG 3.2Å; E802-Q806 PolarHBondContact O-N 3.04Å; S803-Q806 WeakPolarHBondContact O-CB 3.29Å; S803-Q806 PolarHBondContact O-N 3.32Å; Q804-Q806 VanDerWaalsContact C-N 3.3Å; Q804-Q806 PolarHBondContact O-N 3.48Å; Q806-K809 WeakPolarHBondContact O-CB 3.42Å; Q806-K809 PolarHBondContact O-N 3.41Å; Q806-Y810 PolarHBondContact O-N 3.14Å
807E86.1Confident86.2Confident121 Ų121105 Ų10557%0.56550%0.504SS*.Hα-helixtrans-60.2-46.2173.7-73.9177.7-175.400111.5S803 Q804 K809 Y810 E811S803-E807 PolarHBondContact O-N 2.9Å; Q804-E807 PolarHBondContact O-N 3.45Å; E807-K809 VanDerWaalsContact C-N 3.34Å; E807-K809 PolarHBondContact O-N 2.84Å; E807-Y810 PolarHBondContact O-N 3.34Å; E807-E811 WeakPolarHBondContact O-CB 3.39Å; E807-E811 PolarHBondContact O-N 3.1Å
808Y88Confident86.2Confident142 Ų142105 Ų10556%0.55750%0.504SS*.Hα-helixtrans-63.1-38.5175.9-70-41.5000112.7Q804 E811 I812Q804-Y808 HydrophobicContact CB-CE2 4.33Å; Q804-Y808 WeakPolarHBondContact O-CD2 3.28Å; Q804-Y808 PolarHBondContact O-N 2.88Å; Y808-E811 PolarHBondContact O-N 3.39Å; Y808-I812 WeakPolarHBondContact O-CB 2.99Å; Y808-I812 WeakPolarHBondContact O-CD1 3.34Å; Y808-I812 WeakPolarHBondContact O-CG1 3.48Å; Y808-I812 PolarHBondContact O-N 3.17Å
809K85Confident86.1Confident150 Ų150105 Ų10565%0.65250%0.503SS*.Hα-helixtrans-59.8-47.7172.6-90.6-177.61751780111.5S805 Q806 E807 E811 I812 E813S805-K809 WeakPolarHBondContact O-CB 3.47Å; S805-K809 PolarHBondContact O-N 3.41Å; Q806-K809 WeakPolarHBondContact O-CB 3.42Å; Q806-K809 PolarHBondContact O-N 3.41Å; E807-K809 VanDerWaalsContact C-N 3.34Å; E807-K809 PolarHBondContact O-N 2.84Å; K809-E811 VanDerWaalsContact C-N 3.31Å; K809-E811 PolarHBondContact O-N 3.38Å; K809-I812 PolarHBondContact O-N 2.89Å; K809-E813 WeakPolarHBondContact O-CB 3.46Å; K809-E813 PolarHBondContact O-N 3.17Å
810Y86.5Confident85.9Confident165 Ų165103.6 Ų103.665%0.64750%0.498SS*.Hα-helixtrans-61.9-40.7178.2-175-98.9000111.7Q806 E807 E813 R814Q806-Y810 PolarHBondContact O-N 3.14Å; E807-Y810 PolarHBondContact O-N 3.34Å; Y810-E813 PolarHBondContact O-N 2.93Å; Y810-R814 WeakPolarHBondContact O-CB 3.47Å; Y810-R814 PolarHBondContact O-N 3.5Å
811E85.5Confident85.8Confident86 Ų86102.9 Ų102.940%0.40250%0.499SS..Hα-helixtrans-70.8-37.4179.7-164139.9-129.300112.8E807 Y808 K809 E813 R814 L815E807-E811 WeakPolarHBondContact O-CB 3.39Å; E807-E811 PolarHBondContact O-N 3.1Å; Y808-E811 PolarHBondContact O-N 3.39Å; K809-E811 VanDerWaalsContact C-N 3.31Å; K809-E811 PolarHBondContact O-N 3.38Å; E811-E813 VanDerWaalsContact C-N 3.32Å; E811-E813 PolarHBondContact O-N 3.49Å; E811-R814 PolarHBondContact O-N 2.87Å; E811-R814 IonicContact OE1-CZ 3.02Å; E811-R814 IonicContact OE1-NH2 3.89Å; E811-R814 PolarHBondContact OE1-NH2 3.33Å; E811-L815 HydrophobicContact CG-CD1 4.35Å; E811-L815 WeakPolarHBondContact O-CB 3.41Å; E811-L815 VanDerWaalsContact O-CG 3.31Å; E811-L815 WeakPolarHBondContact O-CG 3.19Å; E811-L815 PolarHBondContact O-N 3Å
