A0A3Q0KN23_SCHMA Loading...

Putative g-protein coupled receptor

AlphaFold DB , UniProt , Accession A0A3Q0KN23, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 435 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
1M37.6Very low60.5Low243 Ų243116.3 Ų116.3100%1.19759%0.591SS**  066.10-71.4-178.2-174.200108.3
2E41.8Very low62.7Low188 Ų188115.3 Ų115.388%0.87959%0.587SS**  trans-67.8140.1174.6-75.4179.2150.800109.2I4E2-I4 PolarHBondContact O-N 3.31Å
3S48.6Very low64.6Low78 Ų78114.4 Ų114.455%0.54558%0.583SS.*  trans-64.493.4-159.262.10000113.8Y5 S6S3-Y5 PolarHBondContact O-N 3.47Å; S3-S6 WeakPolarHBondContact OG-CB 3.39Å
4I49.4Very low66.1Low142 Ų142107.8 Ų107.873%0.72855%0.55SS*.SBendtrans-63-25.4160.7-60.7174.4000110.1E2 P7E2-I4 PolarHBondContact O-N 3.31Å; I4-P7 WeakPolarHBondContact O-CD 3.41Å
5Y51.6Low67.7Low195 Ų195106.3 Ų106.377%0.76554%0.538SS*.SBendtrans-82.9-18.5-175.5-74.8-83.4000116.4S3S3-Y5 PolarHBondContact O-N 3.47Å
6S58.5Low69.3Low53 Ų53104.3 Ų104.337%0.37153%0.532SS..Hα-helixtrans-73-38-174-157.10000115.9S3 D8S3-S6 WeakPolarHBondContact OG-CB 3.39Å; S6-D8 VanDerWaalsContact C-N 3.3Å; S6-D8 PolarHBondContact O-N 3.37Å
7P59.2Low70.8Confident45 Ų45102.4 Ų102.429%0.29252%0.517SS..Hα-helixtrans-67.2-29.9-178.325-32.9000113.2I4 K11I4-P7 WeakPolarHBondContact O-CD 3.41Å; P7-K11 WeakPolarHBondContact O-CG 3.47Å; P7-K11 PolarHBondContact O-N 3.25Å
8D75.7Confident72.1Confident105 Ų10596.7 Ų96.756%0.56149%0.489SS*.Hα-helixtrans-74.4-36.8-177.6-68.9-23.1000112.6S6 K11 L12S6-D8 VanDerWaalsContact C-N 3.3Å; S6-D8 PolarHBondContact O-N 3.37Å; D8-K11 PolarHBondContact O-N 3.33Å; D8-L12 WeakPolarHBondContact O-CB 3.48Å; D8-L12 PolarHBondContact O-N 3.45Å
9I81.5Confident73.4Confident98 Ų9893.7 Ų93.750%0.50348%0.478SS..Hα-helixtrans-65.3-43.7178.3-63.2169.7000110.5K11 L12 I13I9-K11 VanDerWaalsContact C-N 3.35Å; I9-K11 PolarHBondContact O-N 3.41Å; I9-L12 PolarHBondContact O-N 3.08Å; I9-I13 HydrophobicContact CG2-CD1 3.86Å; I9-I13 HydrophobicContact CG2-CG1 4.39Å; I9-I13 WeakPolarHBondContact O-CG1 3.5Å; I9-I13 PolarHBondContact O-N 3.18Å
10G79.8Confident74.6Confident15 Ų1593 Ų9316%0.15547%0.474CS..Hα-helixtrans-59.1-45.7178.500000112.2I13 I14G10-I13 PolarHBondContact O-N 2.82Å; G10-I14 WeakPolarHBondContact O-CG1 3.46Å; G10-I14 PolarHBondContact O-N 3.49Å; G10-I14 VanDerWaalsContact O-N 3.13Å
11K81.4Confident75.6Confident117 Ų11789 Ų8951%0.50945%0.454SS..Hα-helixtrans-62.6-43175.5-69.7-179.6178.81770112.1P7 D8 I9 I13 I14 K15 E72P7-K11 WeakPolarHBondContact O-CG 3.47Å; P7-K11 PolarHBondContact O-N 3.25Å; D8-K11 PolarHBondContact O-N 3.33Å; I9-K11 VanDerWaalsContact C-N 3.35Å; I9-K11 PolarHBondContact O-N 3.41Å; K11-I13 VanDerWaalsContact C-N 3.35Å; K11-I13 PolarHBondContact O-N 3.22Å; K11-I14 PolarHBondContact O-N 3.07Å; K11-K15 VanDerWaalsContact O-CB 3.3Å; K11-K15 WeakPolarHBondContact O-CB 3.47Å; K11-K15 PolarHBondContact O-N 3.48Å; K11-E72 WeakPolarHBondContact CG-OE2 3.41Å
12L87.1Confident78.5Confident104 Ų10478.4 Ų78.455%0.54540%0.402SS..Hα-helixtrans-59.7-44.8177.1-178.664.6000111.8D8 I9 I14 K15 V16D8-L12 WeakPolarHBondContact O-CB 3.48Å; D8-L12 PolarHBondContact O-N 3.45Å; I9-L12 PolarHBondContact O-N 3.08Å; L12-I14 PolarHBondContact O-N 3.1Å; L12-K15 PolarHBondContact O-N 3.4Å; L12-V16 HydrophobicContact CD1-CG2 4.34Å; L12-V16 WeakPolarHBondContact O-CG2 3.45Å; L12-V16 PolarHBondContact O-N 3.25Å
13I87.8Confident81.1Confident104 Ų10474.7 Ų74.753%0.53339%0.388SS..Hα-helixtrans-59.8-47.5177.8-69.3167.4000110.4I9 G10 K11 K15 V16 Y17I9-I13 HydrophobicContact CG2-CD1 3.86Å; I9-I13 HydrophobicContact CG2-CG1 4.39Å; I9-I13 WeakPolarHBondContact O-CG1 3.5Å; I9-I13 PolarHBondContact O-N 3.18Å; G10-I13 PolarHBondContact O-N 2.82Å; K11-I13 VanDerWaalsContact C-N 3.35Å; K11-I13 PolarHBondContact O-N 3.22Å; I13-K15 PolarHBondContact O-N 3.21Å; I13-V16 PolarHBondContact O-N 3.08Å; I13-Y17 VanDerWaalsContact O-CB 3.24Å; I13-Y17 WeakPolarHBondContact O-CB 3.31Å; I13-Y17 PolarHBondContact O-N 2.9Å
14I85.8Confident83.4Confident22 Ų2276 Ų7611%0.11338%0.384CS..Hα-helixtrans-63.6-44.1180-63.6165.6000110.6G10 K11 L12 V16 Y17 A18 E72 Y349 M353G10-I14 WeakPolarHBondContact O-CG1 3.46Å; G10-I14 PolarHBondContact O-N 3.49Å; G10-I14 VanDerWaalsContact O-N 3.13Å; K11-I14 PolarHBondContact O-N 3.07Å; L12-I14 PolarHBondContact O-N 3.1Å; I14-V16 PolarHBondContact O-N 3.48Å; I14-Y17 PolarHBondContact O-N 3.23Å; I14-A18 VanDerWaalsContact O-CB 3.29Å; I14-A18 WeakPolarHBondContact O-CB 3.3Å; I14-A18 PolarHBondContact O-N 3.07Å; I14-E72 HydrophobicContact CB-CG 4.39Å; I14-E72 HydrophobicContact CG2-CG 3.82Å; I14-Y349 HydrophobicContact CD1-CG 4.26Å; I14-M353 HydrophobicContact CG2-CE 4.44Å
15K89.9Confident85.7Confident85 Ų8569.2 Ų69.237%0.3735%0.349SS..Hα-helixtrans-56.5-49.8177.7-179.8172.2-179.7172.20112K11 L12 I13 S19 E72 V73K11-K15 VanDerWaalsContact O-CB 3.3Å; K11-K15 WeakPolarHBondContact O-CB 3.47Å; K11-K15 PolarHBondContact O-N 3.48Å; L12-K15 PolarHBondContact O-N 3.4Å; I13-K15 PolarHBondContact O-N 3.21Å; K15-S19 WeakPolarHBondContact O-CB 3.38Å; K15-S19 PolarHBondContact O-N 3.05Å; K15-S19 PolarHBondContact O-OG 2.9Å; K15-E72 HydrophobicContact CB-CB 4.28Å; K15-V73 HydrophobicContact CD-CG2 4.18Å; K15-V73 HydrophobicContact CG-CG2 3.67Å
16V93.4Very high88Confident74 Ų7462.3 Ų62.345%0.44833%0.325SS..Hα-helixtrans-64.5-46.7177.91730000110L12 I13 I14 S19 L20L12-V16 HydrophobicContact CD1-CG2 4.34Å; L12-V16 WeakPolarHBondContact O-CG2 3.45Å; L12-V16 PolarHBondContact O-N 3.25Å; I13-V16 PolarHBondContact O-N 3.08Å; I14-V16 PolarHBondContact O-N 3.48Å; V16-S19 WeakPolarHBondContact O-CB 3.45Å; V16-S19 PolarHBondContact O-N 3.3Å; V16-L20 HydrophobicContact CG1-CD1 3.95Å; V16-L20 HydrophobicContact CG1-CG 4.38Å; V16-L20 WeakPolarHBondContact O-CG 3.19Å; V16-L20 PolarHBondContact O-N 3.43Å
17Y94.1Very high89.8Confident72 Ų7262.7 Ų62.728%0.28233%0.326SS..Hα-helixtrans-66.4-45-175.3-168.2-165.1000112.7I13 I14 S19 L20 L21 M353 T357I13-Y17 VanDerWaalsContact O-CB 3.24Å; I13-Y17 WeakPolarHBondContact O-CB 3.31Å; I13-Y17 PolarHBondContact O-N 2.9Å; I14-Y17 PolarHBondContact O-N 3.23Å; Y17-S19 VanDerWaalsContact C-N 3.27Å; Y17-S19 PolarHBondContact O-N 3.01Å; Y17-L20 PolarHBondContact O-N 3.32Å; Y17-L20 VanDerWaalsContact O-N 3.16Å; Y17-L21 HydrophobicContact CD2-CD1 4.38Å; Y17-L21 HydrophobicContact CD2-CD2 4.44Å; Y17-L21 HydrophobicContact CD2-CG 4.04Å; Y17-L21 HydrophobicContact CE2-CD1 4.29Å; Y17-L21 HydrophobicContact CE2-CD2 3.92Å; Y17-L21 HydrophobicContact CE2-CG 3.99Å; Y17-L21 WeakPolarHBondContact O-CG 3.18Å; Y17-L21 PolarHBondContact O-N 2.91Å; Y17-M353 HydrophobicContact CD1-CB 3.69Å; Y17-M353 HydrophobicContact CD1-CG 4.41Å; Y17-M353 HydrophobicContact CE1-CB 3.63Å; Y17-T357 PolarHBondContact OH-OG1 3.42Å
18A94.7Very high91.6Very high0 Ų060.7 Ų60.70%031%0.314CS..Hα-helixtrans-56.9-4317400000111.6I14 L20 L21 L22 V65 W69 M353I14-A18 VanDerWaalsContact O-CB 3.29Å; I14-A18 WeakPolarHBondContact O-CB 3.3Å; I14-A18 PolarHBondContact O-N 3.07Å; A18-L20 PolarHBondContact O-N 3.03Å; A18-L21 PolarHBondContact O-N 3.46Å; A18-L22 WeakPolarHBondContact O-CG 3.47Å; A18-L22 PolarHBondContact O-N 3.09Å; A18-L22 VanDerWaalsContact O-N 3.09Å; A18-V65 HydrophobicContact CB-CG1 4.38Å; A18-W69 HydrophobicContact CB-CB 4.12Å; A18-M353 VanDerWaalsContact CA-CE 3.41Å; A18-M353 HydrophobicContact CB-CE 3.44Å; A18-M353 VanDerWaalsContact CB-CE 3.44Å
19S96.5Very high92.7Very high40 Ų4055.8 Ų55.828%0.2829%0.288SS..Hα-helixtrans-62.8-42.6177.9-58.20000111.6K15 V16 Y17 L22 L23 W69K15-S19 WeakPolarHBondContact O-CB 3.38Å; K15-S19 PolarHBondContact O-N 3.05Å; K15-S19 PolarHBondContact O-OG 2.9Å; V16-S19 WeakPolarHBondContact O-CB 3.45Å; V16-S19 PolarHBondContact O-N 3.3Å; Y17-S19 VanDerWaalsContact C-N 3.27Å; Y17-S19 PolarHBondContact O-N 3.01Å; S19-L22 PolarHBondContact O-N 3.44Å; S19-L23 WeakPolarHBondContact O-CB 3.29Å; S19-L23 PolarHBondContact O-N 3.22Å; S19-W69 VanDerWaalsContact OG-CD1 3.3Å; S19-W69 PolarHBondContact OG-NE1 2.94Å
20L96.5Very high93.4Very high79 Ų7955.9 Ų55.941%0.41429%0.289SS..Hα-helixtrans-65.2-41.8176.9-68171.5000112.2V16 Y17 A18 L22 L23 F24V16-L20 HydrophobicContact CG1-CD1 3.95Å; V16-L20 HydrophobicContact CG1-CG 4.38Å; V16-L20 WeakPolarHBondContact O-CG 3.19Å; V16-L20 PolarHBondContact O-N 3.43Å; Y17-L20 PolarHBondContact O-N 3.32Å; Y17-L20 VanDerWaalsContact O-N 3.16Å; A18-L20 PolarHBondContact O-N 3.03Å; L20-L22 VanDerWaalsContact C-N 3.34Å; L20-L22 PolarHBondContact O-N 2.75Å; L20-L23 PolarHBondContact O-N 2.89Å; L20-F24 HydrophobicContact CD2-CD2 4.31Å; L20-F24 HydrophobicContact CD2-CE2 3.83Å; L20-F24 WeakPolarHBondContact O-CD2 3.34Å; L20-F24 PolarHBondContact O-N 3.22Å
21L97.1Very high94.2Very high9 Ų958.4 Ų58.45%0.04730%0.298CS..Hα-helixtrans-60.6-42.7177.1-70.4178.9000111.7Y17 A18 G25 V65 M353 F356 T357 A360Y17-L21 HydrophobicContact CD2-CD1 4.38Å; Y17-L21 HydrophobicContact CD2-CD2 4.44Å; Y17-L21 HydrophobicContact CD2-CG 4.04Å; Y17-L21 HydrophobicContact CE2-CD1 4.29Å; Y17-L21 HydrophobicContact CE2-CD2 3.92Å; Y17-L21 HydrophobicContact CE2-CG 3.99Å; Y17-L21 WeakPolarHBondContact O-CG 3.18Å; Y17-L21 PolarHBondContact O-N 2.91Å; A18-L21 PolarHBondContact O-N 3.46Å; L21-G25 WeakPolarHBondContact O-CA 3.4Å; L21-G25 PolarHBondContact O-N 3.34Å; L21-V65 HydrophobicContact CB-CG1 4.01Å; L21-V65 HydrophobicContact CD1-CG1 4.27Å; L21-V65 HydrophobicContact CD1-CG2 4.48Å; L21-M353 HydrophobicContact CD1-CE 4.01Å; L21-F356 HydrophobicContact CD1-CB 4.39Å; L21-T357 HydrophobicContact CD2-CG2 4.35Å; L21-A360 HydrophobicContact CB-CB 4.38Å; L21-A360 HydrophobicContact CD2-CB 3.66Å
22L97.9Very high94.9Very high21 Ų2152.9 Ų52.911%0.1128%0.275CS..Hα-helixtrans-70.2-45.3176-66.4174.8000111.9A18 S19 L20 F24 L26 L61 V65 L66 W69A18-L22 WeakPolarHBondContact O-CG 3.47Å; A18-L22 PolarHBondContact O-N 3.09Å; A18-L22 VanDerWaalsContact O-N 3.09Å; S19-L22 PolarHBondContact O-N 3.44Å; L20-L22 VanDerWaalsContact C-N 3.34Å; L20-L22 PolarHBondContact O-N 2.75Å; L22-F24 PolarHBondContact O-N 3.12Å; L22-L26 HydrophobicContact CB-CD1 4.5Å; L22-L26 HydrophobicContact CD2-CD1 4.3Å; L22-L26 WeakPolarHBondContact O-CB 3.05Å; L22-L26 WeakPolarHBondContact O-CG 3.42Å; L22-L26 PolarHBondContact O-N 3.33Å; L22-L61 HydrophobicContact CD2-CB 4.12Å; L22-L61 WeakPolarHBondContact CD2-O 3.48Å; L22-V65 HydrophobicContact CD2-CB 4.11Å; L22-V65 HydrophobicContact CD2-CG1 4Å; L22-V65 HydrophobicContact CG-CG1 3.91Å; L22-L66 HydrophobicContact CD1-CD1 4.14Å; L22-W69 HydrophobicContact CD1-CB 3.79Å; L22-W69 HydrophobicContact CD1-CD2 4.37Å; L22-W69 HydrophobicContact CD1-CG 3.73Å
23L96.8Very high95.3Very high110 Ų11048.7 Ų48.758%0.57626%0.255SS*.Hα-helixtrans-61.7-41.8-176.6179.163.2000112.6S19 L20 P27S19-L23 WeakPolarHBondContact O-CB 3.29Å; S19-L23 PolarHBondContact O-N 3.22Å; L20-L23 PolarHBondContact O-N 2.89Å; L23-P27 WeakPolarHBondContact O-CD 3.46Å; L23-P27 WeakPolarHBondContact O-CG 3.47Å
24F97Very high95.7Very high106 Ų10649.1 Ų49.147%0.46526%0.257SS..Hα-helixtrans-95.3-34.8-179.9-69.2-69.1000113L20 L22 G28 F364L20-F24 HydrophobicContact CD2-CD2 4.31Å; L20-F24 HydrophobicContact CD2-CE2 3.83Å; L20-F24 WeakPolarHBondContact O-CD2 3.34Å; L20-F24 PolarHBondContact O-N 3.22Å; L22-F24 PolarHBondContact O-N 3.12Å; F24-G28 VanDerWaalsContact O-CA 3.3Å; F24-G28 WeakPolarHBondContact O-CA 3.27Å; F24-G28 PolarHBondContact O-N 3.47Å; F24-F364 HydrophobicContact CB-CE2 4.17Å; F24-F364 HydrophobicContact CB-CZ 4.39Å; F24-F364 HydrophobicContact CD1-CZ 4.17Å; F24-F364 HydrophobicContact CG-CZ 4.33Å
25G97.9Very high96Very high0 Ų049.3 Ų49.30%026%0.258CS..Hα-helixtrans-68.2-50.6-175.400000113.1L21 G28 N29 L61L21-G25 WeakPolarHBondContact O-CA 3.4Å; L21-G25 PolarHBondContact O-N 3.34Å; G25-G28 PolarHBondContact O-N 3.01Å; G25-N29 WeakPolarHBondContact O-CB 3.34Å; G25-N29 PolarHBondContact O-N 2.88Å; G25-N29 PolarHBondContact O-ND2 2.82Å; G25-L61 VanDerWaalsContact C-CD1 3.47Å
26L98.3Very high96.1Very high49 Ų4945.6 Ų45.626%0.25724%0.242SC..Hα-helixtrans-59.1-56.5-177.5-65.9174.3000112.9L22 L30 N58 L61 L62L22-L26 HydrophobicContact CB-CD1 4.5Å; L22-L26 HydrophobicContact CD2-CD1 4.3Å; L22-L26 WeakPolarHBondContact O-CB 3.05Å; L22-L26 WeakPolarHBondContact O-CG 3.42Å; L22-L26 PolarHBondContact O-N 3.33Å; L26-L30 PolarHBondContact O-N 3.04Å; L26-N58 WeakPolarHBondContact CA-OD1 3.16Å; L26-N58 HydrophobicContact CD2-CB 4.27Å; L26-L61 HydrophobicContact CD2-CB 3.8Å; L26-L61 HydrophobicContact CD2-CD1 4.04Å; L26-L61 HydrophobicContact CG-CB 4.44Å; L26-L61 HydrophobicContact CG-CD1 4.26Å; L26-L62 HydrophobicContact CD1-CD2 4.13Å; L26-L62 HydrophobicContact CD2-CD2 4.05Å; L26-L62 HydrophobicContact CD2-CG 3.91Å
27P97.8Very high96Very high61 Ų6142.3 Ų42.340%0.39622%0.223SC..Hα-helixtrans-69.2-34.3176.927.3-34.1000112.1L23 N29 L30 I31L23-P27 WeakPolarHBondContact O-CD 3.46Å; L23-P27 WeakPolarHBondContact O-CG 3.47Å; P27-N29 PolarHBondContact O-N 3.37Å; P27-L30 PolarHBondContact O-N 3.31Å; P27-I31 WeakPolarHBondContact O-CB 3.38Å; P27-I31 VanDerWaalsContact O-CG1 3.24Å; P27-I31 WeakPolarHBondContact O-CG1 3.49Å; P27-I31 PolarHBondContact O-N 3.36Å