812I85.5Confident85.8Confident116 Ų116101.9 Ų101.960%0.59550%0.502SS*.Hα-helixtrans-61.3-42.8170.7-72.2165.7000110.5Y808 K809 L815 S816Y808-I812 WeakPolarHBondContact O-CB 2.99Å; Y808-I812 WeakPolarHBondContact O-CD1 3.34Å; Y808-I812 WeakPolarHBondContact O-CG1 3.48Å; Y808-I812 PolarHBondContact O-N 3.17Å; K809-I812 PolarHBondContact O-N 2.89Å; I812-L815 PolarHBondContact O-N 3.26Å; I812-S816 VanDerWaalsContact O-CB 3.23Å; I812-S816 WeakPolarHBondContact O-CB 3.12Å; I812-S816 PolarHBondContact O-N 2.88Å
813E85.9Confident85.6Confident128 Ų128103.2 Ų103.260%0.59851%0.507SS*.Hα-helixtrans-67.3-42180-153.1169-150.300111.4K809 Y810 E811 S816 N817K809-E813 WeakPolarHBondContact O-CB 3.46Å; K809-E813 PolarHBondContact O-N 3.17Å; Y810-E813 PolarHBondContact O-N 2.93Å; E811-E813 VanDerWaalsContact C-N 3.32Å; E811-E813 PolarHBondContact O-N 3.49Å; E813-S816 PolarHBondContact O-N 2.71Å; E813-N817 PolarHBondContact O-N 3.08Å; E813-N817 PolarHBondContact O-ND2 3.43Å
814R88.9Confident85.4Confident107 Ų107107.5 Ų107.540%0.40452%0.518SS..Hα-helixtrans-59.8-51.3172.1-174.6179.272109-15.2111.9Y810 E811 S816 N817 E818Y810-R814 WeakPolarHBondContact O-CB 3.47Å; Y810-R814 PolarHBondContact O-N 3.5Å; E811-R814 PolarHBondContact O-N 2.87Å; E811-R814 IonicContact OE1-CZ 3.02Å; E811-R814 IonicContact OE1-NH2 3.89Å; E811-R814 PolarHBondContact OE1-NH2 3.33Å; R814-S816 VanDerWaalsContact C-N 3.32Å; R814-S816 PolarHBondContact O-N 3.23Å; R814-N817 WeakPolarHBondContact O-CB 3.41Å; R814-N817 PolarHBondContact O-N 3.19Å; R814-E818 IonicContact CZ-OE1 2.96Å; R814-E818 IonicContact NH1-OE1 3.82Å; R814-E818 PolarHBondContact NH1-OE1 3.44Å; R814-E818 WeakPolarHBondContact O-CG 3.34Å; R814-E818 PolarHBondContact O-N 2.82Å
815L87.1Confident85.4Confident90 Ų90111.5 Ų111.547%0.47153%0.534SS..Hα-helixtrans-63.2-38.2179-75.2171.2000111.9E811 I812 N817 E818 L819E811-L815 HydrophobicContact CG-CD1 4.35Å; E811-L815 WeakPolarHBondContact O-CB 3.41Å; E811-L815 VanDerWaalsContact O-CG 3.31Å; E811-L815 WeakPolarHBondContact O-CG 3.19Å; E811-L815 PolarHBondContact O-N 3Å; I812-L815 PolarHBondContact O-N 3.26Å; L815-N817 VanDerWaalsContact C-N 3.33Å; L815-N817 PolarHBondContact O-N 3.1Å; L815-E818 PolarHBondContact O-N 3.38Å; L815-L819 WeakPolarHBondContact O-CB 3.05Å; L815-L819 PolarHBondContact O-N 3.36Å
816S84.6Confident85.3Confident66 Ų66115.2 Ų115.246%0.46254%0.54SS..Hα-helixtrans-60-44.4174.1-172.90000111.2I812 E813 R814 L819 V820I812-S816 VanDerWaalsContact O-CB 3.23Å; I812-S816 WeakPolarHBondContact O-CB 3.12Å; I812-S816 PolarHBondContact O-N 2.88Å; E813-S816 PolarHBondContact O-N 2.71Å; R814-S816 VanDerWaalsContact C-N 3.32Å; R814-S816 PolarHBondContact O-N 3.23Å; S816-L819 PolarHBondContact O-N 3.28Å; S816-V820 WeakPolarHBondContact O-CG2 3.34Å; S816-V820 PolarHBondContact O-N 3.44Å
817N86Confident85.1Confident100 Ų100113.9 Ų113.954%0.53554%0.536SS..Hα-helixtrans-65.8-40.7175.7-72.8-30.7000112.6E813 R814 L815 L819 V820 T821E813-N817 PolarHBondContact O-N 3.08Å; E813-N817 PolarHBondContact O-ND2 3.43Å; R814-N817 WeakPolarHBondContact O-CB 3.41Å; R814-N817 PolarHBondContact O-N 3.19Å; L815-N817 VanDerWaalsContact C-N 3.33Å; L815-N817 PolarHBondContact O-N 3.1Å; N817-L819 VanDerWaalsContact C-N 3.34Å; N817-V820 PolarHBondContact O-N 2.81Å; N817-T821 WeakPolarHBondContact O-CG2 3.29Å; N817-T821 PolarHBondContact O-N 3.3Å; N817-T821 PolarHBondContact O-OG1 3.31Å
818E85.3Confident84.8Confident82 Ų82110.6 Ų110.638%0.38353%0.529SS..Hα-helixtrans-62-40.2172.8-73.6179.1-163.800111.6R814 L815 T821 L822R814-E818 IonicContact CZ-OE1 2.96Å; R814-E818 IonicContact NH1-OE1 3.82Å; R814-E818 PolarHBondContact NH1-OE1 3.44Å; R814-E818 WeakPolarHBondContact O-CG 3.34Å; R814-E818 PolarHBondContact O-N 2.82Å; L815-E818 PolarHBondContact O-N 3.38Å; E818-T821 VanDerWaalsContact CA-OG1 3.31Å; E818-T821 WeakPolarHBondContact CA-OG1 3.31Å; E818-T821 PolarHBondContact O-N 3.04Å; E818-T821 PolarHBondContact O-OG1 2.86Å; E818-L822 WeakPolarHBondContact O-CB 3.47Å; E818-L822 PolarHBondContact O-N 2.72Å
819L84.2Confident84.6Confident102 Ų102109.2 Ų109.253%0.53453%0.528SS..Hα-helixtrans-67.4-39.5177.6-145.8164.8000111.4L815 S816 N817 L822 K823L815-L819 WeakPolarHBondContact O-CB 3.05Å; L815-L819 PolarHBondContact O-N 3.36Å; S816-L819 PolarHBondContact O-N 3.28Å; N817-L819 VanDerWaalsContact C-N 3.34Å; L819-L822 PolarHBondContact O-N 3.25Å; L819-K823 HydrophobicContact CD2-CD 4.39Å; L819-K823 HydrophobicContact CD2-CG 4.43Å; L819-K823 WeakPolarHBondContact O-CB 3.43Å; L819-K823 PolarHBondContact O-N 2.8Å
820V85Confident84.4Confident68 Ų68107.3 Ų107.341%0.41252%0.52SS..Hα-helixtrans-63.4-43.6173.6170.20000111.1S816 N817 K823 K824S816-V820 WeakPolarHBondContact O-CG2 3.34Å; S816-V820 PolarHBondContact O-N 3.44Å; N817-V820 PolarHBondContact O-N 2.81Å; V820-K823 PolarHBondContact O-N 3.21Å; V820-K824 WeakPolarHBondContact O-CG 3.46Å; V820-K824 PolarHBondContact O-N 3.05Å
821T85.3Confident83.9Confident74 Ų74108.6 Ų108.645%0.45452%0.524SS..Hα-helixtrans-68.9-39178.349.70000112.3N817 E818 K824 K825N817-T821 WeakPolarHBondContact O-CG2 3.29Å; N817-T821 PolarHBondContact O-N 3.3Å; N817-T821 PolarHBondContact O-OG1 3.31Å; E818-T821 VanDerWaalsContact CA-OG1 3.31Å; E818-T821 WeakPolarHBondContact CA-OG1 3.31Å; E818-T821 PolarHBondContact O-N 3.04Å; E818-T821 PolarHBondContact O-OG1 2.86Å; T821-K824 PolarHBondContact O-N 2.92Å; T821-K825 WeakPolarHBondContact O-CG 3.46Å; T821-K825 PolarHBondContact O-N 2.94Å