28G97.5Very high95.9Very high4 Ų440.9 Ų40.94%0.04123%0.23CC..Hα-helixtrans-60.4-45.2179.400000112.5F24 G25 I31 S32F24-G28 VanDerWaalsContact O-CA 3.3Å; F24-G28 WeakPolarHBondContact O-CA 3.27Å; F24-G28 PolarHBondContact O-N 3.47Å; G25-G28 PolarHBondContact O-N 3.01Å; G28-I31 PolarHBondContact O-N 3.12Å; G28-S32 WeakPolarHBondContact O-CB 3.44Å; G28-S32 PolarHBondContact O-N 3.1Å; G28-S32 PolarHBondContact O-OG 3.16Å
29N97.6Very high95.6Very high1 Ų142.7 Ų42.71%0.00524%0.24CC..Hα-helixtrans-66.8-39.5176.2-72.7-27.9000111.8G25 P27 S32 A33 A54 D57 N58 N359G25-N29 WeakPolarHBondContact O-CB 3.34Å; G25-N29 PolarHBondContact O-N 2.88Å; G25-N29 PolarHBondContact O-ND2 2.82Å; P27-N29 PolarHBondContact O-N 3.37Å; N29-S32 WeakPolarHBondContact O-CB 3.42Å; N29-S32 PolarHBondContact O-N 3.48Å; N29-A33 PolarHBondContact O-N 2.86Å; N29-A54 HydrophobicContact CB-CB 4.19Å; N29-A54 WeakPolarHBondContact O-CB 3.19Å; N29-D57 VanDerWaalsContact ND2-CB 3.31Å; N29-D57 WeakPolarHBondContact ND2-CB 3.47Å; N29-N58 WeakPolarHBondContact CB-OD1 3.44Å; N29-N58 PolarHBondContact ND2-OD1 3.37Å; N29-N359 PolarHBondContact ND2-O 3.2Å
30L97.2Very high95.1Very high100 Ų10050 Ų5052%0.52427%0.267SS..Hα-helixtrans-62.3-47.6175.5-178.861.5000111.9L26 P27 S32 A33 I34L26-L30 PolarHBondContact O-N 3.04Å; P27-L30 PolarHBondContact O-N 3.31Å; L30-S32 VanDerWaalsContact C-N 3.26Å; L30-S32 PolarHBondContact O-N 2.93Å; L30-A33 WeakPolarHBondContact O-CB 3.45Å; L30-A33 PolarHBondContact O-N 3.45Å; L30-I34 HydrophobicContact CD1-CD1 4.28Å; L30-I34 HydrophobicContact CG-CD1 4.09Å; L30-I34 WeakPolarHBondContact O-CG1 3.37Å; L30-I34 PolarHBondContact O-N 2.8Å
31I96.2Very high94.5Very high69 Ų6949.6 Ų49.635%0.35427%0.271SS..Hα-helixtrans-60.1-41.2175.5-68164.7000110.1P27 G28 A33 I34 I35 F363P27-I31 WeakPolarHBondContact O-CB 3.38Å; P27-I31 VanDerWaalsContact O-CG1 3.24Å; P27-I31 WeakPolarHBondContact O-CG1 3.49Å; P27-I31 PolarHBondContact O-N 3.36Å; G28-I31 PolarHBondContact O-N 3.12Å; I31-A33 PolarHBondContact O-N 3.41Å; I31-I34 PolarHBondContact O-N 3.41Å; I31-I35 HydrophobicContact CG2-CD1 3.62Å; I31-I35 HydrophobicContact CG2-CG1 4.28Å; I31-I35 WeakPolarHBondContact O-CG1 3.36Å; I31-I35 PolarHBondContact O-N 3.41Å; I31-F363 HydrophobicContact CB-CD2 4.45Å; I31-F363 HydrophobicContact CB-CE2 4.38Å; I31-F363 HydrophobicContact CG2-CD2 4.26Å; I31-F363 HydrophobicContact CG2-CE2 3.83Å
32S94.9Very high93.9Very high1 Ų150.3 Ų50.31%0.00727%0.274CS..Hα-helixtrans-60.9-45.1177.8-58.40000112G28 N29 L30 M36 Y366G28-S32 WeakPolarHBondContact O-CB 3.44Å; G28-S32 PolarHBondContact O-N 3.1Å; G28-S32 PolarHBondContact O-OG 3.16Å; N29-S32 WeakPolarHBondContact O-CB 3.42Å; N29-S32 PolarHBondContact O-N 3.48Å; L30-S32 VanDerWaalsContact C-N 3.26Å; L30-S32 PolarHBondContact O-N 2.93Å; S32-M36 VanDerWaalsContact O-CB 3.3Å; S32-M36 WeakPolarHBondContact O-CB 3.42Å; S32-M36 PolarHBondContact O-N 2.76Å; S32-Y366 WeakPolarHBondContact OG-CD2 3.39Å
33A96.1Very high93.4Very high16 Ų1651.4 Ų51.413%0.13228%0.277CS..Hα-helixtrans-60.7-45.1175.200000112.3N29 L30 I31 G37 I51 A54N29-A33 PolarHBondContact O-N 2.86Å; L30-A33 WeakPolarHBondContact O-CB 3.45Å; L30-A33 PolarHBondContact O-N 3.45Å; I31-A33 PolarHBondContact O-N 3.41Å; A33-G37 WeakPolarHBondContact O-CA 3.46Å; A33-G37 PolarHBondContact O-N 3.02Å; A33-I51 HydrophobicContact CB-CG1 4.41Å; A33-A54 HydrophobicContact CB-CB 3.72Å
34I95.6Very high93.2Very high113 Ų11350.7 Ų50.758%0.57927%0.273SS*.Hα-helixtrans-63.9-49.4-179.4-67.6165.7000110.8L30 I31 G38L30-I34 HydrophobicContact CD1-CD1 4.28Å; L30-I34 HydrophobicContact CG-CD1 4.09Å; L30-I34 WeakPolarHBondContact O-CG1 3.37Å; L30-I34 PolarHBondContact O-N 2.8Å; I31-I34 PolarHBondContact O-N 3.41Å; I34-G38 WeakPolarHBondContact O-CA 3.43Å; I34-G38 PolarHBondContact O-N 2.67Å
35I93.9Very high93Very high25 Ų2545.8 Ų45.813%0.12825%0.252CS..Hα-helixtrans-71-53.9-175.6-64.8175.6000110.5I31 G38 D39 F373 T376 I377I31-I35 HydrophobicContact CG2-CD1 3.62Å; I31-I35 HydrophobicContact CG2-CG1 4.28Å; I31-I35 WeakPolarHBondContact O-CG1 3.36Å; I31-I35 PolarHBondContact O-N 3.41Å; I35-G38 PolarHBondContact O-N 3.27Å; I35-D39 WeakPolarHBondContact O-CB 3.36Å; I35-D39 PolarHBondContact O-N 2.88Å; I35-F373 HydrophobicContact CB-CD2 3.89Å; I35-F373 HydrophobicContact CB-CE2 3.67Å; I35-F373 HydrophobicContact CD1-CD2 4.35Å; I35-F373 HydrophobicContact CD1-CE2 3.89Å; I35-F373 HydrophobicContact CD1-CZ 4.1Å; I35-F373 HydrophobicContact CG1-CE2 4.33Å; I35-F373 HydrophobicContact CG2-CD2 3.4Å; I35-F373 HydrophobicContact CG2-CE2 3.74Å; I35-F373 HydrophobicContact CG2-CG 4.26Å; I35-T376 HydrophobicContact CD1-CG2 4.43Å; I35-T376 HydrophobicContact CG1-CG2 4.24Å; I35-T376 HydrophobicContact CG2-CG2 3.98Å; I35-I377 HydrophobicContact CD1-CD1 4.27Å; I35-I377 HydrophobicContact CD1-CG1 3.57Å
36M91Very high92.7Very high7 Ų745.9 Ų45.93%0.03425%0.253CS..Hα-helixtrans-78.2-34.9-174-67.3-168.575.900113.3S32 G38 D39 N42 I50 L308 Y366 F373S32-M36 VanDerWaalsContact O-CB 3.3Å; S32-M36 WeakPolarHBondContact O-CB 3.42Å; S32-M36 PolarHBondContact O-N 2.76Å; M36-G38 VanDerWaalsContact C-N 3.28Å; M36-D39 PolarHBondContact O-N 3.3Å; M36-N42 PolarHBondContact O-ND2 3.34Å; M36-I50 HydrophobicContact CB-CD1 4.09Å; M36-I50 HydrophobicContact CB-CG2 3.82Å; M36-I50 HydrophobicContact CE-CD1 3.47Å; M36-I50 VanDerWaalsContact CE-CD1 3.47Å; M36-I50 HydrophobicContact SD-CD1 4.22Å; M36-I50 HydrophobicContact SD-CG2 4.28Å; M36-L308 HydrophobicContact CE-CD2 3.36Å; M36-Y366 HydrophobicContact CE-CD1 3.95Å; M36-Y366 HydrophobicContact CE-CE1 3.85Å; M36-Y366 HydrophobicContact SD-CD1 3.17Å; M36-Y366 WeakPolarHBondContact SD-CD1 3.44Å; M36-Y366 HydrophobicContact SD-CD2 4.07Å; M36-Y366 HydrophobicContact SD-CE1 3.21Å; M36-Y366 WeakPolarHBondContact SD-CE1 3.26Å; M36-Y366 HydrophobicContact SD-CE2 4.12Å; M36-Y366 HydrophobicContact SD-CG 3.68Å; M36-F373 HydrophobicContact CG-CD2 3.66Å; M36-F373 HydrophobicContact CG-CE2 3.95Å; M36-F373 HydrophobicContact SD-CD2 4.35Å
37G91.9Very high92.4Very high5 Ų546.9 Ų46.95%0.05225%0.253CS..Hα-helixtrans-70.6-24.217200000112.5A33 R47A33-G37 WeakPolarHBondContact O-CA 3.46Å; A33-G37 PolarHBondContact O-N 3.02Å; G37-R47 VanDerWaalsContact O-CZ 3.26Å; G37-R47 PolarHBondContact O-NE 2.85Å; G37-R47 PolarHBondContact O-NH2 2.84Å
38G91.1Very high92.3Very high42 Ų4245.9 Ų45.943%0.43324%0.244SC..Hα-helixtrans-85.4-21.3172.800000114.9I34 I35 M36 K40I34-G38 WeakPolarHBondContact O-CA 3.43Å; I34-G38 PolarHBondContact O-N 2.67Å; I35-G38 PolarHBondContact O-N 3.27Å; M36-G38 VanDerWaalsContact C-N 3.28Å; G38-K40 PolarHBondContact O-N 2.9Å; G38-K40 VanDerWaalsContact O-N 3.09Å
39D88.1Confident92.2Very high38 Ų3845.9 Ų45.920%0.20324%0.243CC..  trans-68.4107.5-174.8-173-10.4000112I35 M36 S41 N42 R47I35-D39 WeakPolarHBondContact O-CB 3.36Å; I35-D39 PolarHBondContact O-N 2.88Å; M36-D39 PolarHBondContact O-N 3.3Å; D39-S41 PolarHBondContact O-N 3.05Å; D39-S41 WeakPolarHBondContact OD1-CB 3.29Å; D39-S41 PolarHBondContact OD1-N 3.13Å; D39-S41 PolarHBondContact OD1-OG 3.36Å; D39-S41 PolarHBondContact OD2-OG 3.01Å; D39-N42 WeakPolarHBondContact O-CB 3.43Å; D39-N42 PolarHBondContact O-N 2.93Å; D39-R47 WeakPolarHBondContact O-CD 3.33Å
40K86.9Confident92Very high194 Ų19446 Ų4684%0.84324%0.244SC*.THydrogen-bonded Turntrans-65.8-14.9179.5-63.5-177.5-178.7179.90113.6G38 N42G38-K40 PolarHBondContact O-N 2.9Å; G38-K40 VanDerWaalsContact O-N 3.09Å; K40-N42 PolarHBondContact O-N 2.97Å
41S83.3Confident92Very high71 Ų7144.5 Ų44.550%0.49724%0.236SC..THydrogen-bonded Turntrans-70.3-24.817276.30000111.9D39 R300D39-S41 PolarHBondContact O-N 3.05Å; D39-S41 WeakPolarHBondContact OD1-CB 3.29Å; D39-S41 PolarHBondContact OD1-N 3.13Å; D39-S41 PolarHBondContact OD1-OG 3.36Å; D39-S41 PolarHBondContact OD2-OG 3.01Å; S41-R300 PolarHBondContact O-NH1 3.43Å
42N85.4Confident92.1Very high23 Ų2342.9 Ų42.912%0.12323%0.227CC..SBendtrans-77150.9173.4-69.5-39.2000111.2M36 D39 K40 T46 R47M36-N42 PolarHBondContact O-ND2 3.34Å; D39-N42 WeakPolarHBondContact O-CB 3.43Å; D39-N42 PolarHBondContact O-N 2.93Å; K40-N42 PolarHBondContact O-N 2.97Å; N42-T46 HydrophobicContact CB-CG2 4.04Å; N42-R47 HydrophobicContact CB-CG 3.65Å
43R87Confident92.2Very high45 Ų4543 Ų4317%0.1723%0.227CC..  trans-70.6149.2175.6-173.7178174.2-154.819.8108.6T45 T46 R47 E110 V114 A121 V125R43-T45 VanDerWaalsContact C-N 3.25Å; R43-T45 WeakPolarHBondContact CD-OG1 3.47Å; R43-T45 VanDerWaalsContact CG-OG1 3.31Å; R43-T45 WeakPolarHBondContact CG-OG1 3.48Å; R43-T45 PolarHBondContact NE-OG1 3.49Å; R43-T45 PolarHBondContact NH1-OG1 2.76Å; R43-T45 PolarHBondContact O-N 3.3Å; R43-T46 VanDerWaalsContact O-CB 3.26Å; R43-T46 WeakPolarHBondContact O-CB 3.49Å; R43-T46 PolarHBondContact O-N 2.7Å; R43-T46 VanDerWaalsContact O-N 3.1Å; R43-R47 WeakPolarHBondContact O-CG 3.47Å; R43-R47 PolarHBondContact O-N 3.47Å; R43-E110 IonicContact NH1-OE1 3.69Å; R43-V114 VanDerWaalsContact NH1-CG2 3.33Å; R43-A121 PolarHBondContact NH2-O 2.86Å; R43-V125 VanDerWaalsContact NH1-CB 3.35Å; R43-V125 VanDerWaalsContact NH1-CG1 3.28Å; R43-V125 PolarHBondContact NH1-O 3.28Å; R43-V125 PolarHBondContact NH2-O 3.37Å
44L91.6Very high92.3Very high94 Ų9442.5 Ų42.549%0.49222%0.224SC..Hα-helixtrans-56-40179.7-171.659.5000113R47 L48 L127L44-R47 PolarHBondContact O-N 2.83Å; L44-L48 PolarHBondContact O-N 3.45Å; L44-L127 HydrophobicContact CD2-CD1 4.44Å; L44-L127 HydrophobicContact CD2-CD2 3.84Å; L44-L127 HydrophobicContact CG-CD1 4.08Å; L44-L127 HydrophobicContact CG-CD2 4.32Å
45T92.8Very high92.4Very high4 Ų441.6 Ų41.63%0.02522%0.219CC..Hα-helixtrans-59.2-48.7174.851.20000112.1R43 R47 L48 I49 E110 V125 V130R43-T45 VanDerWaalsContact C-N 3.25Å; R43-T45 WeakPolarHBondContact CD-OG1 3.47Å; R43-T45 VanDerWaalsContact CG-OG1 3.31Å; R43-T45 WeakPolarHBondContact CG-OG1 3.48Å; R43-T45 PolarHBondContact NE-OG1 3.49Å; R43-T45 PolarHBondContact NH1-OG1 2.76Å; R43-T45 PolarHBondContact O-N 3.3Å; T45-R47 VanDerWaalsContact C-N 3.33Å; T45-R47 PolarHBondContact O-N 3.4Å; T45-L48 PolarHBondContact O-N 3.28Å; T45-I49 VanDerWaalsContact O-CG1 3.32Å; T45-I49 WeakPolarHBondContact O-CG1 3.37Å; T45-I49 PolarHBondContact O-N 3.36Å; T45-E110 WeakPolarHBondContact CB-OE1 3.43Å; T45-E110 PolarHBondContact OG1-OE1 3.36Å; T45-V125 HydrophobicContact CG2-CG1 4.29Å; T45-V125 WeakPolarHBondContact CG2-O 3.3Å; T45-V130 HydrophobicContact CG2-CG2 4.03Å
46T91.5Very high92.6Very high2 Ų240.4 Ų40.41%0.01221%0.213CC..Hα-helixtrans-55.7-49.1174.2-60.60000111.8N42 R43 L48 I49 I50 E110 R111N42-T46 HydrophobicContact CB-CG2 4.04Å; R43-T46 VanDerWaalsContact O-CB 3.26Å; R43-T46 WeakPolarHBondContact O-CB 3.49Å; R43-T46 PolarHBondContact O-N 2.7Å; R43-T46 VanDerWaalsContact O-N 3.1Å; T46-L48 VanDerWaalsContact C-N 3.25Å; T46-L48 PolarHBondContact O-N 2.98Å; T46-I49 PolarHBondContact O-N 2.95Å; T46-I50 HydrophobicContact CG2-CD1 3.49Å; T46-I50 VanDerWaalsContact CG2-CD1 3.49Å; T46-I50 HydrophobicContact CG2-CG1 4.21Å; T46-I50 WeakPolarHBondContact O-CG1 3.19Å; T46-I50 PolarHBondContact O-N 3.34Å; T46-E110 WeakPolarHBondContact CA-OE2 3.33Å; T46-E110 PolarHBondContact N-OE1 3Å; T46-E110 VanDerWaalsContact OG1-CD 3.3Å; T46-E110 PolarHBondContact OG1-OE1 3.5Å; T46-E110 PolarHBondContact OG1-OE2 2.96Å; T46-R111 PolarHBondContact OG1-NH1 3.5Å; T46-R111 PolarHBondContact OG1-NH2 2.97Å
47R93.3Very high92.9Very high70 Ų7040.2 Ų40.226%0.26421%0.212SC..Hα-helixtrans-58.5-44.9-176.2-69.1168.261.7-148.7-9.9109.6G37 D39 N42 R43 L44 T45 I51G37-R47 VanDerWaalsContact O-CZ 3.26Å; G37-R47 PolarHBondContact O-NE 2.85Å; G37-R47 PolarHBondContact O-NH2 2.84Å; D39-R47 WeakPolarHBondContact O-CD 3.33Å; N42-R47 HydrophobicContact CB-CG 3.65Å; R43-R47 WeakPolarHBondContact O-CG 3.47Å; R43-R47 PolarHBondContact O-N 3.47Å; L44-R47 PolarHBondContact O-N 2.83Å; T45-R47 VanDerWaalsContact C-N 3.33Å; T45-R47 PolarHBondContact O-N 3.4Å; R47-I51 WeakPolarHBondContact O-CD1 3.47Å; R47-I51 VanDerWaalsContact O-CG1 3.27Å; R47-I51 WeakPolarHBondContact O-CG1 3.29Å; R47-I51 PolarHBondContact O-N 2.89Å; R47-I51 VanDerWaalsContact O-N 3.15Å
48L96.1Very high93.3Very high39 Ų3941.5 Ų41.520%0.20422%0.218CC..Hα-helixtrans-61.7-50.2175.1178.9136.3000112.2L44 T45 T46 I50 I51 I52 L127 V130 I131L44-L48 PolarHBondContact O-N 3.45Å; T45-L48 PolarHBondContact O-N 3.28Å; T46-L48 VanDerWaalsContact C-N 3.25Å; T46-L48 PolarHBondContact O-N 2.98Å; L48-I50 VanDerWaalsContact C-N 3.32Å; L48-I50 PolarHBondContact O-N 2.95Å; L48-I51 PolarHBondContact O-N 2.92Å; L48-I52 HydrophobicContact CD2-CD1 3.46Å; L48-I52 VanDerWaalsContact CD2-CD1 3.46Å; L48-I52 HydrophobicContact CD2-CG1 4.46Å; L48-I52 HydrophobicContact CG-CD1 4.02Å; L48-I52 WeakPolarHBondContact O-CG1 3.26Å; L48-I52 PolarHBondContact O-N 3.29Å; L48-L127 HydrophobicContact CB-CD1 4.09Å; L48-L127 HydrophobicContact CD1-CD1 3.67Å; L48-L127 HydrophobicContact CG-CD1 4.33Å; L48-V130 HydrophobicContact CD2-CG1 3.63Å; L48-I131 HydrophobicContact CD1-CD1 4.07Å; L48-I131 HydrophobicContact CD1-CG1 3.85Å; L48-I131 HydrophobicContact CD2-CG1 4.37Å