822L84Confident83.6Confident116 Ų116112.2 Ų112.261%0.60754%0.538SS*.Hα-helixtrans-62-43.8170.7-85.6165.2000112E818 L819 K824 K825 Y826E818-L822 WeakPolarHBondContact O-CB 3.47Å; E818-L822 PolarHBondContact O-N 2.72Å; L819-L822 PolarHBondContact O-N 3.25Å; L822-K824 VanDerWaalsContact C-N 3.32Å; L822-K824 PolarHBondContact O-N 3.27Å; L822-K825 PolarHBondContact O-N 3.25Å; L822-Y826 WeakPolarHBondContact O-CB 3.22Å; L822-Y826 PolarHBondContact O-N 3.47Å
823K79.9Confident83.2Confident136 Ų136111.5 Ų111.559%0.59153%0.532SS*.Hα-helixtrans-57.7-44.2172.9-97.6-177.8175.6175.30111.7L819 V820 Y826 L827L819-K823 HydrophobicContact CD2-CD 4.39Å; L819-K823 HydrophobicContact CD2-CG 4.43Å; L819-K823 WeakPolarHBondContact O-CB 3.43Å; L819-K823 PolarHBondContact O-N 2.8Å; V820-K823 PolarHBondContact O-N 3.21Å; K823-Y826 PolarHBondContact O-N 3.45Å; K823-L827 WeakPolarHBondContact O-CB 3.43Å; K823-L827 VanDerWaalsContact O-CG 3.26Å; K823-L827 WeakPolarHBondContact O-CG 3.38Å; K823-L827 PolarHBondContact O-N 2.8Å
824K83.8Confident82.6Confident145 Ų145110.8 Ų110.863%0.6353%0.532SS*.Hα-helixtrans-61.3-45.8176-75.1-177.3-176.6179.60111.6V820 T821 L822 L827 A828V820-K824 WeakPolarHBondContact O-CG 3.46Å; V820-K824 PolarHBondContact O-N 3.05Å; T821-K824 PolarHBondContact O-N 2.92Å; L822-K824 VanDerWaalsContact C-N 3.32Å; L822-K824 PolarHBondContact O-N 3.27Å; K824-L827 PolarHBondContact O-N 2.73Å; K824-A828 WeakPolarHBondContact O-CB 3.36Å; K824-A828 PolarHBondContact O-N 3.43Å
825K84.9Confident82Confident151 Ų151109.6 Ų109.666%0.65754%0.536SS*.Hα-helixtrans-62.1-45.5176.5-74.6-177.8179.8178.50111.9T821 L822 A828 Q829T821-K825 WeakPolarHBondContact O-CG 3.46Å; T821-K825 PolarHBondContact O-N 2.94Å; L822-K825 PolarHBondContact O-N 3.25Å; K825-A828 PolarHBondContact O-N 2.73Å; K825-Q829 PolarHBondContact O-N 2.8Å
826Y83.2Confident81.3Confident142 Ų142110.5 Ų110.556%0.55754%0.538SS*.Hα-helixtrans-61.6-45.9177.7-179.7-98.2000112L822 K823 A828 Q829 K830L822-Y826 WeakPolarHBondContact O-CB 3.22Å; L822-Y826 PolarHBondContact O-N 3.47Å; K823-Y826 PolarHBondContact O-N 3.45Å; Y826-A828 VanDerWaalsContact C-N 3.32Å; Y826-A828 PolarHBondContact O-N 3.42Å; Y826-Q829 PolarHBondContact O-N 2.76Å; Y826-K830 HydrophobicContact CD1-CG 4.42Å; Y826-K830 HydrophobicContact CE1-CG 3.84Å; Y826-K830 WeakPolarHBondContact O-CB 3.05Å; Y826-K830 PolarHBondContact O-N 3.08Å; Y826-K830 WeakPolarHBondContact OH-CE 3.36Å
827L82.1Confident80.6Confident105 Ų105114.6 Ų114.655%0.5555%0.548SS..Hα-helixtrans-63.5-38.3176.4-72.6170.3000112K823 K824 R831K823-L827 WeakPolarHBondContact O-CB 3.43Å; K823-L827 VanDerWaalsContact O-CG 3.26Å; K823-L827 WeakPolarHBondContact O-CG 3.38Å; K823-L827 PolarHBondContact O-N 2.8Å; K824-L827 PolarHBondContact O-N 2.73Å; L827-R831 WeakPolarHBondContact O-CB 3.28Å; L827-R831 WeakPolarHBondContact O-CG 3.48Å; L827-R831 PolarHBondContact O-N 2.9Å