49I95.4Very high93.6Very high4 Ų442.6 Ų42.62%0.02121%0.213CC..Hα-helixtrans-62.4-39.3-178.4-62.2168.1000111.4T45 T46 I51 I52 L53 V103 A106 V107 E110 V130T45-I49 VanDerWaalsContact O-CG1 3.32Å; T45-I49 WeakPolarHBondContact O-CG1 3.37Å; T45-I49 PolarHBondContact O-N 3.36Å; T46-I49 PolarHBondContact O-N 2.95Å; I49-I51 VanDerWaalsContact C-N 3.34Å; I49-I51 PolarHBondContact O-N 3.41Å; I49-I52 PolarHBondContact O-N 3.23Å; I49-L53 WeakPolarHBondContact O-CB 3.45Å; I49-L53 PolarHBondContact O-N 3.47Å; I49-V103 HydrophobicContact CG2-CG1 3.92Å; I49-A106 HydrophobicContact CG2-CB 4.5Å; I49-V107 HydrophobicContact CB-CG2 4.44Å; I49-V107 HydrophobicContact CG2-CB 4.4Å; I49-V107 HydrophobicContact CG2-CG2 3.35Å; I49-E110 HydrophobicContact CD1-CB 3.91Å; I49-E110 HydrophobicContact CD1-CG 3.94Å; I49-V130 HydrophobicContact CD1-CG1 3.8Å; I49-V130 HydrophobicContact CD1-CG2 4.37Å; I49-V130 HydrophobicContact CG1-CG1 3.56Å
50I93.4Very high94.1Very high5 Ų540.8 Ų40.83%0.02620%0.204CC..Hα-helixtrans-66.5-36.7177.9-66.4170.4000111.7M36 T46 L48 L53 A54M36-I50 HydrophobicContact CB-CD1 4.09Å; M36-I50 HydrophobicContact CB-CG2 3.82Å; M36-I50 HydrophobicContact CE-CD1 3.47Å; M36-I50 VanDerWaalsContact CE-CD1 3.47Å; M36-I50 HydrophobicContact SD-CD1 4.22Å; M36-I50 HydrophobicContact SD-CG2 4.28Å; T46-I50 HydrophobicContact CG2-CD1 3.49Å; T46-I50 VanDerWaalsContact CG2-CD1 3.49Å; T46-I50 HydrophobicContact CG2-CG1 4.21Å; T46-I50 WeakPolarHBondContact O-CG1 3.19Å; T46-I50 PolarHBondContact O-N 3.34Å; L48-I50 VanDerWaalsContact C-N 3.32Å; L48-I50 PolarHBondContact O-N 2.95Å; I50-L53 WeakPolarHBondContact O-CB 3.47Å; I50-L53 PolarHBondContact O-N 3.39Å; I50-A54 PolarHBondContact O-N 3.27Å
51I97.1Very high94.7Very high68 Ų6831.5 Ų31.535%0.34916%0.164SC..Hα-helixtrans-63.9-45.8173.3-68.2164000110A33 R47 L48 I49 L53 A54 I55A33-I51 HydrophobicContact CB-CG1 4.41Å; R47-I51 WeakPolarHBondContact O-CD1 3.47Å; R47-I51 VanDerWaalsContact O-CG1 3.27Å; R47-I51 WeakPolarHBondContact O-CG1 3.29Å; R47-I51 PolarHBondContact O-N 2.89Å; R47-I51 VanDerWaalsContact O-N 3.15Å; L48-I51 PolarHBondContact O-N 2.92Å; I49-I51 VanDerWaalsContact C-N 3.34Å; I49-I51 PolarHBondContact O-N 3.41Å; I51-L53 VanDerWaalsContact C-N 3.27Å; I51-L53 PolarHBondContact O-N 3.33Å; I51-A54 PolarHBondContact O-N 3.38Å; I51-I55 HydrophobicContact CG2-CD1 3.98Å; I51-I55 WeakPolarHBondContact O-CG1 3.16Å; I51-I55 PolarHBondContact O-N 3.36Å
52I98Very high95.4Very high34 Ų3432.3 Ų32.317%0.17416%0.162CC..Hα-helixtrans-60.6-39.7176.2-64.3172.2000110.7L48 I49 I55 A56 F99 V103 M134L48-I52 HydrophobicContact CD2-CD1 3.46Å; L48-I52 VanDerWaalsContact CD2-CD1 3.46Å; L48-I52 HydrophobicContact CD2-CG1 4.46Å; L48-I52 HydrophobicContact CG-CD1 4.02Å; L48-I52 WeakPolarHBondContact O-CG1 3.26Å; L48-I52 PolarHBondContact O-N 3.29Å; I49-I52 PolarHBondContact O-N 3.23Å; I52-I55 PolarHBondContact O-N 3.4Å; I52-A56 WeakPolarHBondContact O-CB 3.23Å; I52-A56 PolarHBondContact O-N 3.15Å; I52-F99 HydrophobicContact CG2-CE1 3.73Å; I52-F99 HydrophobicContact CG2-CZ 3.73Å; I52-V103 HydrophobicContact CB-CG1 4.39Å; I52-V103 HydrophobicContact CG2-CG1 4.09Å; I52-V103 HydrophobicContact CG2-CG2 3.72Å; I52-M134 HydrophobicContact CD1-CB 4.45Å; I52-M134 HydrophobicContact CD1-CG 4.14Å; I52-M134 HydrophobicContact CG2-CE 4.34Å
53L96.4Very high96Very high3 Ų332.4 Ų32.42%0.01616%0.163CC..Hα-helixtrans-60.5-49.7177.8-177.360.4000110.8I49 I50 I51 I55 A56 D57 V103 L104 V107I49-L53 WeakPolarHBondContact O-CB 3.45Å; I49-L53 PolarHBondContact O-N 3.47Å; I50-L53 WeakPolarHBondContact O-CB 3.47Å; I50-L53 PolarHBondContact O-N 3.39Å; I51-L53 VanDerWaalsContact C-N 3.27Å; I51-L53 PolarHBondContact O-N 3.33Å; L53-I55 VanDerWaalsContact C-N 3.3Å; L53-I55 PolarHBondContact O-N 3.04Å; L53-A56 PolarHBondContact O-N 3.34Å; L53-A56 VanDerWaalsContact O-N 3.14Å; L53-D57 WeakPolarHBondContact O-CB 3.25Å; L53-D57 VanDerWaalsContact O-CG 3.29Å; L53-D57 PolarHBondContact O-N 2.64Å; L53-V103 HydrophobicContact CB-CG1 3.67Å; L53-V103 HydrophobicContact CD1-CB 4.11Å; L53-V103 HydrophobicContact CD1-CG1 3.98Å; L53-V103 HydrophobicContact CG-CG1 4.41Å; L53-L104 HydrophobicContact CD1-CB 4.29Å; L53-V107 HydrophobicContact CD2-CG2 4.41Å
54A97.9Very high96.4Very high7 Ų730.4 Ų30.46%0.05816%0.156CC..Hα-helixtrans-61.5-36.6177.700000113.1N29 A33 I50 I51 N58N29-A54 HydrophobicContact CB-CB 4.19Å; N29-A54 WeakPolarHBondContact O-CB 3.19Å; A33-A54 HydrophobicContact CB-CB 3.72Å; I50-A54 PolarHBondContact O-N 3.27Å; I51-A54 PolarHBondContact O-N 3.38Å; A54-N58 WeakPolarHBondContact O-CB 3.48Å; A54-N58 VanDerWaalsContact O-CG 3.3Å; A54-N58 PolarHBondContact O-N 2.93Å; A54-N58 PolarHBondContact O-ND2 2.93Å
55I98.2Very high96.7Very high94 Ų9426 Ų2648%0.48213%0.133SC..Hα-helixtrans-64.8-48.3173.5-67.2166.4000110I51 I52 L53 N58 L59I51-I55 HydrophobicContact CG2-CD1 3.98Å; I51-I55 WeakPolarHBondContact O-CG1 3.16Å; I51-I55 PolarHBondContact O-N 3.36Å; I52-I55 PolarHBondContact O-N 3.4Å; L53-I55 VanDerWaalsContact C-N 3.3Å; L53-I55 PolarHBondContact O-N 3.04Å; I55-N58 PolarHBondContact O-N 3.37Å; I55-L59 HydrophobicContact CG2-CD1 4.31Å; I55-L59 WeakPolarHBondContact O-CG 3.29Å; I55-L59 PolarHBondContact O-N 3.25Å
56A98.4Very high96.9Very high0 Ų028.3 Ų28.30%015%0.145CC..Hα-helixtrans-62.3-44.3-179.700000112I52 L53 N58 L59 V60 F99 A100 V103I52-A56 WeakPolarHBondContact O-CB 3.23Å; I52-A56 PolarHBondContact O-N 3.15Å; L53-A56 PolarHBondContact O-N 3.34Å; L53-A56 VanDerWaalsContact O-N 3.14Å; A56-N58 VanDerWaalsContact C-N 3.34Å; A56-N58 PolarHBondContact O-N 3.41Å; A56-L59 WeakPolarHBondContact O-CB 3.41Å; A56-L59 PolarHBondContact O-N 2.86Å; A56-V60 PolarHBondContact O-N 2.91Å; A56-F99 HydrophobicContact CB-CD1 3.61Å; A56-F99 HydrophobicContact CB-CE1 4.01Å; A56-A100 HydrophobicContact CB-CB 3.9Å; A56-V103 HydrophobicContact CB-CG2 4.36Å
57D98.1Very high97.1Very high3 Ų330 Ų302%0.01615%0.151CC..Hα-helixtrans-60.3-44.4175.5-71.4-31.1000111.3N29 L53 L59 V60 L61 N359 N362N29-D57 VanDerWaalsContact ND2-CB 3.31Å; N29-D57 WeakPolarHBondContact ND2-CB 3.47Å; L53-D57 WeakPolarHBondContact O-CB 3.25Å; L53-D57 VanDerWaalsContact O-CG 3.29Å; L53-D57 PolarHBondContact O-N 2.64Å; D57-L59 VanDerWaalsContact C-N 3.33Å; D57-L59 PolarHBondContact O-N 3.01Å; D57-V60 PolarHBondContact O-N 3.11Å; D57-V60 VanDerWaalsContact O-N 3.16Å; D57-L61 WeakPolarHBondContact O-CG 3.39Å; D57-L61 PolarHBondContact O-N 3.45Å; D57-N359 HydrophobicContact CB-CB 4.18Å; D57-N359 WeakPolarHBondContact CB-O 3.28Å; D57-N362 PolarHBondContact OD2-ND2 2.83Å
58N98.6Very high97.1Very high31 Ų3128.5 Ų28.517%0.16615%0.146CC..Hα-helixtrans-63.5-36.8175.3-79.2-14.6000112.8L26 N29 A54 I55 A56 V60 L61 L62L26-N58 WeakPolarHBondContact CA-OD1 3.16Å; L26-N58 HydrophobicContact CD2-CB 4.27Å; N29-N58 WeakPolarHBondContact CB-OD1 3.44Å; N29-N58 PolarHBondContact ND2-OD1 3.37Å; A54-N58 WeakPolarHBondContact O-CB 3.48Å; A54-N58 VanDerWaalsContact O-CG 3.3Å; A54-N58 PolarHBondContact O-N 2.93Å; A54-N58 PolarHBondContact O-ND2 2.93Å; I55-N58 PolarHBondContact O-N 3.37Å; A56-N58 VanDerWaalsContact C-N 3.34Å; A56-N58 PolarHBondContact O-N 3.41Å; N58-V60 VanDerWaalsContact C-N 3.3Å; N58-V60 PolarHBondContact O-N 2.92Å; N58-L61 PolarHBondContact O-N 3.49Å; N58-L62 WeakPolarHBondContact O-CB 3.37Å; N58-L62 VanDerWaalsContact O-CG 3.27Å; N58-L62 WeakPolarHBondContact O-CG 3.19Å; N58-L62 PolarHBondContact O-N 2.91Å
59L98.5Very high97Very high65 Ų6530 Ų3034%0.3415%0.149SC..Hα-helixtrans-61.7-39.6173.3-71.9172.6000111.5I55 A56 D57 L62 T63I55-L59 HydrophobicContact CG2-CD1 4.31Å; I55-L59 WeakPolarHBondContact O-CG 3.29Å; I55-L59 PolarHBondContact O-N 3.25Å; A56-L59 WeakPolarHBondContact O-CB 3.41Å; A56-L59 PolarHBondContact O-N 2.86Å; D57-L59 VanDerWaalsContact C-N 3.33Å; D57-L59 PolarHBondContact O-N 3.01Å; L59-L62 PolarHBondContact O-N 3.15Å; L59-T63 WeakPolarHBondContact O-CB 3.48Å; L59-T63 VanDerWaalsContact O-CG2 3.26Å; L59-T63 WeakPolarHBondContact O-CG2 3.1Å; L59-T63 PolarHBondContact O-N 3.32Å; L59-T63 PolarHBondContact O-OG1 3.13Å
60V98.5Very high97Very high0 Ų031 Ų310%015%0.154CC..Hα-helixtrans-65.8-42.7175.3175.50000111.3A56 D57 N58 T63 A64 V65 S96 T97 A100 F356 N359A56-V60 PolarHBondContact O-N 2.91Å; D57-V60 PolarHBondContact O-N 3.11Å; D57-V60 VanDerWaalsContact O-N 3.16Å; N58-V60 VanDerWaalsContact C-N 3.3Å; N58-V60 PolarHBondContact O-N 2.92Å; V60-T63 PolarHBondContact O-N 3Å; V60-A64 HydrophobicContact CG1-CB 4.23Å; V60-A64 WeakPolarHBondContact O-CA 3.24Å; V60-A64 VanDerWaalsContact O-CB 3.26Å; V60-A64 WeakPolarHBondContact O-CB 3.34Å; V60-A64 PolarHBondContact O-N 3.26Å; V60-V65 PolarHBondContact O-N 3.21Å; V60-S96 VanDerWaalsContact CG2-O 3.24Å; V60-S96 WeakPolarHBondContact CG2-O 3.41Å; V60-T97 HydrophobicContact CG1-CG2 3.89Å; V60-T97 HydrophobicContact CG2-CG2 3.94Å; V60-A100 HydrophobicContact CG2-CB 4Å; V60-F356 HydrophobicContact CG1-CD1 3.6Å; V60-F356 HydrophobicContact CG1-CE1 3.82Å; V60-N359 VanDerWaalsContact CB-ND2 3.29Å; V60-N359 WeakPolarHBondContact CB-ND2 3.34Å; V60-N359 HydrophobicContact CG1-CB 4.48Å; V60-N359 VanDerWaalsContact CG1-ND2 3.35Å; V60-N359 WeakPolarHBondContact CG1-ND2 3.07Å; V60-N359 VanDerWaalsContact CG2-ND2 3.31Å; V60-N359 WeakPolarHBondContact CG2-ND2 3.41Å
61L98.6Very high97Very high0 Ų032.6 Ų32.60%016%0.162CC..Iπ-helixtrans-62.4-45176.6-64.9-179.9000111.5L22 G25 L26 D57 N58 V65 L66 A360L22-L61 HydrophobicContact CD2-CB 4.12Å; L22-L61 WeakPolarHBondContact CD2-O 3.48Å; G25-L61 VanDerWaalsContact C-CD1 3.47Å; L26-L61 HydrophobicContact CD2-CB 3.8Å; L26-L61 HydrophobicContact CD2-CD1 4.04Å; L26-L61 HydrophobicContact CG-CB 4.44Å; L26-L61 HydrophobicContact CG-CD1 4.26Å; D57-L61 WeakPolarHBondContact O-CG 3.39Å; D57-L61 PolarHBondContact O-N 3.45Å; N58-L61 PolarHBondContact O-N 3.49Å; L61-V65 HydrophobicContact CD2-CB 4.34Å; L61-V65 HydrophobicContact CD2-CG2 3.75Å; L61-V65 WeakPolarHBondContact O-CB 3.44Å; L61-V65 PolarHBondContact O-N 3.05Å; L61-L66 PolarHBondContact O-N 3.34Å; L61-A360 HydrophobicContact CD1-CB 4.5Å; L61-A360 HydrophobicContact CD2-CB 4.15Å
62L98.2Very high96.6Very high87 Ų8731.7 Ų31.746%0.45516%0.156SC..Iπ-helixtrans-73.3-25.8-178.6-70.9172.6000114L26 N58 L59 L66L26-L62 HydrophobicContact CD1-CD2 4.13Å; L26-L62 HydrophobicContact CD2-CD2 4.05Å; L26-L62 HydrophobicContact CD2-CG 3.91Å; N58-L62 WeakPolarHBondContact O-CB 3.37Å; N58-L62 VanDerWaalsContact O-CG 3.27Å; N58-L62 WeakPolarHBondContact O-CG 3.19Å; N58-L62 PolarHBondContact O-N 2.91Å; L59-L62 PolarHBondContact O-N 3.15Å; L62-L66 WeakPolarHBondContact O-CB 3.47Å; L62-L66 VanDerWaalsContact O-CD2 3.29Å; L62-L66 WeakPolarHBondContact O-CD2 3.41Å
63T97.7Very high96.3Very high26 Ų2632.3 Ų32.316%0.1616%0.162CC..Iπ-helixtrans-99.5-46.5-179.759.20000112.2L59 V60 H89 A92 S96L59-T63 WeakPolarHBondContact O-CB 3.48Å; L59-T63 VanDerWaalsContact O-CG2 3.26Å; L59-T63 WeakPolarHBondContact O-CG2 3.1Å; L59-T63 PolarHBondContact O-N 3.32Å; L59-T63 PolarHBondContact O-OG1 3.13Å; V60-T63 PolarHBondContact O-N 3Å; T63-H89 PolarHBondContact O-CE1 3.32Å; T63-H89 PolarHBondContact O-NE2 3.03Å; T63-A92 HydrophobicContact CG2-CB 3.96Å; T63-S96 PolarHBondContact OG1-OG 3.14Å
64A97Very high96.1Very high3 Ų335.7 Ų35.73%0.02518%0.184CC..Iπ-helixtrans-90.1-59.8-17400000111.6V60 L66 R67 Y68 V93 F356V60-A64 HydrophobicContact CG1-CB 4.23Å; V60-A64 WeakPolarHBondContact O-CA 3.24Å; V60-A64 VanDerWaalsContact O-CB 3.26Å; V60-A64 WeakPolarHBondContact O-CB 3.34Å; V60-A64 PolarHBondContact O-N 3.26Å; A64-L66 VanDerWaalsContact C-N 3.34Å; A64-L66 PolarHBondContact O-N 3.48Å; A64-R67 WeakPolarHBondContact O-CB 3.47Å; A64-R67 PolarHBondContact O-N 2.98Å; A64-R67 VanDerWaalsContact O-N 3.13Å; A64-Y68 VanDerWaalsContact O-CD2 3.26Å; A64-Y68 WeakPolarHBondContact O-CD2 3.12Å; A64-Y68 PolarHBondContact O-N 3.45Å; A64-V93 HydrophobicContact CB-CG1 4.03Å; A64-V93 HydrophobicContact CB-CG2 4.1Å; A64-F356 HydrophobicContact CB-CD1 4.3Å; A64-F356 HydrophobicContact CB-CE1 3.57Å; A64-F356 HydrophobicContact CB-CE2 4Å; A64-F356 HydrophobicContact CB-CZ 3.41Å; A64-F356 VanDerWaalsContact CB-CZ 3.41Å
65V97.2Very high95.8Very high0 Ų038.6 Ų38.60%022%0.216CC..Iπ-helixtrans-65.2-39.7-175.8-177.60000111.2A18 L21 L22 V60 L61 R67 Y68 W69 F356A18-V65 HydrophobicContact CB-CG1 4.38Å; L21-V65 HydrophobicContact CB-CG1 4.01Å; L21-V65 HydrophobicContact CD1-CG1 4.27Å; L21-V65 HydrophobicContact CD1-CG2 4.48Å; L22-V65 HydrophobicContact CD2-CB 4.11Å; L22-V65 HydrophobicContact CD2-CG1 4Å; L22-V65 HydrophobicContact CG-CG1 3.91Å; V60-V65 PolarHBondContact O-N 3.21Å; L61-V65 HydrophobicContact CD2-CB 4.34Å; L61-V65 HydrophobicContact CD2-CG2 3.75Å; L61-V65 WeakPolarHBondContact O-CB 3.44Å; L61-V65 PolarHBondContact O-N 3.05Å; V65-R67 PolarHBondContact O-N 2.88Å; V65-Y68 PolarHBondContact O-N 3.44Å; V65-Y68 VanDerWaalsContact O-N 3.11Å; V65-W69 PolarHBondContact O-N 2.98Å; V65-F356 HydrophobicContact CG2-CB 3.59Å; V65-F356 HydrophobicContact CG2-CD1 4.42Å; V65-F356 HydrophobicContact CG2-CD2 3.91Å; V65-F356 HydrophobicContact CG2-CG 3.73Å
66L97Very high95.5Very high54 Ų5439.9 Ų39.928%0.28321%0.214SC..Hα-helixtrans-57.5-35.4175.7-175.160.6000112.3L22 L61 L62 A64 W69 L70L22-L66 HydrophobicContact CD1-CD1 4.14Å; L61-L66 PolarHBondContact O-N 3.34Å; L62-L66 WeakPolarHBondContact O-CB 3.47Å; L62-L66 VanDerWaalsContact O-CD2 3.29Å; L62-L66 WeakPolarHBondContact O-CD2 3.41Å; A64-L66 VanDerWaalsContact C-N 3.34Å; A64-L66 PolarHBondContact O-N 3.48Å; L66-W69 HydrophobicContact CD1-CE3 4.13Å; L66-W69 PolarHBondContact O-N 3.22Å; L66-L70 HydrophobicContact CD1-CG 4.3Å; L66-L70 HydrophobicContact CG-CD1 4.07Å; L66-L70 HydrophobicContact CG-CG 4.3Å; L66-L70 WeakPolarHBondContact O-CB 3.29Å; L66-L70 VanDerWaalsContact O-CG 3.26Å; L66-L70 WeakPolarHBondContact O-CG 3.22Å; L66-L70 PolarHBondContact O-N 3.12Å
67R95.3Very high95.2Very high37 Ų3741.5 Ų41.514%0.1422%0.223CC..Hα-helixtrans-61.9-48.7174.7177.3175.9173-124.7-0.6111.7A64 V65 W69 L70 M71 D77 R79 H89A64-R67 WeakPolarHBondContact O-CB 3.47Å; A64-R67 PolarHBondContact O-N 2.98Å; A64-R67 VanDerWaalsContact O-N 3.13Å; V65-R67 PolarHBondContact O-N 2.88Å; R67-W69 VanDerWaalsContact C-N 3.26Å; R67-W69 PolarHBondContact O-N 3.3Å; R67-L70 PolarHBondContact O-N 2.98Å; R67-M71 HydrophobicContact CG-CG 4.4Å; R67-M71 HydrophobicContact CG-SD 3.86Å; R67-M71 WeakPolarHBondContact O-CB 3.34Å; R67-M71 VanDerWaalsContact O-CG 3.23Å; R67-M71 WeakPolarHBondContact O-CG 3.36Å; R67-M71 PolarHBondContact O-N 3.49Å; R67-D77 IonicContact CZ-OD1 2.8Å; R67-D77 IonicContact CZ-OD2 3.22Å; R67-D77 IonicContact NE-OD1 3.66Å; R67-D77 PolarHBondContact NE-OD1 3.04Å; R67-D77 IonicContact NE-OD2 2.69Å; R67-D77 IonicContact NH2-OD1 3.67Å; R67-D77 PolarHBondContact NH2-OD1 2.83Å; R67-D77 IonicContact NH2-OD2 2.89Å; R67-D77 PolarHBondContact NH2-OD2 3.46Å; R67-R79 VanDerWaalsContact CZ-CD 3.43Å; R67-H89 WeakPolarHBondContact CD-CE1 3.29Å
68Y93.2Very high95Very high38 Ų3843.6 Ų43.615%0.14923%0.234CC..Hα-helixtrans-61.9-38.8177.3-70.6-83.2000111.4A64 V65 M71 E72 Y349 V352 M353 F356A64-Y68 VanDerWaalsContact O-CD2 3.26Å; A64-Y68 WeakPolarHBondContact O-CD2 3.12Å; A64-Y68 PolarHBondContact O-N 3.45Å; V65-Y68 PolarHBondContact O-N 3.44Å; V65-Y68 VanDerWaalsContact O-N 3.11Å; Y68-M71 PolarHBondContact O-N 3Å; Y68-E72 WeakPolarHBondContact O-CG 3.38Å; Y68-E72 PolarHBondContact O-N 3.37Å; Y68-Y349 AromaticContact CD1-CD1 3.92Å; Y68-Y349 HydrophobicContact CD1-CD1 3.92Å; Y68-Y349 AromaticContact CD1-CE1 3.88Å; Y68-Y349 HydrophobicContact CD1-CE1 3.88Å; Y68-Y349 AromaticContact CE1-CD1 3.54Å; Y68-Y349 HydrophobicContact CE1-CD1 3.54Å; Y68-Y349 AromaticContact CE1-CE1 3.44Å; Y68-Y349 HydrophobicContact CE1-CE1 3.44Å; Y68-Y349 VanDerWaalsContact CE1-CE1 3.44Å; Y68-V352 HydrophobicContact CE2-CG1 4.11Å; Y68-M353 HydrophobicContact CD2-SD 4.43Å; Y68-M353 HydrophobicContact CG-SD 4.24Å; Y68-F356 HydrophobicContact CD2-CE2 4.24Å; Y68-F356 AromaticContact CE2-CE2 3.74Å; Y68-F356 HydrophobicContact CE2-CE2 3.74Å
69W95.4Very high94.8Very high71 Ų7143.9 Ų43.927%0.26923%0.233SC..Hα-helixtrans-62.2-48.2174.9-17391.1000112A18 S19 L22 V65 L66 R67 M71 E72 V73A18-W69 HydrophobicContact CB-CB 4.12Å; S19-W69 VanDerWaalsContact OG-CD1 3.3Å; S19-W69 PolarHBondContact OG-NE1 2.94Å; L22-W69 HydrophobicContact CD1-CB 3.79Å; L22-W69 HydrophobicContact CD1-CD2 4.37Å; L22-W69 HydrophobicContact CD1-CG 3.73Å; V65-W69 PolarHBondContact O-N 2.98Å; L66-W69 HydrophobicContact CD1-CE3 4.13Å; L66-W69 PolarHBondContact O-N 3.22Å; R67-W69 VanDerWaalsContact C-N 3.26Å; R67-W69 PolarHBondContact O-N 3.3Å; W69-M71 VanDerWaalsContact C-N 3.32Å; W69-M71 PolarHBondContact O-N 3.45Å; W69-E72 PolarHBondContact O-N 3.4Å; W69-V73 HydrophobicContact CD2-CB 4.21Å; W69-V73 HydrophobicContact CD2-CG2 3.93Å; W69-V73 HydrophobicContact CE3-CB 4.46Å; W69-V73 HydrophobicContact CG-CG2 4.03Å; W69-V73 HydrophobicContact CH2-CB 4.42Å; W69-V73 HydrophobicContact CH2-CG1 4.01Å; W69-V73 HydrophobicContact CZ2-CB 4.18Å; W69-V73 HydrophobicContact CZ2-CG1 3.79Å; W69-V73 HydrophobicContact CZ2-CG2 4.15Å; W69-V73 WeakPolarHBondContact O-CB 3.04Å; W69-V73 VanDerWaalsContact O-CG2 3.25Å; W69-V73 WeakPolarHBondContact O-CG2 3.35Å; W69-V73 PolarHBondContact O-N 3.37Å
70L95.3Very high94.5Very high25 Ų2543.2 Ų43.213%0.13123%0.233CC..Hα-helixtrans-61.4-40.2177.4-71.6169000111.9L66 R67 C74 G75 W76L66-L70 HydrophobicContact CD1-CG 4.3Å; L66-L70 HydrophobicContact CG-CD1 4.07Å; L66-L70 HydrophobicContact CG-CG 4.3Å; L66-L70 WeakPolarHBondContact O-CB 3.29Å; L66-L70 VanDerWaalsContact O-CG 3.26Å; L66-L70 WeakPolarHBondContact O-CG 3.22Å; L66-L70 PolarHBondContact O-N 3.12Å; R67-L70 PolarHBondContact O-N 2.98Å; L70-C74 CarbonylContact O-C 3.45Å; L70-C74 WeakPolarHBondContact O-CA 3.46Å; L70-C74 VanDerWaalsContact O-CB 3.26Å; L70-C74 WeakPolarHBondContact O-CB 3.3Å; L70-C74 PolarHBondContact O-N 3.4Å; L70-G75 PolarHBondContact O-N 3.38Å; L70-G75 VanDerWaalsContact O-N 3.14Å; L70-W76 CarbonylContact C-O 3.57Å; L70-W76 WeakPolarHBondContact CB-O 3.49Å; L70-W76 HydrophobicContact CD1-CE3 4.48Å; L70-W76 HydrophobicContact CD2-CE3 4.33Å; L70-W76 PolarHBondContact O-N 3.42Å; L70-W76 VanDerWaalsContact O-N 3.13Å
71M92.1Very high94.1Very high39 Ų3947 Ų4719%0.19226%0.256CS..Hα-helixtrans-63-48178-72.6174.767.900111.9R67 Y68 W69 G75 W76 D77R67-M71 HydrophobicContact CG-CG 4.4Å; R67-M71 HydrophobicContact CG-SD 3.86Å; R67-M71 WeakPolarHBondContact O-CB 3.34Å; R67-M71 VanDerWaalsContact O-CG 3.23Å; R67-M71 WeakPolarHBondContact O-CG 3.36Å; R67-M71 PolarHBondContact O-N 3.49Å; Y68-M71 PolarHBondContact O-N 3Å; W69-M71 VanDerWaalsContact C-N 3.32Å; W69-M71 PolarHBondContact O-N 3.45Å; M71-G75 WeakPolarHBondContact O-CA 3.44Å; M71-G75 PolarHBondContact O-N 2.86Å; M71-W76 PolarHBondContact N-O 2.94Å; M71-D77 HydrophobicContact CE-CB 4.37Å; M71-D77 HydrophobicContact CG-CB 3.78Å; M71-D77 HydrophobicContact SD-CB 4.13Å
72E89.2Confident93.8Very high49 Ų4947.5 Ų47.523%0.22926%0.262CS..Hα-helixtrans-87.5-26.5-173.6-62.4-55.7140.300114K11 I14 K15 Y68 W69K11-E72 WeakPolarHBondContact CG-OE2 3.41Å; I14-E72 HydrophobicContact CB-CG 4.39Å; I14-E72 HydrophobicContact CG2-CG 3.82Å; K15-E72 HydrophobicContact CB-CB 4.28Å; Y68-E72 WeakPolarHBondContact O-CG 3.38Å; Y68-E72 PolarHBondContact O-N 3.37Å; W69-E72 PolarHBondContact O-N 3.4Å
73V92.1Very high93.5Very high47 Ų4746.9 Ų46.929%0.28526%0.263SS..Hα-helixtrans-93.4-47.1-178.7-179.50000111.2K15 W69K15-V73 HydrophobicContact CD-CG2 4.18Å; K15-V73 HydrophobicContact CG-CG2 3.67Å; W69-V73 HydrophobicContact CD2-CB 4.21Å; W69-V73 HydrophobicContact CD2-CG2 3.93Å; W69-V73 HydrophobicContact CE3-CB 4.46Å; W69-V73 HydrophobicContact CG-CG2 4.03Å; W69-V73 HydrophobicContact CH2-CB 4.42Å; W69-V73 HydrophobicContact CH2-CG1 4.01Å; W69-V73 HydrophobicContact CZ2-CB 4.18Å; W69-V73 HydrophobicContact CZ2-CG1 3.79Å; W69-V73 HydrophobicContact CZ2-CG2 4.15Å; W69-V73 WeakPolarHBondContact O-CB 3.04Å; W69-V73 VanDerWaalsContact O-CG2 3.25Å; W69-V73 WeakPolarHBondContact O-CG2 3.35Å; W69-V73 PolarHBondContact O-N 3.37Å
74C92.6Very high93.3Very high73 Ų7351 Ų5149%0.49328%0.284SS..Hα-helixtrans-98.2-9.1-175.5-56.80000112.8L70 W76L70-C74 CarbonylContact O-C 3.45Å; L70-C74 WeakPolarHBondContact O-CA 3.46Å; L70-C74 VanDerWaalsContact O-CB 3.26Å; L70-C74 WeakPolarHBondContact O-CB 3.3Å; L70-C74 PolarHBondContact O-N 3.4Å; C74-W76 HydrophobicContact CB-CB 4.37Å; C74-W76 PolarHBondContact O-N 3.21Å
75G90.3Very high93.1Very high69 Ų6953.2 Ų53.271%0.71130%0.297SS*.SBendtrans68.417.4-173.700000113.2L70 M71L70-G75 PolarHBondContact O-N 3.38Å; L70-G75 VanDerWaalsContact O-N 3.14Å; M71-G75 WeakPolarHBondContact O-CA 3.44Å; M71-G75 PolarHBondContact O-N 2.86Å
76W92.2Very high93.1Very high120 Ų12053.2 Ų53.246%0.45530%0.297SS..  trans-118.8116.8-173.1-178.344.4000111.5L70 M71 C74 L78 T81L70-W76 CarbonylContact C-O 3.57Å; L70-W76 WeakPolarHBondContact CB-O 3.49Å; L70-W76 HydrophobicContact CD1-CE3 4.48Å; L70-W76 HydrophobicContact CD2-CE3 4.33Å; L70-W76 PolarHBondContact O-N 3.42Å; L70-W76 VanDerWaalsContact O-N 3.13Å; M71-W76 PolarHBondContact N-O 2.94Å; C74-W76 HydrophobicContact CB-CB 4.37Å; C74-W76 PolarHBondContact O-N 3.21Å; W76-L78 HydrophobicContact CH2-CD1 3.87Å; W76-L78 HydrophobicContact CZ2-CD1 4.01Å; W76-T81 WeakPolarHBondContact CZ2-OG1 3.39Å; W76-T81 PolarHBondContact NE1-OG1 3.33Å
77D93.1Very high93.1Very high34 Ų3452.9 Ų52.918%0.18229%0.293CS..  trans-89.3112.7168-171.6-5.3000109.7R67 M71 R79 S80R67-D77 IonicContact CZ-OD1 2.8Å; R67-D77 IonicContact CZ-OD2 3.22Å; R67-D77 IonicContact NE-OD1 3.66Å; R67-D77 PolarHBondContact NE-OD1 3.04Å; R67-D77 IonicContact NE-OD2 2.69Å; R67-D77 IonicContact NH2-OD1 3.67Å; R67-D77 PolarHBondContact NH2-OD1 2.83Å; R67-D77 IonicContact NH2-OD2 2.89Å; R67-D77 PolarHBondContact NH2-OD2 3.46Å; M71-D77 HydrophobicContact CE-CB 4.37Å; M71-D77 HydrophobicContact CG-CB 3.78Å; M71-D77 HydrophobicContact SD-CB 4.13Å; D77-R79 PolarHBondContact O-N 3.14Å; D77-R79 WeakPolarHBondContact OD1-CB 3.26Å; D77-R79 PolarHBondContact OD1-N 2.97Å; D77-S80 WeakPolarHBondContact O-CB 3.48Å; D77-S80 PolarHBondContact O-N 3.4Å; D77-S80 PolarHBondContact O-OG 3.46Å
78L92.9Very high93.1Very high47 Ų4756 Ų5625%0.24631%0.311CS..G310 helixtrans-50.9-32.9175.2-177.151.8000112.4W76 S80 T81 T85 H89W76-L78 HydrophobicContact CH2-CD1 3.87Å; W76-L78 HydrophobicContact CZ2-CD1 4.01Å; L78-S80 VanDerWaalsContact C-N 3.31Å; L78-S80 PolarHBondContact O-N 3.31Å; L78-T81 PolarHBondContact O-N 3.45Å; L78-T81 PolarHBondContact O-OG1 2.97Å; L78-T85 HydrophobicContact CD1-CG2 3.68Å; L78-T85 HydrophobicContact CG-CG2 4.02Å; L78-T85 WeakPolarHBondContact O-CG2 3.19Å; L78-H89 WeakPolarHBondContact CD2-CD2 3.3Å
79R94.3Very high93.3Very high38 Ų3855 Ų5514%0.14331%0.307CS..G310 helixtrans-74.8-13.8178.2-63-168.7-173.6170.4-4.3114.5R67 D77 C86 H89 F195 C197R67-R79 VanDerWaalsContact CZ-CD 3.43Å; D77-R79 PolarHBondContact O-N 3.14Å; D77-R79 WeakPolarHBondContact OD1-CB 3.26Å; D77-R79 PolarHBondContact OD1-N 2.97Å; R79-C86 HydrophobicContact CB-CB 4.45Å; R79-H89 HydrophobicContact CG-CB 4.14Å; R79-H89 PolarHBondContact NE-ND1 3.35Å; R79-H89 VanDerWaalsContact NE-ND1 3.13Å; R79-H89 PolarHBondContact NH2-ND1 3Å; R79-F195 WeakPolarHBondContact O-CE1 3.49Å; R79-C197 HydrophobicContact CB-CB 3.77Å
80S91.8Very high93.4Very high50 Ų5051.7 Ų51.735%0.3530%0.295SS..G310 helixtrans-85-14.7177.368.50000113.6D77 L78 G82D77-S80 WeakPolarHBondContact O-CB 3.48Å; D77-S80 PolarHBondContact O-N 3.4Å; D77-S80 PolarHBondContact O-OG 3.46Å; L78-S80 VanDerWaalsContact C-N 3.31Å; L78-S80 PolarHBondContact O-N 3.31Å; S80-G82 VanDerWaalsContact C-N 3.27Å; S80-G82 PolarHBondContact O-N 3.42Å
81T91.3Very high93.5Very high79 Ų7953 Ų5349%0.48530%0.3SS..SBendtrans-61.8-32.2-176.6-46.90000113.3W76 L78W76-T81 WeakPolarHBondContact CZ2-OG1 3.39Å; W76-T81 PolarHBondContact NE1-OG1 3.33Å; L78-T81 PolarHBondContact O-N 3.45Å; L78-T81 PolarHBondContact O-OG1 2.97Å
82G91.1Very high93.8Very high12 Ų1252.6 Ų52.612%0.12430%0.303CS..  trans169.5170.517900000114S80 L84 T85 C86S80-G82 VanDerWaalsContact C-N 3.27Å; S80-G82 PolarHBondContact O-N 3.42Å; G82-L84 PolarHBondContact O-N 2.84Å; G82-T85 PolarHBondContact O-N 2.84Å; G82-C86 WeakPolarHBondContact O-CB 3.37Å; G82-C86 PolarHBondContact O-N 3.28Å
83P92.1Very high94.2Very high73 Ų7351.3 Ų51.347%0.47430%0.298SS..Hα-helixtrans-63.6-42.5-173.723.3-33.1000113.4K87 F195P83-K87 WeakPolarHBondContact O-CG 3.22Å; P83-K87 PolarHBondContact O-N 3.11Å; P83-K87 VanDerWaalsContact O-N 3.12Å; P83-F195 VanDerWaalsContact CA-CZ 3.44Å; P83-F195 HydrophobicContact CB-CE2 3.88Å; P83-F195 HydrophobicContact CB-CZ 4.02Å
84L93.2Very high94.4Very high114 Ų11449.5 Ų49.560%0.59729%0.289SS*.Hα-helixtrans-66.4-44.7178.6-178.261.1000111.4G82 C86 K87 M88G82-L84 PolarHBondContact O-N 2.84Å; L84-C86 VanDerWaalsContact C-N 3.35Å; L84-C86 PolarHBondContact O-N 3.32Å; L84-K87 PolarHBondContact O-N 3.41Å; L84-M88 HydrophobicContact CD1-CG 3.97Å; L84-M88 HydrophobicContact CG-CG 4.2Å; L84-M88 WeakPolarHBondContact O-CB 2.98Å; L84-M88 WeakPolarHBondContact O-CG 3.43Å; L84-M88 PolarHBondContact O-N 3.38Å
85T94.5Very high94.7Very high49 Ų4948.3 Ų48.330%0.30128%0.275SS..Hα-helixtrans-61.4-43178.7-50.10000111.6L78 G82 H89L78-T85 HydrophobicContact CD1-CG2 3.68Å; L78-T85 HydrophobicContact CG-CG2 4.02Å; L78-T85 WeakPolarHBondContact O-CG2 3.19Å; G82-T85 PolarHBondContact O-N 2.84Å; T85-H89 WeakPolarHBondContact O-CB 3.45Å; T85-H89 PolarHBondContact O-N 3.41Å
86C95.9Very high95.1Very high0 Ų045.1 Ų45.10%024%0.242CC..Hα-helixtrans-54.7-54.6172.1159.40000111.6R79 G82 L84 H89 V90 F195 C197R79-C86 HydrophobicContact CB-CB 4.45Å; G82-C86 WeakPolarHBondContact O-CB 3.37Å; G82-C86 PolarHBondContact O-N 3.28Å; L84-C86 VanDerWaalsContact C-N 3.35Å; L84-C86 PolarHBondContact O-N 3.32Å; C86-H89 PolarHBondContact O-N 2.94Å; C86-V90 WeakPolarHBondContact O-CB 3.45Å; C86-V90 WeakPolarHBondContact O-CG2 3.41Å; C86-V90 PolarHBondContact O-N 3.43Å; C86-F195 HydrophobicContact CB-CE1 3.81Å; C86-F195 HydrophobicContact CB-CZ 4.07Å; C86-C197 HydrophobicContact CB-CB 3.68Å; C86-C197 WeakPolarHBondContact CB-SG 3.38Å; C86-C197 WeakPolarHBondContact SG-CB 3.41Å; C86-C197 CovalentContact SG-SG 2.02Å; C86-C197 PolarHBondContact SG-SG 3.48Å