828A81.2Confident79.6Confident51 Ų51113.9 Ų113.942%0.42154%0.544SS..Hα-helixtrans-65.1-41.3174.600000111.9K824 K825 Y826 R831 K832K824-A828 WeakPolarHBondContact O-CB 3.36Å; K824-A828 PolarHBondContact O-N 3.43Å; K825-A828 PolarHBondContact O-N 2.73Å; Y826-A828 VanDerWaalsContact C-N 3.32Å; Y826-A828 PolarHBondContact O-N 3.42Å; A828-R831 PolarHBondContact O-N 3.26Å; A828-K832 PolarHBondContact O-N 2.85Å
829Q83.1Confident78.4Confident113 Ų113116.2 Ų116.253%0.52855%0.553SS.*Hα-helixtrans-66.2-45.9175.5-174.2173.4-10.500111.8K825 Y826 R831 K832 E833K825-Q829 PolarHBondContact O-N 2.8Å; Y826-Q829 PolarHBondContact O-N 2.76Å; Q829-R831 VanDerWaalsContact C-N 3.27Å; Q829-R831 PolarHBondContact O-N 3.21Å; Q829-K832 WeakPolarHBondContact O-CA 3.47Å; Q829-K832 WeakPolarHBondContact O-CB 3.1Å; Q829-K832 PolarHBondContact O-N 3.46Å; Q829-E833 PolarHBondContact O-N 2.7Å
830K80.1Confident77.1Confident110 Ų110115.2 Ų115.248%0.47855%0.548SS..Hα-helixtrans-55.8-40.1172.4-97.7-88-179.5172.80112.3Y826 L834Y826-K830 HydrophobicContact CD1-CG 4.42Å; Y826-K830 HydrophobicContact CE1-CG 3.84Å; Y826-K830 WeakPolarHBondContact O-CB 3.05Å; Y826-K830 PolarHBondContact O-N 3.08Å; Y826-K830 WeakPolarHBondContact OH-CE 3.36Å; K830-L834 WeakPolarHBondContact O-CB 3.4Å; K830-L834 PolarHBondContact O-N 3.21Å
831R77Confident75.6Confident193 Ų193120.9 Ų120.973%0.72856%0.562SS**Hα-helixtrans-64.5-43.6173.8-78.7-179.6-177.8-169.90.9111.7L827 A828 Q829 L834 V835L827-R831 WeakPolarHBondContact O-CB 3.28Å; L827-R831 WeakPolarHBondContact O-CG 3.48Å; L827-R831 PolarHBondContact O-N 2.9Å; A828-R831 PolarHBondContact O-N 3.26Å; Q829-R831 VanDerWaalsContact C-N 3.27Å; Q829-R831 PolarHBondContact O-N 3.21Å; R831-L834 PolarHBondContact O-N 3.41Å; R831-V835 VanDerWaalsContact O-CG2 3.3Å; R831-V835 WeakPolarHBondContact O-CG2 3.1Å; R831-V835 PolarHBondContact O-N 2.73Å
832K79.2Confident74.1Confident161 Ų161123.7 Ų123.770%0.757%0.573SS**Hα-helixtrans-61.5-46.2175.3-76.6-175.5175.9-176.20112.1A828 Q829 L834 V835 Q836A828-K832 PolarHBondContact O-N 2.85Å; Q829-K832 WeakPolarHBondContact O-CA 3.47Å; Q829-K832 WeakPolarHBondContact O-CB 3.1Å; Q829-K832 PolarHBondContact O-N 3.46Å; K832-L834 VanDerWaalsContact C-N 3.34Å; K832-L834 PolarHBondContact O-N 3.48Å; K832-V835 PolarHBondContact O-N 3.24Å; K832-Q836 PolarHBondContact O-N 2.75Å
833E76.2Confident72.4Confident102 Ų102122.9 Ų122.948%0.47758%0.576SS.*Hα-helixtrans-62.5-38.8177.1-75.7175.4-171.600112.5Q829 Q836 K837Q829-E833 PolarHBondContact O-N 2.7Å; E833-Q836 PolarHBondContact O-N 3.43Å; E833-K837 WeakPolarHBondContact O-CB 3.47Å; E833-K837 PolarHBondContact O-N 2.65Å