87K96.4Very high95.3Very high47 Ų4740.3 Ų40.320%0.20423%0.226CC..Hα-helixtrans-61.1-49.2-178.8-67.8173.2-179.8-92.30111.9P83 L84 H89 V90 F91 F149 W150 M152P83-K87 WeakPolarHBondContact O-CG 3.22Å; P83-K87 PolarHBondContact O-N 3.11Å; P83-K87 VanDerWaalsContact O-N 3.12Å; L84-K87 PolarHBondContact O-N 3.41Å; K87-H89 PolarHBondContact O-N 2.98Å; K87-V90 PolarHBondContact O-N 2.8Å; K87-F91 WeakPolarHBondContact O-CB 3.34Å; K87-F91 PolarHBondContact O-N 3.4Å; K87-F149 VanDerWaalsContact C-CD2 3.49Å; K87-F149 HydrophobicContact CB-CD2 3.58Å; K87-F149 HydrophobicContact CB-CE2 3.39Å; K87-F149 HydrophobicContact CB-CG 4.22Å; K87-F149 HydrophobicContact CB-CZ 3.91Å; K87-F149 HydrophobicContact CD-CE1 4.35Å; K87-F149 HydrophobicContact CD-CE2 4.49Å; K87-F149 HydrophobicContact CD-CZ 4.17Å; K87-F149 WeakPolarHBondContact O-CD2 3.4Å; K87-W150 PolarHBondContact NZ-O 2.91Å; K87-M152 WeakPolarHBondContact CE-O 3.24Å; K87-M152 VanDerWaalsContact CG-O 3.3Å; K87-M152 WeakPolarHBondContact CG-O 3.31Å; K87-M152 PolarHBondContact NZ-O 3.43Å
88M96.8Very high95.5Very high102 Ų10239.3 Ų39.350%0.50222%0.221SC..Hα-helixtrans-61-43.4179.7-72.6-59.5-66.100112L84 F91 A92 F149L84-M88 HydrophobicContact CD1-CG 3.97Å; L84-M88 HydrophobicContact CG-CG 4.2Å; L84-M88 WeakPolarHBondContact O-CB 2.98Å; L84-M88 WeakPolarHBondContact O-CG 3.43Å; L84-M88 PolarHBondContact O-N 3.38Å; M88-F91 PolarHBondContact O-N 3.07Å; M88-A92 WeakPolarHBondContact O-CB 3.44Å; M88-A92 PolarHBondContact O-N 3.43Å; M88-F149 HydrophobicContact CG-CE2 4.15Å; M88-F149 HydrophobicContact SD-CD2 4.38Å; M88-F149 HydrophobicContact SD-CE2 3.61Å; M88-F149 HydrophobicContact SD-CZ 4.41Å
89H97.6Very high95.8Very high16 Ų1638.2 Ų38.27%0.07421%0.214CC..Hα-helixtrans-68.6-39.8178.9-174.5-60.4000112.2T63 R67 L78 R79 T85 C86 K87 F91 A92 V93T63-H89 PolarHBondContact O-CE1 3.32Å; T63-H89 PolarHBondContact O-NE2 3.03Å; R67-H89 WeakPolarHBondContact CD-CE1 3.29Å; L78-H89 WeakPolarHBondContact CD2-CD2 3.3Å; R79-H89 HydrophobicContact CG-CB 4.14Å; R79-H89 PolarHBondContact NE-ND1 3.35Å; R79-H89 VanDerWaalsContact NE-ND1 3.13Å; R79-H89 PolarHBondContact NH2-ND1 3Å; T85-H89 WeakPolarHBondContact O-CB 3.45Å; T85-H89 PolarHBondContact O-N 3.41Å; C86-H89 PolarHBondContact O-N 2.94Å; K87-H89 PolarHBondContact O-N 2.98Å; H89-F91 VanDerWaalsContact C-N 3.34Å; H89-A92 PolarHBondContact O-N 3.44Å; H89-V93 WeakPolarHBondContact CE1-CG2 3.34Å; H89-V93 WeakPolarHBondContact O-CG2 3.42Å; H89-V93 PolarHBondContact O-N 3.35Å
90V96.5Very high95.9Very high3 Ų336.5 Ų36.52%0.01821%0.208CC..Hα-helixtrans-63.6-44.7177.51730000110.2C86 K87 V93 G94 H148 M152C86-V90 WeakPolarHBondContact O-CB 3.45Å; C86-V90 WeakPolarHBondContact O-CG2 3.41Å; C86-V90 PolarHBondContact O-N 3.43Å; K87-V90 PolarHBondContact O-N 2.8Å; V90-V93 PolarHBondContact O-N 3.25Å; V90-G94 PolarHBondContact O-N 2.74Å; V90-H148 WeakPolarHBondContact CG1-CE1 3.11Å; V90-H148 WeakPolarHBondContact CG1-ND1 3.33Å; V90-H148 WeakPolarHBondContact CG1-NE2 3.33Å; V90-M152 HydrophobicContact CB-CG 4.31Å; V90-M152 HydrophobicContact CG1-CG 3.87Å; V90-M152 HydrophobicContact CG2-CE 3.84Å; V90-M152 HydrophobicContact CG2-CG 4.28Å
91F98Very high96.1Very high53 Ų5334.6 Ų34.623%0.23219%0.194CC..Hα-helixtrans-56.4-50.5172.4175.4-94.1000112.1K87 M88 H89 V93 G94 F95 A142 N145 F149K87-F91 WeakPolarHBondContact O-CB 3.34Å; K87-F91 PolarHBondContact O-N 3.4Å; M88-F91 PolarHBondContact O-N 3.07Å; H89-F91 VanDerWaalsContact C-N 3.34Å; F91-V93 VanDerWaalsContact C-N 3.33Å; F91-V93 PolarHBondContact O-N 3.21Å; F91-G94 PolarHBondContact O-N 2.97Å; F91-F95 HydrophobicContact CE1-CB 4.3Å; F91-F95 HydrophobicContact CZ-CB 4.4Å; F91-F95 HydrophobicContact CZ-CD2 4.48Å; F91-F95 VanDerWaalsContact O-CB 3.26Å; F91-F95 WeakPolarHBondContact O-CB 3.48Å; F91-F95 PolarHBondContact O-N 2.83Å; F91-A142 HydrophobicContact CZ-CB 4.28Å; F91-N145 HydrophobicContact CD2-CB 3.85Å; F91-N145 HydrophobicContact CE2-CB 3.93Å; F91-F149 HydrophobicContact CB-CB 4.16Å; F91-F149 HydrophobicContact CB-CD2 4.06Å; F91-F149 HydrophobicContact CD2-CB 4.28Å
92A98.3Very high96.4Very high30 Ų3031.5 Ų31.525%0.24818%0.178CC..Hα-helixtrans-62-39.5-176.800000112.6T63 M88 H89 S96T63-A92 HydrophobicContact CG2-CB 3.96Å; M88-A92 WeakPolarHBondContact O-CB 3.44Å; M88-A92 PolarHBondContact O-N 3.43Å; H89-A92 PolarHBondContact O-N 3.44Å; A92-S96 VanDerWaalsContact O-CB 3.25Å; A92-S96 WeakPolarHBondContact O-CB 3.3Å; A92-S96 PolarHBondContact O-N 3.42Å; A92-S96 PolarHBondContact O-OG 2.87Å
93V97.7Very high96.7Very high21 Ų2130.9 Ų30.913%0.12717%0.172CC..Hα-helixtrans-64.4-53.4174.5170.50000110.4A64 H89 V90 F91 F95 S96 T97A64-V93 HydrophobicContact CB-CG1 4.03Å; A64-V93 HydrophobicContact CB-CG2 4.1Å; H89-V93 WeakPolarHBondContact CE1-CG2 3.34Å; H89-V93 WeakPolarHBondContact O-CG2 3.42Å; H89-V93 PolarHBondContact O-N 3.35Å; V90-V93 PolarHBondContact O-N 3.25Å; F91-V93 VanDerWaalsContact C-N 3.33Å; F91-V93 PolarHBondContact O-N 3.21Å; V93-F95 PolarHBondContact O-N 3.27Å; V93-S96 PolarHBondContact O-N 3.49Å; V93-S96 PolarHBondContact O-OG 3.37Å; V93-T97 HydrophobicContact CG1-CG2 4.4Å; V93-T97 WeakPolarHBondContact O-CG2 3.26Å; V93-T97 PolarHBondContact O-N 3.38Å; V93-T97 PolarHBondContact O-OG1 2.99Å
94G96.8Very high96.8Very high9 Ų927.6 Ų27.69%0.09315%0.15CC..Hα-helixtrans-60.1-46.5-178.700000112.6V90 F91 S96 T97 D98 N145V90-G94 PolarHBondContact O-N 2.74Å; F91-G94 PolarHBondContact O-N 2.97Å; G94-S96 PolarHBondContact O-N 3.13Å; G94-T97 PolarHBondContact O-N 3.31Å; G94-T97 PolarHBondContact O-OG1 3.01Å; G94-T97 VanDerWaalsContact O-OG1 3.08Å; G94-D98 WeakPolarHBondContact O-CB 3.4Å; G94-D98 PolarHBondContact O-N 3.16Å; G94-N145 VanDerWaalsContact CA-OD1 3.31Å; G94-N145 WeakPolarHBondContact CA-OD1 3.44Å
95F98.4Very high97Very high49 Ų4922.7 Ų22.722%0.21513%0.125CC..Hα-helixtrans-57.5-51.6175.9173.3-91000111.8F91 V93 T97 F99 A138 V141 A142F91-F95 HydrophobicContact CE1-CB 4.3Å; F91-F95 HydrophobicContact CZ-CB 4.4Å; F91-F95 HydrophobicContact CZ-CD2 4.48Å; F91-F95 VanDerWaalsContact O-CB 3.26Å; F91-F95 WeakPolarHBondContact O-CB 3.48Å; F91-F95 PolarHBondContact O-N 2.83Å; V93-F95 PolarHBondContact O-N 3.27Å; F95-T97 PolarHBondContact O-N 2.88Å; F95-F99 HydrophobicContact CE1-CB 4.5Å; F95-F99 WeakPolarHBondContact O-CB 3.32Å; F95-F99 PolarHBondContact O-N 3.46Å; F95-A138 HydrophobicContact CE2-CB 4.48Å; F95-A138 HydrophobicContact CZ-CB 4.47Å; F95-V141 HydrophobicContact CD2-CB 4.43Å; F95-V141 HydrophobicContact CD2-CG1 3.78Å; F95-V141 HydrophobicContact CE2-CG1 4.33Å; F95-V141 HydrophobicContact CG-CG1 4.38Å; F95-A142 HydrophobicContact CD2-CB 4.16Å; F95-A142 HydrophobicContact CE2-CB 4.19Å
96S98.4Very high97Very high2 Ų221.5 Ų21.51%0.01412%0.121CC..Hα-helixtrans-66-40.3-175.860.60000112.2V60 T63 A92 V93 G94 F99 A100V60-S96 VanDerWaalsContact CG2-O 3.24Å; V60-S96 WeakPolarHBondContact CG2-O 3.41Å; T63-S96 PolarHBondContact OG1-OG 3.14Å; A92-S96 VanDerWaalsContact O-CB 3.25Å; A92-S96 WeakPolarHBondContact O-CB 3.3Å; A92-S96 PolarHBondContact O-N 3.42Å; A92-S96 PolarHBondContact O-OG 2.87Å; V93-S96 PolarHBondContact O-N 3.49Å; V93-S96 PolarHBondContact O-OG 3.37Å; G94-S96 PolarHBondContact O-N 3.13Å; S96-F99 PolarHBondContact O-N 2.9Å; S96-A100 WeakPolarHBondContact O-CB 3.27Å; S96-A100 PolarHBondContact O-N 3.43Å
97T96.9Very high96.9Very high19 Ų1922 Ų2212%0.11712%0.123CC..Hα-helixtrans-67.4-46.3-18051.60000112V60 V93 G94 F95 F99 A100 V101 F356V60-T97 HydrophobicContact CG1-CG2 3.89Å; V60-T97 HydrophobicContact CG2-CG2 3.94Å; V93-T97 HydrophobicContact CG1-CG2 4.4Å; V93-T97 WeakPolarHBondContact O-CG2 3.26Å; V93-T97 PolarHBondContact O-N 3.38Å; V93-T97 PolarHBondContact O-OG1 2.99Å; G94-T97 PolarHBondContact O-N 3.31Å; G94-T97 PolarHBondContact O-OG1 3.01Å; G94-T97 VanDerWaalsContact O-OG1 3.08Å; F95-T97 PolarHBondContact O-N 2.88Å; T97-F99 VanDerWaalsContact C-N 3.33Å; T97-A100 PolarHBondContact O-N 3.12Å; T97-V101 WeakPolarHBondContact O-CG2 3.34Å; T97-V101 PolarHBondContact O-N 2.96Å; T97-V101 VanDerWaalsContact O-N 3.1Å; T97-F356 HydrophobicContact CG2-CE1 4Å
98D97.2Very high96.7Very high13 Ų1319.8 Ų19.87%0.0711%0.114CC..Hα-helixtrans-65-41177.2-68.9-35.2000111.6G94 V101 G102 V141 K144 N145G94-D98 WeakPolarHBondContact O-CB 3.4Å; G94-D98 PolarHBondContact O-N 3.16Å; D98-V101 PolarHBondContact O-N 2.99Å; D98-G102 PolarHBondContact O-N 3.14Å; D98-V141 HydrophobicContact CB-CB 4.5Å; D98-V141 HydrophobicContact CB-CG1 3.53Å; D98-V141 HydrophobicContact CB-CG2 4.1Å; D98-K144 IonicContact OD1-NZ 3.46Å; D98-K144 PolarHBondContact OD1-NZ 2.99Å; D98-K144 VanDerWaalsContact OD1-NZ 3.16Å; D98-K144 WeakPolarHBondContact OD2-CE 3.31Å; D98-K144 IonicContact OD2-NZ 2.83Å; D98-K144 PolarHBondContact OD2-NZ 3.27Å; D98-N145 PolarHBondContact OD2-ND2 2.9Å
99F98.3Very high96.6Very high23 Ų2317.8 Ų17.810%0.10111%0.107CC..Hα-helixtrans-64.1-46.1179.3-171.7-111000110.9I52 A56 F95 S96 T97 V101 G102 V103 M134 F137 A138I52-F99 HydrophobicContact CG2-CE1 3.73Å; I52-F99 HydrophobicContact CG2-CZ 3.73Å; A56-F99 HydrophobicContact CB-CD1 3.61Å; A56-F99 HydrophobicContact CB-CE1 4.01Å; F95-F99 HydrophobicContact CE1-CB 4.5Å; F95-F99 WeakPolarHBondContact O-CB 3.32Å; F95-F99 PolarHBondContact O-N 3.46Å; S96-F99 PolarHBondContact O-N 2.9Å; T97-F99 VanDerWaalsContact C-N 3.33Å; F99-V101 PolarHBondContact O-N 3.26Å; F99-G102 PolarHBondContact O-N 3.47Å; F99-V103 HydrophobicContact CD1-CG2 4.04Å; F99-V103 HydrophobicContact CD2-CG2 4.44Å; F99-V103 HydrophobicContact CE1-CG2 3.77Å; F99-V103 HydrophobicContact CE2-CG2 4.19Å; F99-V103 HydrophobicContact CG-CG2 4.37Å; F99-V103 HydrophobicContact CZ-CG2 3.85Å; F99-V103 WeakPolarHBondContact O-CG2 3.37Å; F99-V103 PolarHBondContact O-N 3.24Å; F99-M134 HydrophobicContact CE2-CE 3.72Å; F99-M134 HydrophobicContact CZ-CE 3.84Å; F99-F137 AromaticContact CD2-CD1 3.81Å; F99-F137 HydrophobicContact CD2-CD1 3.81Å; F99-F137 AromaticContact CD2-CE1 3.9Å; F99-F137 HydrophobicContact CD2-CE1 3.9Å; F99-F137 HydrophobicContact CE2-CD1 4.01Å; F99-A138 HydrophobicContact CD2-CB 4.13Å; F99-A138 HydrophobicContact CE2-CB 3.76Å
100A97.6Very high96.4Very high2 Ų217.3 Ų17.32%0.01711%0.105CC..Hα-helixtrans-58.6-46.3176.900000112.4A56 V60 S96 T97 G102 V103 L104A56-A100 HydrophobicContact CB-CB 3.9Å; V60-A100 HydrophobicContact CG2-CB 4Å; S96-A100 WeakPolarHBondContact O-CB 3.27Å; S96-A100 PolarHBondContact O-N 3.43Å; T97-A100 PolarHBondContact O-N 3.12Å; A100-G102 PolarHBondContact O-N 3.44Å; A100-V103 PolarHBondContact O-N 2.92Å; A100-L104 PolarHBondContact O-N 3.42Å
101V96.1Very high96.1Very high10 Ų1017.6 Ų17.66%0.06111%0.106CC..Hα-helixtrans-62.4-42.3176.9169.20000111.7T97 D98 F99 L104 C105 F218 P222T97-V101 WeakPolarHBondContact O-CG2 3.34Å; T97-V101 PolarHBondContact O-N 2.96Å; T97-V101 VanDerWaalsContact O-N 3.1Å; D98-V101 PolarHBondContact O-N 2.99Å; F99-V101 PolarHBondContact O-N 3.26Å; V101-L104 WeakPolarHBondContact O-CB 3.45Å; V101-L104 PolarHBondContact O-N 3.11Å; V101-C105 PolarHBondContact O-N 3.42Å; V101-C105 PolarHBondContact O-SG 2.94Å; V101-F218 HydrophobicContact CG2-CD2 4.04Å; V101-F218 HydrophobicContact CG2-CE2 3.7Å; V101-F218 HydrophobicContact CG2-CZ 4.48Å; V101-P222 HydrophobicContact CG1-CB 3.83Å; V101-P222 HydrophobicContact CG1-CG 3.17Å
102G97Very high95.8Very high14 Ų1416.6 Ų16.614%0.14410%0.103CC..Hα-helixtrans-68.3-36.2177.200000113.7D98 F99 A100 L104 C105 A106D98-G102 PolarHBondContact O-N 3.14Å; F99-G102 PolarHBondContact O-N 3.47Å; A100-G102 PolarHBondContact O-N 3.44Å; G102-L104 VanDerWaalsContact C-N 3.34Å; G102-C105 CarbonylContact O-C 3.45Å; G102-C105 WeakPolarHBondContact O-CB 3.36Å; G102-C105 PolarHBondContact O-N 2.9Å; G102-A106 PolarHBondContact O-N 2.87Å
103V96.9Very high95.4Very high0 Ų018.1 Ų18.10%011%0.106CC..Hα-helixtrans-64.7-40.8173.3-178.60000110.5I49 I52 L53 A56 F99 A100 C105 A106 V107 M134I49-V103 HydrophobicContact CG2-CG1 3.92Å; I52-V103 HydrophobicContact CB-CG1 4.39Å; I52-V103 HydrophobicContact CG2-CG1 4.09Å; I52-V103 HydrophobicContact CG2-CG2 3.72Å; L53-V103 HydrophobicContact CB-CG1 3.67Å; L53-V103 HydrophobicContact CD1-CB 4.11Å; L53-V103 HydrophobicContact CD1-CG1 3.98Å; L53-V103 HydrophobicContact CG-CG1 4.41Å; A56-V103 HydrophobicContact CB-CG2 4.36Å; F99-V103 HydrophobicContact CD1-CG2 4.04Å; F99-V103 HydrophobicContact CD2-CG2 4.44Å; F99-V103 HydrophobicContact CE1-CG2 3.77Å; F99-V103 HydrophobicContact CE2-CG2 4.19Å; F99-V103 HydrophobicContact CG-CG2 4.37Å; F99-V103 HydrophobicContact CZ-CG2 3.85Å; F99-V103 WeakPolarHBondContact O-CG2 3.37Å; F99-V103 PolarHBondContact O-N 3.24Å; A100-V103 PolarHBondContact O-N 2.92Å; V103-C105 VanDerWaalsContact C-N 3.29Å; V103-C105 PolarHBondContact O-N 2.81Å; V103-A106 WeakPolarHBondContact O-CB 3.45Å; V103-A106 PolarHBondContact O-N 2.02Å; V103-A106 VanDerWaalsContact O-N 3.09Å; V103-V107 PolarHBondContact O-N 3.05Å; V103-M134 HydrophobicContact CB-CE 4.28Å; V103-M134 HydrophobicContact CG2-CE 3.41Å; V103-M134 VanDerWaalsContact CG2-CE 3.41Å
104L95.1Very high95Very high4 Ų418.5 Ų18.52%0.02111%0.109CC..Hα-helixtrans-58.8-42.5173.6178.663000111.3L53 A100 V101 G102 V107 A108 L226 L312 H316L53-L104 HydrophobicContact CD1-CB 4.29Å; A100-L104 PolarHBondContact O-N 3.42Å; V101-L104 WeakPolarHBondContact O-CB 3.45Å; V101-L104 PolarHBondContact O-N 3.11Å; G102-L104 VanDerWaalsContact C-N 3.34Å; L104-V107 WeakPolarHBondContact O-CB 3.34Å; L104-V107 PolarHBondContact O-N 3.49Å; L104-A108 PolarHBondContact O-N 3.13Å; L104-L226 HydrophobicContact CD2-CD1 4.04Å; L104-L226 HydrophobicContact CG-CD1 4.37Å; L104-L226 HydrophobicContact CG-CD2 4.32Å; L104-L312 HydrophobicContact CD1-CB 4.12Å; L104-L312 HydrophobicContact CD1-CD1 4.21Å; L104-H316 HydrophobicContact CD2-CB 4.24Å
105C96.2Very high94.6Very high10 Ų1019 Ų197%0.06811%0.11CC..Hα-helixtrans-63.9-39.9173-65.90000112.1V101 G102 V103 V107 A108 V109 I225V101-C105 PolarHBondContact O-N 3.42Å; V101-C105 PolarHBondContact O-SG 2.94Å; G102-C105 CarbonylContact O-C 3.45Å; G102-C105 WeakPolarHBondContact O-CB 3.36Å; G102-C105 PolarHBondContact O-N 2.9Å; V103-C105 VanDerWaalsContact C-N 3.29Å; V103-C105 PolarHBondContact O-N 2.81Å; C105-V107 VanDerWaalsContact C-N 3.31Å; C105-V107 PolarHBondContact O-N 2.92Å; C105-A108 WeakPolarHBondContact O-CB 3.18Å; C105-A108 PolarHBondContact O-N 3.39Å; C105-V109 WeakPolarHBondContact O-CG2 3.21Å; C105-V109 PolarHBondContact O-N 2.87Å; C105-I225 HydrophobicContact CB-CD1 4.15Å; C105-I225 HydrophobicContact CB-CG2 4.02Å
106A95.7Very high94.1Very high25 Ų2518.3 Ų18.321%0.20711%0.109CC..Hα-helixtrans-62.2-37.317700000112.1I49 G102 V103 A108 V109 E110 M134I49-A106 HydrophobicContact CG2-CB 4.5Å; G102-A106 PolarHBondContact O-N 2.87Å; V103-A106 WeakPolarHBondContact O-CB 3.45Å; V103-A106 PolarHBondContact O-N 2.02Å; V103-A106 VanDerWaalsContact O-N 3.09Å; A106-A108 VanDerWaalsContact C-N 3.34Å; A106-A108 PolarHBondContact O-N 3.39Å; A106-V109 PolarHBondContact O-N 3.26Å; A106-E110 VanDerWaalsContact O-CB 3.29Å; A106-E110 WeakPolarHBondContact O-CB 3.48Å; A106-E110 PolarHBondContact O-N 3.13Å; A106-M134 HydrophobicContact CB-SD 3.89Å
107V92.6Very high93.6Very high10 Ų1021.1 Ų21.16%0.06112%0.124CC..Hα-helixtrans-57.8-48.8170.4176.50000110.1I49 L53 V103 L104 C105 E110 R111 L309I49-V107 HydrophobicContact CB-CG2 4.44Å; I49-V107 HydrophobicContact CG2-CB 4.4Å; I49-V107 HydrophobicContact CG2-CG2 3.35Å; L53-V107 HydrophobicContact CD2-CG2 4.41Å; V103-V107 PolarHBondContact O-N 3.05Å; L104-V107 WeakPolarHBondContact O-CB 3.34Å; L104-V107 PolarHBondContact O-N 3.49Å; C105-V107 VanDerWaalsContact C-N 3.31Å; C105-V107 PolarHBondContact O-N 2.92Å; V107-E110 PolarHBondContact O-N 3.42Å; V107-R111 VanDerWaalsContact O-CG 3.28Å; V107-R111 WeakPolarHBondContact O-CG 3.48Å; V107-R111 PolarHBondContact O-N 2.94Å; V107-L309 HydrophobicContact CG1-CD1 4.37Å
108A93.8Very high92.8Very high0 Ų023.7 Ų23.70%014%0.141CC..Hα-helixtrans-62-45-179.400000112.4L104 C105 A106 R111 L112 L226 L309L104-A108 PolarHBondContact O-N 3.13Å; C105-A108 WeakPolarHBondContact O-CB 3.18Å; C105-A108 PolarHBondContact O-N 3.39Å; A106-A108 VanDerWaalsContact C-N 3.34Å; A106-A108 PolarHBondContact O-N 3.39Å; A108-R111 WeakPolarHBondContact O-CB 3.27Å; A108-R111 PolarHBondContact O-N 3.26Å; A108-L112 WeakPolarHBondContact O-CB 3.45Å; A108-L112 PolarHBondContact O-N 3.38Å; A108-L226 HydrophobicContact CB-CD2 3.64Å; A108-L309 HydrophobicContact CB-CD1 3.91Å; A108-L309 HydrophobicContact CB-CD2 4.39Å
109V93.9Very high92Very high60 Ų6032.6 Ų32.636%0.36418%0.175SC..Hα-helixtrans-66.3-43.8178.3173.90000111.5C105 A106 R111 L112 L113 I225C105-V109 WeakPolarHBondContact O-CG2 3.21Å; C105-V109 PolarHBondContact O-N 2.87Å; A106-V109 PolarHBondContact O-N 3.26Å; V109-R111 PolarHBondContact O-N 2.94Å; V109-L112 PolarHBondContact O-N 3.47Å; V109-L113 HydrophobicContact CG1-CD1 4.07Å; V109-L113 HydrophobicContact CG1-CG 4.38Å; V109-L113 WeakPolarHBondContact O-CG 3.26Å; V109-L113 PolarHBondContact O-N 2.82Å; V109-I225 HydrophobicContact CG2-CG2 3.85Å
110E92.4Very high91.1Very high6 Ų638.1 Ų38.13%0.02820%0.199CC..Hα-helixtrans-55.1-42.9173.8-168.3-131.1171.500110.3R43 T45 T46 I49 A106 V107 V114 V125R43-E110 IonicContact NH1-OE1 3.69Å; T45-E110 WeakPolarHBondContact CB-OE1 3.43Å; T45-E110 PolarHBondContact OG1-OE1 3.36Å; T46-E110 WeakPolarHBondContact CA-OE2 3.33Å; T46-E110 PolarHBondContact N-OE1 3Å; T46-E110 VanDerWaalsContact OG1-CD 3.3Å; T46-E110 PolarHBondContact OG1-OE1 3.5Å; T46-E110 PolarHBondContact OG1-OE2 2.96Å; I49-E110 HydrophobicContact CD1-CB 3.91Å; I49-E110 HydrophobicContact CD1-CG 3.94Å; A106-E110 VanDerWaalsContact O-CB 3.29Å; A106-E110 WeakPolarHBondContact O-CB 3.48Å; A106-E110 PolarHBondContact O-N 3.13Å; V107-E110 PolarHBondContact O-N 3.42Å; E110-V114 WeakPolarHBondContact O-CB 3.3Å; E110-V114 WeakPolarHBondContact O-CG2 3.24Å; E110-V114 PolarHBondContact O-N 2.97Å; E110-V125 HydrophobicContact CG-CG1 3.91Å
111R90.4Very high90.1Very high10 Ų1038.3 Ų38.34%0.03820%0.201CC..Hα-helixtrans-67.4-44.4177.4-68.3-31.3-174.8-175.82113.2T46 V107 A108 V109 L113 V114 V115 I233 V305 L309T46-R111 PolarHBondContact OG1-NH1 3.5Å; T46-R111 PolarHBondContact OG1-NH2 2.97Å; V107-R111 VanDerWaalsContact O-CG 3.28Å; V107-R111 WeakPolarHBondContact O-CG 3.48Å; V107-R111 PolarHBondContact O-N 2.94Å; A108-R111 WeakPolarHBondContact O-CB 3.27Å; A108-R111 PolarHBondContact O-N 3.26Å; V109-R111 PolarHBondContact O-N 2.94Å; R111-L113 VanDerWaalsContact C-N 3.32Å; R111-L113 PolarHBondContact O-N 3.26Å; R111-V114 PolarHBondContact O-N 3.36Å; R111-V115 WeakPolarHBondContact O-CB 3.12Å; R111-V115 VanDerWaalsContact O-CG2 3.32Å; R111-V115 WeakPolarHBondContact O-CG2 3.46Å; R111-V115 PolarHBondContact O-N 3.44Å; R111-I233 HydrophobicContact CB-CD1 3.8Å; R111-V305 HydrophobicContact CG-CG1 4.12Å; R111-L309 HydrophobicContact CB-CD2 4Å; R111-L309 HydrophobicContact CG-CD2 4.21Å
112L91.8Very high89Confident32 Ų3241.5 Ų41.517%0.16822%0.223CC..Hα-helixtrans-56.1-50.4177.5179.462.2000110.3A108 V109 V114 V115 T116 I232 I233A108-L112 WeakPolarHBondContact O-CB 3.45Å; A108-L112 PolarHBondContact O-N 3.38Å; V109-L112 PolarHBondContact O-N 3.47Å; L112-V114 PolarHBondContact O-N 3.49Å; L112-V115 PolarHBondContact O-N 3.34Å; L112-T116 HydrophobicContact CD1-CG2 3.79Å; L112-T116 HydrophobicContact CG-CG2 4.44Å; L112-T116 VanDerWaalsContact O-CB 3.31Å; L112-T116 WeakPolarHBondContact O-CB 3.39Å; L112-T116 VanDerWaalsContact O-CG2 3.24Å; L112-T116 WeakPolarHBondContact O-CG2 3.22Å; L112-T116 PolarHBondContact O-N 2.94Å; L112-T116 PolarHBondContact O-OG1 3.23Å; L112-I232 HydrophobicContact CD1-CB 3.66Å; L112-I232 HydrophobicContact CD1-CD1 4.23Å; L112-I232 HydrophobicContact CD1-CG2 3.46Å; L112-I232 VanDerWaalsContact CD1-CG2 3.46Å; L112-I233 HydrophobicContact CB-CD1 4.48Å; L112-I233 HydrophobicContact CD1-CG1 4.22Å
113L91.4Very high88.1Confident62 Ų6246.9 Ų46.933%0.32525%0.249SC..Hα-helixtrans-63.4-43.6179.9-66.8175.6000112.3V109 R111 V115 T116 L117 V125V109-L113 HydrophobicContact CG1-CD1 4.07Å; V109-L113 HydrophobicContact CG1-CG 4.38Å; V109-L113 WeakPolarHBondContact O-CG 3.26Å; V109-L113 PolarHBondContact O-N 2.82Å; R111-L113 VanDerWaalsContact C-N 3.32Å; R111-L113 PolarHBondContact O-N 3.26Å; L113-V115 PolarHBondContact O-N 3.09Å; L113-T116 PolarHBondContact O-OG1 3.46Å; L113-L117 HydrophobicContact CD2-CD1 4.42Å; L113-L117 WeakPolarHBondContact O-CB 3.3Å; L113-L117 PolarHBondContact O-N 2.84Å; L113-V125 HydrophobicContact CB-CG2 3.85Å; L113-V125 HydrophobicContact CD1-CG2 3.58Å; L113-V125 HydrophobicContact CG-CG2 4.37Å
114V88.7Confident87.5Confident29 Ų2951.7 Ų51.718%0.17627%0.274CS..Hα-helixtrans-64.1-40.1179168.80000112.2R43 E110 R111 L112 A121R43-V114 VanDerWaalsContact NH1-CG2 3.33Å; E110-V114 WeakPolarHBondContact O-CB 3.3Å; E110-V114 WeakPolarHBondContact O-CG2 3.24Å; E110-V114 PolarHBondContact O-N 2.97Å; R111-V114 PolarHBondContact O-N 3.36Å; L112-V114 PolarHBondContact O-N 3.49Å; V114-A121 HydrophobicContact CG2-CB 4.26Å
115V87.1Confident87.2Confident19 Ų1951.9 Ų51.912%0.11528%0.275CS..Hα-helixtrans-78-38.3-177.8171.40000111.8R111 L112 L113 I233 K236 L237R111-V115 WeakPolarHBondContact O-CB 3.12Å; R111-V115 VanDerWaalsContact O-CG2 3.32Å; R111-V115 WeakPolarHBondContact O-CG2 3.46Å; R111-V115 PolarHBondContact O-N 3.44Å; L112-V115 PolarHBondContact O-N 3.34Å; L113-V115 PolarHBondContact O-N 3.09Å; V115-I233 HydrophobicContact CB-CG1 4.45Å; V115-I233 HydrophobicContact CG1-CG2 4.48Å; V115-I233 HydrophobicContact CG2-CG2 4.48Å; V115-K236 HydrophobicContact CG1-CB 4.03Å; V115-K236 HydrophobicContact CG1-CG 3.98Å; V115-L237 HydrophobicContact CG1-CD2 4.12Å; V115-L237 HydrophobicContact CG1-CG 4.01Å
116T88.4Confident87Confident34 Ų3454 Ų5421%0.20929%0.288CS..Hα-helixtrans-77.6-33.4-177.754.70000112.6L112 L113 P118 I232L112-T116 HydrophobicContact CD1-CG2 3.79Å; L112-T116 HydrophobicContact CG-CG2 4.44Å; L112-T116 VanDerWaalsContact O-CB 3.31Å; L112-T116 WeakPolarHBondContact O-CB 3.39Å; L112-T116 VanDerWaalsContact O-CG2 3.24Å; L112-T116 WeakPolarHBondContact O-CG2 3.22Å; L112-T116 PolarHBondContact O-N 2.94Å; L112-T116 PolarHBondContact O-OG1 3.23Å; L113-T116 PolarHBondContact O-OG1 3.46Å; T116-P118 VanDerWaalsContact C-CD 3.45Å; T116-P118 WeakPolarHBondContact O-CD 3.34Å; T116-I232 HydrophobicContact CG2-CG2 3.84Å
117L87.5Confident86.9Confident62 Ų6255.4 Ų55.433%0.32529%0.292SS..  trans-12258.6-173.5-55.2177000112.8L113 Y119 K120 A121 L124L113-L117 HydrophobicContact CD2-CD1 4.42Å; L113-L117 WeakPolarHBondContact O-CB 3.3Å; L113-L117 PolarHBondContact O-N 2.84Å; L117-Y119 PolarHBondContact O-N 2.99Å; L117-Y119 VanDerWaalsContact O-N 3.07Å; L117-K120 HydrophobicContact CB-CB 4.37Å; L117-K120 PolarHBondContact O-N 2.97Å; L117-A121 WeakPolarHBondContact O-CA 3.37Å; L117-A121 WeakPolarHBondContact O-CB 3.49Å; L117-A121 PolarHBondContact O-N 3.37Å; L117-L124 HydrophobicContact CD1-CD1 3.62Å
118P80.7Confident87Confident72 Ų7260.1 Ų60.147%0.46832%0.317SS..THydrogen-bonded Turntrans-57.1-33.5-17123.7-35000114.3T116T116-P118 VanDerWaalsContact C-CD 3.45Å; T116-P118 WeakPolarHBondContact O-CD 3.34Å
119Y80.2Confident87Confident201 Ų20162.5 Ų62.579%0.78833%0.333SS*.THydrogen-bonded Turntrans-84.7-24.3-179.7-56.6-69.9000114.1L117L117-Y119 PolarHBondContact O-N 2.99Å; L117-Y119 VanDerWaalsContact O-N 3.07Å
120K79.9Confident87.1Confident139 Ų13960.4 Ų60.460%0.60432%0.321SS*.THydrogen-bonded Turntrans-103.9-13.5-178.5-63.1-174.6178-175.40112.9L117 S122 N123 L124L117-K120 HydrophobicContact CB-CB 4.37Å; L117-K120 PolarHBondContact O-N 2.97Å; K120-S122 VanDerWaalsContact C-N 3.31Å; K120-S122 PolarHBondContact O-N 3.42Å; K120-N123 PolarHBondContact O-N 3.12Å; K120-L124 HydrophobicContact CB-CD1 3.89Å; K120-L124 HydrophobicContact CB-CG 4.43Å; K120-L124 PolarHBondContact O-N 3.22Å
121A75.5Confident87.4Confident6 Ų663.2 Ų63.25%0.0534%0.335CS..Hα-helixtrans-60-38.1-172.600000113R43 V114 L117 N123 L124 V125R43-A121 PolarHBondContact NH2-O 2.86Å; V114-A121 HydrophobicContact CG2-CB 4.26Å; L117-A121 WeakPolarHBondContact O-CA 3.37Å; L117-A121 WeakPolarHBondContact O-CB 3.49Å; L117-A121 PolarHBondContact O-N 3.37Å; A121-N123 PolarHBondContact O-N 3.41Å; A121-L124 PolarHBondContact O-N 3.37Å; A121-V125 PolarHBondContact O-N 2.94Å
122S73.7Confident87.7Confident76 Ų7667.7 Ų67.753%0.53136%0.359SS..Hα-helixtrans-58.9-32.9176.953.90000112.6K120K120-S122 VanDerWaalsContact C-N 3.31Å; K120-S122 PolarHBondContact O-N 3.42Å
123N79.1Confident88Confident128 Ų12868 Ų6868%0.68437%0.369SS*.Hα-helixtrans-92.1-34.4-175.2-60.64.8000111.6K120 A121 T126K120-N123 PolarHBondContact O-N 3.12Å; A121-N123 PolarHBondContact O-N 3.41Å; N123-T126 WeakPolarHBondContact O-CG2 3.36Å
124L83Confident88.3Confident100 Ų10065.8 Ų65.852%0.52436%0.358SS..Hα-helixtrans-80.5-44.3-178.4-69.4170.4000113.1L117 K120 A121 T126 S129L117-L124 HydrophobicContact CD1-CD1 3.62Å; K120-L124 HydrophobicContact CB-CD1 3.89Å; K120-L124 HydrophobicContact CB-CG 4.43Å; K120-L124 PolarHBondContact O-N 3.22Å; A121-L124 PolarHBondContact O-N 3.37Å; L124-T126 PolarHBondContact O-N 2.94Å; L124-S129 PolarHBondContact O-OG 2.9Å
125V89.4Confident88.8Confident9 Ų969 Ų696%0.05537%0.373CS..SBendtrans-104.875.1-174.7-176.40000108.5R43 T45 E110 L113 A121 V130R43-V125 VanDerWaalsContact NH1-CB 3.35Å; R43-V125 VanDerWaalsContact NH1-CG1 3.28Å; R43-V125 PolarHBondContact NH1-O 3.28Å; R43-V125 PolarHBondContact NH2-O 3.37Å; T45-V125 HydrophobicContact CG2-CG1 4.29Å; T45-V125 WeakPolarHBondContact CG2-O 3.3Å; E110-V125 HydrophobicContact CG-CG1 3.91Å; L113-V125 HydrophobicContact CB-CG2 3.85Å; L113-V125 HydrophobicContact CD1-CG2 3.58Å; L113-V125 HydrophobicContact CG-CG2 4.37Å; A121-V125 PolarHBondContact O-N 2.94Å; V125-V130 HydrophobicContact CG1-CG2 3.88Å
126T92.3Very high89.3Confident55 Ų5571.3 Ų71.334%0.33739%0.389SS..  trans-85.7166.6179.664.50000110.8N123 L124 N128 S129 V130N123-T126 WeakPolarHBondContact O-CG2 3.36Å; L124-T126 PolarHBondContact O-N 2.94Å; T126-N128 VanDerWaalsContact C-N 3.27Å; T126-N128 PolarHBondContact O-N 3.05Å; T126-S129 PolarHBondContact N-OG 3.49Å; T126-S129 PolarHBondContact O-N 3.02Å; T126-S129 PolarHBondContact O-OG 3.19Å; T126-S129 PolarHBondContact OG1-N 3.38Å; T126-S129 PolarHBondContact OG1-OG 3.44Å; T126-V130 WeakPolarHBondContact O-CG2 3.18Å; T126-V130 PolarHBondContact O-N 3.37Å; T126-V130 VanDerWaalsContact O-N 3.12Å