834L73.8Confident70.8Confident112 Ų112122.2 Ų122.259%0.58658%0.578SS**Hα-helixtrans-65-42.1176.2-162.185.5000111.5K830 R831 K832 Q836 K837 N838K830-L834 WeakPolarHBondContact O-CB 3.4Å; K830-L834 PolarHBondContact O-N 3.21Å; R831-L834 PolarHBondContact O-N 3.41Å; K832-L834 VanDerWaalsContact C-N 3.34Å; K832-L834 PolarHBondContact O-N 3.48Å; L834-Q836 VanDerWaalsContact C-N 3.34Å; L834-K837 PolarHBondContact O-N 3.07Å; L834-N838 WeakPolarHBondContact O-CB 3.46Å; L834-N838 PolarHBondContact O-N 2.65Å
835V75.8Confident68.6Low82 Ų82122 Ų12250%0.49758%0.584SS.*Hα-helixtrans-64.3-40.7175.4172.10000110.8R831 K832 N838 K839R831-V835 VanDerWaalsContact O-CG2 3.3Å; R831-V835 WeakPolarHBondContact O-CG2 3.1Å; R831-V835 PolarHBondContact O-N 2.73Å; K832-V835 PolarHBondContact O-N 3.24Å; V835-N838 PolarHBondContact O-N 2.91Å; V835-K839 PolarHBondContact O-N 3.21Å
836Q72.9Confident66.2Low110 Ų110122 Ų12251%0.51459%0.591SS.*Hα-helixtrans-64.7-47.4176.3-159.272.91600111.4K832 E833 L834 N838 K839 D840K832-Q836 PolarHBondContact O-N 2.75Å; E833-Q836 PolarHBondContact O-N 3.43Å; L834-Q836 VanDerWaalsContact C-N 3.34Å; Q836-N838 VanDerWaalsContact C-N 3.27Å; Q836-N838 PolarHBondContact O-N 2.87Å; Q836-K839 WeakPolarHBondContact O-CA 3.49Å; Q836-K839 WeakPolarHBondContact O-CB 3.14Å; Q836-K839 PolarHBondContact O-N 2.91Å; Q836-D840 PolarHBondContact O-N 3.5Å
837K69.5Low63.8Low152 Ų152121.6 Ų121.666%0.66160%0.597SS**Hα-helixtrans-58.9-37.1174.9-105.5-177.6174.21760113E833 L834 R841E833-K837 WeakPolarHBondContact O-CB 3.47Å; E833-K837 PolarHBondContact O-N 2.65Å; L834-K837 PolarHBondContact O-N 3.07Å; K837-R841 WeakPolarHBondContact O-CB 3.5Å; K837-R841 PolarHBondContact O-N 2.61Å
838N64.6Low61.4Low84 Ų84125.7 Ų125.745%0.44961%0.611SS.*Hα-helixtrans-70.2-36.3175.5-77.4-15.7000111.7L834 V835 Q836 I842L834-N838 WeakPolarHBondContact O-CB 3.46Å; L834-N838 PolarHBondContact O-N 2.65Å; V835-N838 PolarHBondContact O-N 2.91Å; Q836-N838 VanDerWaalsContact C-N 3.27Å; Q836-N838 PolarHBondContact O-N 2.87Å; N838-I842 WeakPolarHBondContact O-CD1 3.28Å; N838-I842 VanDerWaalsContact O-CG1 3.27Å; N838-I842 WeakPolarHBondContact O-CG1 3.17Å; N838-I842 PolarHBondContact O-N 3.41Å; N838-I842 VanDerWaalsContact O-N 3.15Å
839K61.7Low58.9Low132 Ų132128.5 Ų128.557%0.57463%0.627SS**Hα-helixtrans-64.8-44.3171.4-80.8-174.3171.6-1740112.1V835 Q836 R841 I842 S843V835-K839 PolarHBondContact O-N 3.21Å; Q836-K839 WeakPolarHBondContact O-CA 3.49Å; Q836-K839 WeakPolarHBondContact O-CB 3.14Å; Q836-K839 PolarHBondContact O-N 2.91Å; K839-R841 VanDerWaalsContact C-N 3.32Å; K839-R841 PolarHBondContact O-N 3.32Å; K839-I842 PolarHBondContact O-N 3.47Å; K839-S843 PolarHBondContact O-N 3.41Å