127L93.3Very high89.8Confident54 Ų5473 Ų7328%0.28339%0.394SS..Hα-helixtrans-58.3-45174.7-173.865.9000110.9L44 L48 V130 I131L44-L127 HydrophobicContact CD2-CD1 4.44Å; L44-L127 HydrophobicContact CD2-CD2 3.84Å; L44-L127 HydrophobicContact CG-CD1 4.08Å; L44-L127 HydrophobicContact CG-CD2 4.32Å; L48-L127 HydrophobicContact CB-CD1 4.09Å; L48-L127 HydrophobicContact CD1-CD1 3.67Å; L48-L127 HydrophobicContact CG-CD1 4.33Å; L127-V130 PolarHBondContact O-N 3.36Å; L127-I131 HydrophobicContact CD1-CD1 4.42Å; L127-I131 HydrophobicContact CD2-CD1 4.42Å; L127-I131 HydrophobicContact CG-CD1 3.89Å; L127-I131 WeakPolarHBondContact O-CG1 3.35Å; L127-I131 PolarHBondContact O-N 3.15Å
128N95.2Very high90.3Very high109 Ų10971.1 Ų71.158%0.58339%0.387SS*.Hα-helixtrans-65.1-42.2-178.8-63.87000111.3T126 V130 I131 I132T126-N128 VanDerWaalsContact C-N 3.27Å; T126-N128 PolarHBondContact O-N 3.05Å; N128-V130 VanDerWaalsContact C-N 3.3Å; N128-V130 PolarHBondContact O-N 2.77Å; N128-I131 PolarHBondContact O-N 3.41Å; N128-I132 WeakPolarHBondContact O-CB 3.43Å; N128-I132 VanDerWaalsContact O-CG1 3.24Å; N128-I132 WeakPolarHBondContact O-CG1 3.39Å; N128-I132 PolarHBondContact O-N 2.68Å
129S94.1Very high91.2Very high49 Ų4972.6 Ų72.634%0.34339%0.391SS..Hα-helixtrans-65.4-35.4178.172.10000112.2L124 T126 G133L124-S129 PolarHBondContact O-OG 2.9Å; T126-S129 PolarHBondContact N-OG 3.49Å; T126-S129 PolarHBondContact O-N 3.02Å; T126-S129 PolarHBondContact O-OG 3.19Å; T126-S129 PolarHBondContact OG1-N 3.38Å; T126-S129 PolarHBondContact OG1-OG 3.44Å; S129-G133 PolarHBondContact O-N 3.49Å
130V96Very high92Very high17 Ų1766.6 Ų66.610%0.10338%0.378CS..Hα-helixtrans-66.4-46.6172.51730000111.3T45 L48 I49 V125 T126 L127 N128 G133 M134T45-V130 HydrophobicContact CG2-CG2 4.03Å; L48-V130 HydrophobicContact CD2-CG1 3.63Å; I49-V130 HydrophobicContact CD1-CG1 3.8Å; I49-V130 HydrophobicContact CD1-CG2 4.37Å; I49-V130 HydrophobicContact CG1-CG1 3.56Å; V125-V130 HydrophobicContact CG1-CG2 3.88Å; T126-V130 WeakPolarHBondContact O-CG2 3.18Å; T126-V130 PolarHBondContact O-N 3.37Å; T126-V130 VanDerWaalsContact O-N 3.12Å; L127-V130 PolarHBondContact O-N 3.36Å; N128-V130 VanDerWaalsContact C-N 3.3Å; N128-V130 PolarHBondContact O-N 2.77Å; V130-G133 PolarHBondContact O-N 2.99Å; V130-M134 HydrophobicContact CG1-CG 4.25Å; V130-M134 WeakPolarHBondContact O-CB 3.42Å; V130-M134 VanDerWaalsContact O-CG 3.27Å; V130-M134 WeakPolarHBondContact O-CG 3.39Å; V130-M134 PolarHBondContact O-N 3.31Å
131I97.6Very high92.9Very high64 Ų6460.4 Ų60.433%0.32835%0.352SS..Hα-helixtrans-59.7-50.7179-70.5167.5000110.7L48 L127 N128 G133 M134 I135L48-I131 HydrophobicContact CD1-CD1 4.07Å; L48-I131 HydrophobicContact CD1-CG1 3.85Å; L48-I131 HydrophobicContact CD2-CG1 4.37Å; L127-I131 HydrophobicContact CD1-CD1 4.42Å; L127-I131 HydrophobicContact CD2-CD1 4.42Å; L127-I131 HydrophobicContact CG-CD1 3.89Å; L127-I131 WeakPolarHBondContact O-CG1 3.35Å; L127-I131 PolarHBondContact O-N 3.15Å; N128-I131 PolarHBondContact O-N 3.41Å; I131-G133 VanDerWaalsContact C-N 3.33Å; I131-G133 PolarHBondContact O-N 3.34Å; I131-M134 PolarHBondContact O-N 2.94Å; I131-I135 HydrophobicContact CG2-CD1 3.75Å; I131-I135 HydrophobicContact CG2-CG1 4.5Å; I131-I135 VanDerWaalsContact O-CG1 3.32Å; I131-I135 WeakPolarHBondContact O-CG1 3.48Å; I131-I135 PolarHBondContact O-N 3.18Å
132I97.5Very high93.9Very high104 Ų10461.5 Ų61.553%0.53336%0.361SS..Hα-helixtrans-59.7-46.7178.2-66165.1000110N128 M134 I135 C136N128-I132 WeakPolarHBondContact O-CB 3.43Å; N128-I132 VanDerWaalsContact O-CG1 3.24Å; N128-I132 WeakPolarHBondContact O-CG1 3.39Å; N128-I132 PolarHBondContact O-N 2.68Å; I132-M134 PolarHBondContact O-N 3Å; I132-I135 PolarHBondContact O-N 3.38Å; I132-C136 WeakPolarHBondContact O-CB 3.48Å; I132-C136 PolarHBondContact O-N 3.13Å; I132-C136 PolarHBondContact O-SG 2.91Å
133G97.6Very high95.1Very high38 Ų3863.6 Ų63.639%0.39237%0.365SS..Hα-helixtrans-58.5-43.6177.600000113.1S129 V130 I131 F137S129-G133 PolarHBondContact O-N 3.49Å; V130-G133 PolarHBondContact O-N 2.99Å; I131-G133 VanDerWaalsContact C-N 3.33Å; I131-G133 PolarHBondContact O-N 3.34Å; G133-F137 VanDerWaalsContact O-CB 3.31Å; G133-F137 WeakPolarHBondContact O-CB 3.24Å; G133-F137 PolarHBondContact O-N 3.46Å
134M97.9Very high95.9Very high17 Ų1759 Ų598%0.08434%0.339CS..Hα-helixtrans-69.6-35.5178.3-67.8-49.6-51.200112.8I52 F99 V103 A106 V130 I131 I132 F137 A138I52-M134 HydrophobicContact CD1-CB 4.45Å; I52-M134 HydrophobicContact CD1-CG 4.14Å; I52-M134 HydrophobicContact CG2-CE 4.34Å; F99-M134 HydrophobicContact CE2-CE 3.72Å; F99-M134 HydrophobicContact CZ-CE 3.84Å; V103-M134 HydrophobicContact CB-CE 4.28Å; V103-M134 HydrophobicContact CG2-CE 3.41Å; V103-M134 VanDerWaalsContact CG2-CE 3.41Å; A106-M134 HydrophobicContact CB-SD 3.89Å; V130-M134 HydrophobicContact CG1-CG 4.25Å; V130-M134 WeakPolarHBondContact O-CB 3.42Å; V130-M134 VanDerWaalsContact O-CG 3.27Å; V130-M134 WeakPolarHBondContact O-CG 3.39Å; V130-M134 PolarHBondContact O-N 3.31Å; I131-M134 PolarHBondContact O-N 2.94Å; I132-M134 PolarHBondContact O-N 3Å; M134-F137 HydrophobicContact CE-CD1 4.2Å; M134-A138 WeakPolarHBondContact O-CB 3.36Å; M134-A138 PolarHBondContact O-N 3.01Å
135I98.3Very high96.6Very high96 Ų9654.2 Ų54.249%0.49231%0.314SS..Hα-helixtrans-66.3-49.4174-69.3168.4000110.1I131 I132 F137 A138 L139I131-I135 HydrophobicContact CG2-CD1 3.75Å; I131-I135 HydrophobicContact CG2-CG1 4.5Å; I131-I135 VanDerWaalsContact O-CG1 3.32Å; I131-I135 WeakPolarHBondContact O-CG1 3.48Å; I131-I135 PolarHBondContact O-N 3.18Å; I132-I135 PolarHBondContact O-N 3.38Å; I135-F137 VanDerWaalsContact C-N 3.27Å; I135-F137 PolarHBondContact O-N 3.45Å; I135-A138 PolarHBondContact O-N 3.39Å; I135-L139 HydrophobicContact CG2-CD1 4.17Å; I135-L139 WeakPolarHBondContact O-CG 3.41Å; I135-L139 PolarHBondContact O-N 3.04Å
136C98.4Very high97Very high68 Ų6856.6 Ų56.646%0.45933%0.331SS..Hα-helixtrans-58.1-42.2176.4-69.30000111.3I132 L139 S140I132-C136 WeakPolarHBondContact O-CB 3.48Å; I132-C136 PolarHBondContact O-N 3.13Å; I132-C136 PolarHBondContact O-SG 2.91Å; C136-L139 PolarHBondContact O-N 3.28Å; C136-S140 PolarHBondContact O-N 3.46Å; C136-S140 PolarHBondContact O-OG 3.09Å; C136-S140 VanDerWaalsContact O-OG 3.09Å
137F98.1Very high97.1Very high69 Ų6957.7 Ų57.730%0.30333%0.334SS..Hα-helixtrans-64.2-44.8176.4-179.8-110.5000112.4F99 G133 M134 I135 L139 S140 V141F99-F137 AromaticContact CD2-CD1 3.81Å; F99-F137 HydrophobicContact CD2-CD1 3.81Å; F99-F137 AromaticContact CD2-CE1 3.9Å; F99-F137 HydrophobicContact CD2-CE1 3.9Å; F99-F137 HydrophobicContact CE2-CD1 4.01Å; G133-F137 VanDerWaalsContact O-CB 3.31Å; G133-F137 WeakPolarHBondContact O-CB 3.24Å; G133-F137 PolarHBondContact O-N 3.46Å; M134-F137 HydrophobicContact CE-CD1 4.2Å; I135-F137 VanDerWaalsContact C-N 3.27Å; I135-F137 PolarHBondContact O-N 3.45Å; F137-L139 VanDerWaalsContact C-N 3.3Å; F137-L139 PolarHBondContact O-N 3.28Å; F137-S140 PolarHBondContact O-N 3.29Å; F137-V141 HydrophobicContact CD1-CG2 4.36Å; F137-V141 HydrophobicContact CD2-CG2 4.29Å; F137-V141 HydrophobicContact CE1-CG2 3.84Å; F137-V141 HydrophobicContact CE2-CG2 3.75Å; F137-V141 HydrophobicContact CZ-CG2 3.49Å; F137-V141 VanDerWaalsContact CZ-CG2 3.49Å; F137-V141 WeakPolarHBondContact O-CG2 3.25Å; F137-V141 PolarHBondContact O-N 2.81Å
138A98.6Very high97.1Very high22 Ų2256.5 Ų56.518%0.18233%0.327CS..Hα-helixtrans-58.6-42.4175.300000111.7F95 F99 M134 I135 V141 A142F95-A138 HydrophobicContact CE2-CB 4.48Å; F95-A138 HydrophobicContact CZ-CB 4.47Å; F99-A138 HydrophobicContact CD2-CB 4.13Å; F99-A138 HydrophobicContact CE2-CB 3.76Å; M134-A138 WeakPolarHBondContact O-CB 3.36Å; M134-A138 PolarHBondContact O-N 3.01Å; I135-A138 PolarHBondContact O-N 3.39Å; A138-V141 PolarHBondContact O-N 2.97Å; A138-A142 WeakPolarHBondContact O-CB 3.44Å; A138-A142 PolarHBondContact O-N 2.99Å
139L98.5Very high97.1Very high104 Ų10454 Ų5455%0.54531%0.311SS..Hα-helixtrans-63.4-44.9175.6-68.6173.6000111.8I135 C136 F137 V141 A142 I143I135-L139 HydrophobicContact CG2-CD1 4.17Å; I135-L139 WeakPolarHBondContact O-CG 3.41Å; I135-L139 PolarHBondContact O-N 3.04Å; C136-L139 PolarHBondContact O-N 3.28Å; F137-L139 VanDerWaalsContact C-N 3.3Å; F137-L139 PolarHBondContact O-N 3.28Å; L139-V141 VanDerWaalsContact C-N 3.33Å; L139-V141 PolarHBondContact O-N 2.86Å; L139-A142 PolarHBondContact O-N 2.89Å; L139-I143 VanDerWaalsContact O-CG1 3.29Å; L139-I143 WeakPolarHBondContact O-CG1 3.26Å; L139-I143 PolarHBondContact O-N 3.13Å
140S97.9Very high97.2Very high75 Ų7559 Ų5952%0.52432%0.322SS..Hα-helixtrans-60-42.4176.2-63.80000112.3C136 F137 I143 K144C136-S140 PolarHBondContact O-N 3.46Å; C136-S140 PolarHBondContact O-OG 3.09Å; C136-S140 VanDerWaalsContact O-OG 3.09Å; F137-S140 PolarHBondContact O-N 3.29Å; S140-I143 PolarHBondContact O-N 3.08Å; S140-K144 PolarHBondContact O-N 2.79Å
141V98Very high97.1Very high9 Ų958.2 Ų58.26%0.05532%0.318CS..Hα-helixtrans-66.8-39.6175.9170.70000111.3F95 D98 F137 A138 L139 K144 N145F95-V141 HydrophobicContact CD2-CB 4.43Å; F95-V141 HydrophobicContact CD2-CG1 3.78Å; F95-V141 HydrophobicContact CE2-CG1 4.33Å; F95-V141 HydrophobicContact CG-CG1 4.38Å; D98-V141 HydrophobicContact CB-CB 4.5Å; D98-V141 HydrophobicContact CB-CG1 3.53Å; D98-V141 HydrophobicContact CB-CG2 4.1Å; F137-V141 HydrophobicContact CD1-CG2 4.36Å; F137-V141 HydrophobicContact CD2-CG2 4.29Å; F137-V141 HydrophobicContact CE1-CG2 3.84Å; F137-V141 HydrophobicContact CE2-CG2 3.75Å; F137-V141 HydrophobicContact CZ-CG2 3.49Å; F137-V141 VanDerWaalsContact CZ-CG2 3.49Å; F137-V141 WeakPolarHBondContact O-CG2 3.25Å; F137-V141 PolarHBondContact O-N 2.81Å; A138-V141 PolarHBondContact O-N 2.97Å; L139-V141 VanDerWaalsContact C-N 3.33Å; L139-V141 PolarHBondContact O-N 2.86Å; V141-K144 PolarHBondContact O-N 2.96Å; V141-N145 WeakPolarHBondContact CG1-ND2 3.39Å; V141-N145 WeakPolarHBondContact O-CB 3.44Å; V141-N145 PolarHBondContact O-N 3.43Å; V141-N145 PolarHBondContact O-ND2 3.23Å
142A98.3Very high96.9Very high28 Ų2855.8 Ų55.823%0.23131%0.305CS..Hα-helixtrans-63.3-44.2175.200000111.3F91 F95 A138 L139 N145 S146F91-A142 HydrophobicContact CZ-CB 4.28Å; F95-A142 HydrophobicContact CD2-CB 4.16Å; F95-A142 HydrophobicContact CE2-CB 4.19Å; A138-A142 WeakPolarHBondContact O-CB 3.44Å; A138-A142 PolarHBondContact O-N 2.99Å; L139-A142 PolarHBondContact O-N 2.89Å; A142-N145 PolarHBondContact O-N 2.69Å; A142-S146 WeakPolarHBondContact O-CB 3.34Å; A142-S146 PolarHBondContact O-N 3.05Å
143I97.7Very high96.5Very high120 Ų12051 Ų5162%0.61528%0.282SS*.Hα-helixtrans-60.6-48.8175.8-68164.5000110L139 S140 N145 S146L139-I143 VanDerWaalsContact O-CG1 3.29Å; L139-I143 WeakPolarHBondContact O-CG1 3.26Å; L139-I143 PolarHBondContact O-N 3.13Å; S140-I143 PolarHBondContact O-N 3.08Å; I143-N145 VanDerWaalsContact C-N 3.35Å; I143-N145 PolarHBondContact O-N 3.5Å; I143-S146 WeakPolarHBondContact O-CB 3.49Å; I143-S146 PolarHBondContact O-N 3.3Å; I143-S146 PolarHBondContact O-OG 2.83Å
144K96.6Very high95.7Very high32 Ų3250.4 Ų50.414%0.13928%0.275CS..Hα-helixtrans-54.5-51.1176.8-168.2-15770.5153.40111.2D98 S140 V141 S146 L147 F210 F213 D214D98-K144 IonicContact OD1-NZ 3.46Å; D98-K144 PolarHBondContact OD1-NZ 2.99Å; D98-K144 VanDerWaalsContact OD1-NZ 3.16Å; D98-K144 WeakPolarHBondContact OD2-CE 3.31Å; D98-K144 IonicContact OD2-NZ 2.83Å; D98-K144 PolarHBondContact OD2-NZ 3.27Å; S140-K144 PolarHBondContact O-N 2.79Å; V141-K144 PolarHBondContact O-N 2.96Å; K144-S146 VanDerWaalsContact C-N 3.32Å; K144-S146 PolarHBondContact O-N 3.42Å; K144-L147 WeakPolarHBondContact O-CB 3.35Å; K144-L147 PolarHBondContact O-N 3.32Å; K144-F210 HydrophobicContact CG-CE2 4.13Å; K144-F210 WeakPolarHBondContact O-CE2 3.39Å; K144-F213 HydrophobicContact CD-CD1 3.95Å; K144-F213 HydrophobicContact CD-CE1 3.58Å; K144-F213 HydrophobicContact CG-CD1 4.26Å; K144-F213 HydrophobicContact CG-CE1 3.87Å; K144-D214 IonicContact NZ-OD1 3.16Å; K144-D214 PolarHBondContact NZ-OD1 2.96Å
145N97.2Very high94.3Very high0 Ų055.9 Ų55.90%030%0.3CS..Hα-helixtrans-76.3-17.6-176.1-74.8-74.5000113.7F91 G94 D98 V141 A142 I143 L147 H148 F149F91-N145 HydrophobicContact CD2-CB 3.85Å; F91-N145 HydrophobicContact CE2-CB 3.93Å; G94-N145 VanDerWaalsContact CA-OD1 3.31Å; G94-N145 WeakPolarHBondContact CA-OD1 3.44Å; D98-N145 PolarHBondContact OD2-ND2 2.9Å; V141-N145 WeakPolarHBondContact CG1-ND2 3.39Å; V141-N145 WeakPolarHBondContact O-CB 3.44Å; V141-N145 PolarHBondContact O-N 3.43Å; V141-N145 PolarHBondContact O-ND2 3.23Å; A142-N145 PolarHBondContact O-N 2.69Å; I143-N145 VanDerWaalsContact C-N 3.35Å; I143-N145 PolarHBondContact O-N 3.5Å; N145-L147 PolarHBondContact O-N 3.47Å; N145-H148 WeakPolarHBondContact O-CB 3.31Å; N145-H148 PolarHBondContact O-N 3.34Å; N145-H148 VanDerWaalsContact O-N 3.11Å; N145-F149 PolarHBondContact O-N 2.94Å
146S97Very high92Very high59 Ų5960.5 Ų60.541%0.41332%0.317SS..Hα-helixtrans-64.5-30.3172.976.10000112.1A142 I143 K144 H148 F149 W150A142-S146 WeakPolarHBondContact O-CB 3.34Å; A142-S146 PolarHBondContact O-N 3.05Å; I143-S146 WeakPolarHBondContact O-CB 3.49Å; I143-S146 PolarHBondContact O-N 3.3Å; I143-S146 PolarHBondContact O-OG 2.83Å; K144-S146 VanDerWaalsContact C-N 3.32Å; K144-S146 PolarHBondContact O-N 3.42Å; S146-H148 VanDerWaalsContact C-N 3.34Å; S146-F149 WeakPolarHBondContact O-CB 3.35Å; S146-F149 PolarHBondContact O-N 2.9Å; S146-W150 PolarHBondContact O-N 3.49Å; S146-W150 VanDerWaalsContact O-N 3.08Å