840D55.5Low56.4Low80 Ų80130.8 Ų130.843%0.42864%0.643SS.*Hα-helixtrans-66.3-34.7179.3-63.7-22.5000111.7Q836 I842 S843 I844Q836-D840 PolarHBondContact O-N 3.5Å; D840-I842 VanDerWaalsContact C-N 3.32Å; D840-I842 PolarHBondContact O-N 2.7Å; D840-S843 PolarHBondContact O-N 3.29Å; D840-I844 VanDerWaalsContact O-CG1 3.32Å; D840-I844 WeakPolarHBondContact O-CG1 3.42Å; D840-I844 PolarHBondContact O-N 2.87Å
841R54.9Low54.7Low187 Ų187130.1 Ų130.171%0.70665%0.65SS**Hα-helixtrans-65.9-31.3171-84.8-172.9172.1-170.4-2.9113.6K837 K839 N845K837-R841 WeakPolarHBondContact O-CB 3.5Å; K837-R841 PolarHBondContact O-N 2.61Å; K839-R841 VanDerWaalsContact C-N 3.32Å; K839-R841 PolarHBondContact O-N 3.32Å; R841-N845 PolarHBondContact O-N 2.69Å
842I52.3Low52.4Low134 Ų134130.2 Ų130.269%0.68766%0.656SS**Hα-helixtrans-77-30.9176.1-65.9165000110.7N838 K839 D840N838-I842 WeakPolarHBondContact O-CD1 3.28Å; N838-I842 VanDerWaalsContact O-CG1 3.27Å; N838-I842 WeakPolarHBondContact O-CG1 3.17Å; N838-I842 PolarHBondContact O-N 3.41Å; N838-I842 VanDerWaalsContact O-N 3.15Å; K839-I842 PolarHBondContact O-N 3.47Å; D840-I842 VanDerWaalsContact C-N 3.32Å; D840-I842 PolarHBondContact O-N 2.7Å
843S48.3Very low50.1Low98 Ų98132 Ų13269%0.68567%0.667SS**Hα-helixtrans-76.9-26.9174.3-73.90000114.5K839 D840K839-S843 PolarHBondContact O-N 3.41Å; D840-S843 PolarHBondContact O-N 3.29Å
844I46Very low48.2Very low123 Ų123132.5 Ų132.563%0.63168%0.681SS**Hα-helixtrans-87-18.7-178.3-65.8168.5000112.6D840 N846D840-I844 VanDerWaalsContact O-CG1 3.32Å; D840-I844 WeakPolarHBondContact O-CG1 3.42Å; D840-I844 PolarHBondContact O-N 2.87Å; I844-N846 PolarHBondContact O-N 3.38Å
845N39.1Very low46.6Very low139 Ų139133 Ų13374%0.74369%0.689SS**THydrogen-bonded Turntrans-76.617.3-178.5-91.76000115.8R841R841-N845 PolarHBondContact O-N 2.69Å
846N34.6Very low45.2Very low151 Ų151134 Ų13481%0.80770%0.697SS**THydrogen-bonded Turntrans-110.66.7173-98.5-0.5000115.5I844I844-N846 PolarHBondContact O-N 3.38Å
847I32.8Very low43.7Very low135 Ų135139.8 Ų139.869%0.69271%0.714SS**SBendtrans-141.4101.8-176.8-67.7-174.1000110.6
848F32.1Very low42.5Very low191 Ų191141.3 Ų141.384%0.83872%0.721SS**  trans69.7113.4159.2-63.8-106.5000117.4
849S27Very low41.7Very low109 Ų109143 Ų14376%0.76274%0.735SS**  55.29067.1-580000114.5
850D31.7Very low40.7Very low162 Ų162141 Ų14187%0.86675%0.751SS**  171.2167.5119.5-111.9-8.4000112.7
851P43.7Very low40.1Very low96 Ų96140.2 Ų140.262%0.62376%0.762SS**  trans-115.7165.6-136.640.6-27.1000115.2
852K28.9Very low39.5Very low195 Ų195134.9 Ų134.985%0.84877%0.765SS**  trans56.5106.2153.9-70.5173.9-178.7178.70116.7
853Q31.5Very low39.1Very low199 Ų199138 Ų13893%0.9377%0.774SS**  -157.4148.9127-108.5166.922.700111.4
854S36.4Very low38.9Very low111 Ų111138.4 Ų138.478%0.77678%0.775SS**  trans-66.6130.9-155.254.50000115.2
855V40.4Very low38.9Very low123 Ų123140.7 Ų140.775%0.74579%0.787SS**  trans-59.5128.1167.9-1790000111.3R857V855-R857 PolarHBondContact O-N 2.9Å
856P45.6Very low39.1Very low104 Ų104141.5 Ų141.568%0.67579%0.792SS**  trans-72.6112.1159.1-723.7000108.5F858P856-F858 PolarHBondContact O-N 3.48Å
857R41.4Very low39.2Very low231 Ų231143.2 Ų143.287%0.87280%0.795SS**  trans-69.6119.5176-100.7177.4175170-1.7110.1V855V855-R857 PolarHBondContact O-N 2.9Å
858F44.9Very low39.7Very low183 Ų183142.8 Ų142.880%0.80380%0.801SS**  trans-92120.8159.1-66.6-93.4000107.8P856P856-F858 PolarHBondContact O-N 3.48Å
859T46.1Very low40Very low120 Ų120142.5 Ų142.574%0.73680%0.802SS**  trans-107141.4168.750.80000109.6
860G41Very low40.5Very low89 Ų89147.1 Ų147.192%0.91881%0.808SS**SBendtrans-43.3133.3-170.300000115
861G43.3Very low40.9Very low64 Ų64145.7 Ų145.766%0.6681%0.805SS**SBendtrans136.7-8.4179.700000115.8F863G861-F863 PolarHBondContact O-N 2.74Å
862G42.8Very low40.3Very low75 Ų75150.3 Ų150.377%0.77382%0.815SS**  trans69.427.1158.900000117.9
863F42.5Very low40.7Very low199 Ų199152.7 Ų152.787%0.87384%0.836SS**  trans-103.5117.2168.1-74.7-80.6000111.4G861G861-F863 PolarHBondContact O-N 2.74Å
864P46.1Very low41.2Very low107 Ų107150.4 Ų150.470%0.69583%0.831SS**  trans-85.2127.3177.331-29.8000111.5N866P864-N866 PolarHBondContact O-N 3.22Å; P864-N866 VanDerWaalsContact O-N 3.14Å
865L45.6Very low41.4Very low172 Ų172152.5 Ų152.590%0.90183%0.834SS**  trans-73.696.5166.4-90.1142.2000108.6
866N43.1Very low41.5Very low156 Ų156154.1 Ų154.183%0.83484%0.839SS**  trans-169.2107.3143.8-93.6-16.6000109.9P864P864-N866 PolarHBondContact O-N 3.22Å; P864-N866 VanDerWaalsContact O-N 3.14Å
867Q36.6Very low41.2Very low187 Ų187157.1 Ų157.187%0.87485%0.849SS**PPolyproline II helixtrans-64.5132.7170.7-78.8173.1-17.900110.2H869Q867-H869 PolarHBondContact O-N 3.11Å
868P42.8Very low41.2Very low126 Ų126152.4 Ų152.482%0.81885%0.847SS**PPolyproline II helixtrans-77.4125.217230.8-29.8000109.7
869H38.9Very low41Very low185 Ų185150.4 Ų150.486%0.85685%0.85SS**PPolyproline II helixtrans-58.2132.4175.2-91.4-81.2000112.1Q867 V871Q867-H869 PolarHBondContact O-N 3.11Å; H869-V871 PolarHBondContact O-N 3.44Å
870K36.4Very low40.6Very low206 Ų206152.6 Ų152.690%0.89686%0.858SS**PPolyproline II helixtrans-52.7122.4161.8-72.5174173.4176.30110.3
871V41.2Very low40.6Very low132 Ų132157.5 Ų157.580%0.885%0.854SS**  trans-107.5125.3158.9179.70000106.8H869H869-V871 PolarHBondContact O-N 3.44Å
872K31.4Very low40.3Very low193 Ų193165.3 Ų165.384%0.83987%0.87SS**  trans-79.8158.5177-79.3175.4169.9179.10110.2
873L36.5Very low40.1Very low245 Ų245173.5 Ų173.5100%1.28388%0.879SS**  trans91.40-165.4-62.6167000110.9

Retrieved 873 of 873 residues in 680.6 ms (Link to these results)