147L94.9Very high89.6Confident78 Ų7859.7 Ų59.741%0.40831%0.312SS..Hα-helixtrans-64-41.2171.6-173.860.2000111K144 N145 W150 M151 F210K144-L147 WeakPolarHBondContact O-CB 3.35Å; K144-L147 PolarHBondContact O-N 3.32Å; N145-L147 PolarHBondContact O-N 3.47Å; L147-W150 WeakPolarHBondContact O-CB 3.24Å; L147-W150 PolarHBondContact O-N 3.49Å; L147-M151 HydrophobicContact CG-CE 3.93Å; L147-M151 HydrophobicContact CG-SD 4.34Å; L147-M151 WeakPolarHBondContact O-CG 3.46Å; L147-M151 PolarHBondContact O-N 3.33Å; L147-M151 VanDerWaalsContact O-N 3.08Å; L147-F210 HydrophobicContact CD2-CD2 4.13Å
148H93.8Very high86.8Confident29 Ų2964.5 Ų64.513%0.13434%0.335CS..Hα-helixtrans-66.3-40176.4-164.4-170.9000112V90 N145 S146 W150 M151 M152 F207 F210V90-H148 WeakPolarHBondContact CG1-CE1 3.11Å; V90-H148 WeakPolarHBondContact CG1-ND1 3.33Å; V90-H148 WeakPolarHBondContact CG1-NE2 3.33Å; N145-H148 WeakPolarHBondContact O-CB 3.31Å; N145-H148 PolarHBondContact O-N 3.34Å; N145-H148 VanDerWaalsContact O-N 3.11Å; S146-H148 VanDerWaalsContact C-N 3.34Å; H148-W150 VanDerWaalsContact C-N 3.27Å; H148-W150 PolarHBondContact O-N 3.49Å; H148-M151 PolarHBondContact O-N 2.97Å; H148-M152 WeakPolarHBondContact O-CG 3.35Å; H148-M152 PolarHBondContact O-N 3.1Å; H148-M152 VanDerWaalsContact O-N 3.15Å; H148-F207 AromaticContact NE2-CE2 3.74Å; H148-F210 HydrophobicContact CB-CE1 3.88Å; H148-F210 HydrophobicContact CB-CE2 4.28Å; H148-F210 HydrophobicContact CB-CZ 3.67Å; H148-F210 AromaticContact CG-CE1 3.77Å; H148-F210 AromaticContact ND1-CE1 3.83Å
149F95.8Very high84Confident57 Ų5769.1 Ų69.125%0.2535%0.353CS..Hα-helixtrans-54.9-43.8171.8175.1-86000111.9K87 M88 F91 N145 S146K87-F149 VanDerWaalsContact C-CD2 3.49Å; K87-F149 HydrophobicContact CB-CD2 3.58Å; K87-F149 HydrophobicContact CB-CE2 3.39Å; K87-F149 HydrophobicContact CB-CG 4.22Å; K87-F149 HydrophobicContact CB-CZ 3.91Å; K87-F149 HydrophobicContact CD-CE1 4.35Å; K87-F149 HydrophobicContact CD-CE2 4.49Å; K87-F149 HydrophobicContact CD-CZ 4.17Å; K87-F149 WeakPolarHBondContact O-CD2 3.4Å; M88-F149 HydrophobicContact CG-CE2 4.15Å; M88-F149 HydrophobicContact SD-CD2 4.38Å; M88-F149 HydrophobicContact SD-CE2 3.61Å; M88-F149 HydrophobicContact SD-CZ 4.41Å; F91-F149 HydrophobicContact CB-CB 4.16Å; F91-F149 HydrophobicContact CB-CD2 4.06Å; F91-F149 HydrophobicContact CD2-CB 4.28Å; N145-F149 PolarHBondContact O-N 2.94Å; S146-F149 WeakPolarHBondContact O-CB 3.35Å; S146-F149 PolarHBondContact O-N 2.9Å
150W94.7Very high81.1Confident152 Ų15268.9 Ų68.958%0.57636%0.36SS*.Hα-helixtrans-65.1-48.4179.8-175.9-101.5000112K87 S146 L147 H148 M152 Y203K87-W150 PolarHBondContact NZ-O 2.91Å; S146-W150 PolarHBondContact O-N 3.49Å; S146-W150 VanDerWaalsContact O-N 3.08Å; L147-W150 WeakPolarHBondContact O-CB 3.24Å; L147-W150 PolarHBondContact O-N 3.49Å; H148-W150 VanDerWaalsContact C-N 3.27Å; H148-W150 PolarHBondContact O-N 3.49Å; W150-M152 VanDerWaalsContact C-N 3.3Å; W150-M152 PolarHBondContact O-N 3.06Å; W150-Y203 AromaticContact NE1-CE2 3.92Å; W150-Y203 AromaticContact NE1-CZ 3.59Å; W150-Y203 PolarHBondContact NE1-OH 3.24Å
151M94Very high78Confident2 Ų272.2 Ų72.21%0.0137%0.367CS..Hα-helixtrans-69.3-22.3-175.8-66.6-177.7-61.600114.3L147 H148 F199 V200 Y203 I206 F207 F210L147-M151 HydrophobicContact CG-CE 3.93Å; L147-M151 HydrophobicContact CG-SD 4.34Å; L147-M151 WeakPolarHBondContact O-CG 3.46Å; L147-M151 PolarHBondContact O-N 3.33Å; L147-M151 VanDerWaalsContact O-N 3.08Å; H148-M151 PolarHBondContact O-N 2.97Å; M151-F199 WeakPolarHBondContact O-CA 3.33Å; M151-V200 PolarHBondContact O-N 2.65Å; M151-Y203 HydrophobicContact CB-CD2 4.48Å; M151-Y203 HydrophobicContact CG-CD2 4.43Å; M151-Y203 HydrophobicContact CG-CG 4.32Å; M151-I206 HydrophobicContact SD-CB 4.08Å; M151-I206 HydrophobicContact SD-CG2 3.65Å; M151-F207 HydrophobicContact CE-CD2 4.2Å; M151-F207 HydrophobicContact SD-CB 4.08Å; M151-F210 HydrophobicContact CE-CB 3.78Å; M151-F210 HydrophobicContact CE-CD1 4.09Å; M151-F210 HydrophobicContact CE-CD2 4.15Å; M151-F210 HydrophobicContact CE-CG 3.73Å
152M93Very high75.1Confident13 Ų1375.5 Ų75.56%0.06439%0.387CS..EExtended strand (participates in β ladder)trans-84.9146.3-179-67.4-64.6-71.200112.6K87 V90 H148 W150 F199 F207K87-M152 WeakPolarHBondContact CE-O 3.24Å; K87-M152 VanDerWaalsContact CG-O 3.3Å; K87-M152 WeakPolarHBondContact CG-O 3.31Å; K87-M152 PolarHBondContact NZ-O 3.43Å; V90-M152 HydrophobicContact CB-CG 4.31Å; V90-M152 HydrophobicContact CG1-CG 3.87Å; V90-M152 HydrophobicContact CG2-CE 3.84Å; V90-M152 HydrophobicContact CG2-CG 4.28Å; H148-M152 WeakPolarHBondContact O-CG 3.35Å; H148-M152 PolarHBondContact O-N 3.1Å; H148-M152 VanDerWaalsContact O-N 3.15Å; W150-M152 VanDerWaalsContact C-N 3.3Å; W150-M152 PolarHBondContact O-N 3.06Å; M152-F199 HydrophobicContact SD-CB 4.14Å; M152-F207 HydrophobicContact SD-CE2 4.31Å
153G89.7Confident72.3Confident4 Ų478.5 Ų78.54%0.04140%0.399CS..EExtended strand (participates in β ladder)trans-173.6-161.3-177.700000113C197 T198G153-C197 WeakPolarHBondContact O-CA 3.29Å; G153-T198 CarbonylContact C-O 3.6Å; G153-T198 PolarHBondContact N-O 3.24Å; G153-T198 PolarHBondContact O-N 3.42Å
154G82.3Confident69.5Low24 Ų2476 Ų7625%0.24739%0.392CS..EExtended strand (participates in β ladder)trans-94.4147.1173.100000111.6K156G154-K156 PolarHBondContact O-N 3.3Å
155H66.7Low67.2Low132 Ų13278 Ų7861%0.61141%0.407SS*.  trans-68.2111.3164-157.671.6000108.5S157 K196 T198H155-S157 PolarHBondContact O-N 3.25Å; H155-K196 PolarHBondContact N-O 3.07Å; H155-T198 HydrophobicContact CB-CG2 3.85Å
156K51.1Low64.7Low194 Ų19481.6 Ų81.684%0.84343%0.426SS*.  trans-78.9106.4161.8-71.5-175.1179.5-179.60105.8G154 Q158G154-K156 PolarHBondContact O-N 3.3Å; K156-Q158 PolarHBondContact O-N 3.35Å; K156-Q158 VanDerWaalsContact O-N 3.15Å
157S46.8Very low62.4Low50 Ų5084 Ų8435%0.3543%0.434SS..  trans-61.4118.8168.8-170.30000107.7H155 H159 S160H155-S157 PolarHBondContact O-N 3.25Å; S157-H159 PolarHBondContact O-N 2.94Å; S157-S160 PolarHBondContact O-N 3.33Å
158Q39.5Very low60Low171 Ų17187.6 Ų87.680%0.79944%0.443SS*.THydrogen-bonded Turntrans-63.5-1.9171.8-88.9179.5-22.900112.7K156 S160 E161K156-Q158 PolarHBondContact O-N 3.35Å; K156-Q158 VanDerWaalsContact O-N 3.15Å; Q158-S160 PolarHBondContact O-N 3.37Å; Q158-E161 PolarHBondContact O-N 3.42Å
159H40Very low57.7Low118 Ų11892.6 Ų92.655%0.54646%0.464SS..Hα-helixtrans-63-21.1171.4-90.8-66.3000114.1S157 E161 D163S157-H159 PolarHBondContact O-N 2.94Å; H159-E161 PolarHBondContact O-N 3.37Å; H159-D163 VanDerWaalsContact O-CB 3.27Å; H159-D163 WeakPolarHBondContact O-CB 3.4Å; H159-D163 PolarHBondContact O-N 2.97Å
160S39Very low55.6Low99 Ų9993.6 Ų93.669%0.69247%0.471SS*.Hα-helixtrans-64.7-23.5176-600000114.2S157 Q158S157-S160 PolarHBondContact O-N 3.33Å; Q158-S160 PolarHBondContact O-N 3.37Å
161E31.9Very low53.4Low145 Ų14590.9 Ų90.968%0.67847%0.468SS*.Hα-helixtrans-88.3-40.8179.4-159.1170-168.900111.6Q158 H159 D163 S164 V165Q158-E161 PolarHBondContact O-N 3.42Å; H159-E161 PolarHBondContact O-N 3.37Å; E161-D163 VanDerWaalsContact C-N 3.35Å; E161-D163 PolarHBondContact O-N 3.25Å; E161-S164 PolarHBondContact O-N 3.45Å; E161-S164 PolarHBondContact O-OG 3.46Å; E161-V165 PolarHBondContact O-N 3.09Å
162V36.7Very low51.4Low79 Ų7996.2 Ų96.248%0.47949%0.493SS..Hα-helixtrans-68.3-34.6176.7-1770000111.6S164 V165 N166V162-S164 VanDerWaalsContact C-N 3.3Å; V162-S164 PolarHBondContact O-N 2.94Å; V162-V165 PolarHBondContact O-N 3Å; V162-N166 PolarHBondContact O-N 3.27Å; V162-N166 PolarHBondContact O-ND2 3.11Å
163D40.3Very low49.3Very low91 Ų91100.6 Ų100.649%0.48752%0.521SS..Hα-helixtrans-69.3-29.5177-68.9-19.1000112.1H159 E161 L167H159-D163 VanDerWaalsContact O-CB 3.27Å; H159-D163 WeakPolarHBondContact O-CB 3.4Å; H159-D163 PolarHBondContact O-N 2.97Å; E161-D163 VanDerWaalsContact C-N 3.35Å; E161-D163 PolarHBondContact O-N 3.25Å; D163-L167 WeakPolarHBondContact O-CB 3.48Å; D163-L167 PolarHBondContact O-N 3Å
164S39Very low47.2Very low66 Ų66107.1 Ų107.146%0.46254%0.544SS..Hα-helixtrans-68.8-37.6174.276.80000112.2E161 V162 Y168E161-S164 PolarHBondContact O-N 3.45Å; E161-S164 PolarHBondContact O-OG 3.46Å; V162-S164 VanDerWaalsContact C-N 3.3Å; V162-S164 PolarHBondContact O-N 2.94Å; S164-Y168 VanDerWaalsContact O-CB 3.29Å; S164-Y168 WeakPolarHBondContact O-CB 3.34Å; S164-Y168 PolarHBondContact O-N 3.26Å
165V47.3Very low45.3Very low75 Ų75112.1 Ų112.146%0.45557%0.57SS.*Hα-helixtrans-71.7-38.91761790000111.3E161 V162 Y168 K169E161-V165 PolarHBondContact O-N 3.09Å; V162-V165 PolarHBondContact O-N 3Å; V165-Y168 PolarHBondContact O-N 3.08Å; V165-K169 WeakPolarHBondContact O-CB 3.37Å; V165-K169 PolarHBondContact O-N 3.36Å
166N44.9Very low44.2Very low75 Ų75110.8 Ų110.840%0.40158%0.575SS.*Hα-helixtrans-71.1-40.2176.8-74.3-25.4000112.1V162 Y168 K169 I170V162-N166 PolarHBondContact O-N 3.27Å; V162-N166 PolarHBondContact O-ND2 3.11Å; N166-Y168 VanDerWaalsContact C-N 3.32Å; N166-Y168 PolarHBondContact O-N 3.37Å; N166-K169 PolarHBondContact O-N 3.39Å; N166-I170 WeakPolarHBondContact O-CB 3.39Å; N166-I170 WeakPolarHBondContact O-CD1 3.33Å; N166-I170 WeakPolarHBondContact O-CG1 3.39Å; N166-I170 PolarHBondContact O-N 2.91Å
167L49Very low43.7Very low110 Ų110105.4 Ų105.458%0.57658%0.575SS**Hα-helixtrans-63.2-39.2173.6-170.970.9000111.4D163 I170 N171D163-L167 WeakPolarHBondContact O-CB 3.48Å; D163-L167 PolarHBondContact O-N 3Å; L167-I170 PolarHBondContact O-N 3.28Å; L167-N171 PolarHBondContact O-N 2.99Å; L167-N171 VanDerWaalsContact O-N 3.08Å
168Y44.4Very low43.2Very low153 Ų153109.1 Ų109.160%0.660%0.596SS**Hα-helixtrans-65.5-42.8174.4-170.6-105.1000112.3S164 V165 N166 N171 Q172S164-Y168 VanDerWaalsContact O-CB 3.29Å; S164-Y168 WeakPolarHBondContact O-CB 3.34Å; S164-Y168 PolarHBondContact O-N 3.26Å; V165-Y168 PolarHBondContact O-N 3.08Å; N166-Y168 VanDerWaalsContact C-N 3.32Å; N166-Y168 PolarHBondContact O-N 3.37Å; Y168-N171 PolarHBondContact O-N 3.36Å; Y168-Q172 HydrophobicContact CE1-CG 4.35Å; Y168-Q172 PolarHBondContact O-N 3.31Å; Y168-Q172 PolarHBondContact OH-NE2 3.08Å
169K46.2Very low43.1Very low135 Ų135106.5 Ų106.559%0.58759%0.592SS**Hα-helixtrans-64.5-38.1175.1-87.7-176.8175.1178.20113.4V165 N166 Q172 T173V165-K169 WeakPolarHBondContact O-CB 3.37Å; V165-K169 PolarHBondContact O-N 3.36Å; N166-K169 PolarHBondContact O-N 3.39Å; K169-Q172 PolarHBondContact O-N 2.82Å; K169-T173 PolarHBondContact O-N 3.44Å; K169-T173 PolarHBondContact O-OG1 2.81Å
170I52Low43.1Very low77 Ų77108.2 Ų108.240%0.39561%0.605SS.*Hα-helixtrans-68.7-37178-67.6162.6000110.7N166 L167 T173 R174N166-I170 WeakPolarHBondContact O-CB 3.39Å; N166-I170 WeakPolarHBondContact O-CD1 3.33Å; N166-I170 WeakPolarHBondContact O-CG1 3.39Å; N166-I170 PolarHBondContact O-N 2.91Å; L167-I170 PolarHBondContact O-N 3.28Å; I170-T173 PolarHBondContact O-N 3.28Å; I170-T173 PolarHBondContact O-OG1 2.85Å; I170-R174 WeakPolarHBondContact O-CG 3.4Å; I170-R174 PolarHBondContact O-N 3.22Å
171N47Very low43Very low95 Ų95108.3 Ų108.351%0.50860%0.601SS.*Hα-helixtrans-72.5-34177.2-75.5-14000112.6L167 Y168 T173 R174L167-N171 PolarHBondContact O-N 2.99Å; L167-N171 VanDerWaalsContact O-N 3.08Å; Y168-N171 PolarHBondContact O-N 3.36Å; N171-T173 VanDerWaalsContact C-N 3.34Å; N171-R174 PolarHBondContact O-N 3.48Å
172Q53.1Low43.3Very low114 Ų114109.9 Ų109.953%0.53361%0.608SS.*Hα-helixtrans-69.5-28.8174.4-76.2-166.7-3.100113.7Y168 K169Y168-Q172 HydrophobicContact CE1-CG 4.35Å; Y168-Q172 PolarHBondContact O-N 3.31Å; Y168-Q172 PolarHBondContact OH-NE2 3.08Å; K169-Q172 PolarHBondContact O-N 2.82Å
173T48.4Very low43.1Very low106 Ų106116.3 Ų116.365%0.6563%0.63SS**Hα-helixtrans-83-11.7178.737.10000113.5K169 I170 N171 T175K169-T173 PolarHBondContact O-N 3.44Å; K169-T173 PolarHBondContact O-OG1 2.81Å; I170-T173 PolarHBondContact O-N 3.28Å; I170-T173 PolarHBondContact O-OG1 2.85Å; N171-T173 VanDerWaalsContact C-N 3.34Å; T173-T175 PolarHBondContact O-N 2.85Å
174R44.6Very low42.6Very low141 Ų141119.5 Ų119.553%0.53264%0.644SS.*THydrogen-bonded Turntrans-87.79.6-177.2-83.1-175-169.7-172.34.5116I170 N171 S176I170-R174 WeakPolarHBondContact O-CG 3.4Å; I170-R174 PolarHBondContact O-N 3.22Å; N171-R174 PolarHBondContact O-N 3.48Å; R174-S176 PolarHBondContact O-N 3.45Å
175T43.9Very low42.5Very low129 Ų129120.9 Ų120.979%0.79165%0.646SS**THydrogen-bonded Turntrans-78.83.7168.147.10000114T173T173-T175 PolarHBondContact O-N 2.85Å
176S43.8Very low41.7Very low103 Ų103123 Ų12372%0.7266%0.659SS**SBendtrans-136.9109175.8-57.90000111.1R174R174-S176 PolarHBondContact O-N 3.45Å
177G39.1Very low41.3Very low81 Ų81127.2 Ų127.284%0.83568%0.676SS**  trans120.3121.8159.600000116.4
178T36.1Very low40.9Very low129 Ų129129.5 Ų129.579%0.79169%0.689SS**  trans-73.4147.4-171.219.90000116.9
179T37.7Very low40.7Very low116 Ų116126.5 Ų126.571%0.71269%0.69SS**SBendtrans63.1122142.756.20000121.5
180N39.8Very low40.8Very low154 Ų154126.8 Ų126.882%0.82470%0.697SS**  trans107.430.3153.8-58-13.5000120.7
181T36.8Very low40.4Very low100 Ų100132.2 Ų132.261%0.61372%0.717SS**  trans-115.630.6166.818.40000114.7K183T181-K183 VanDerWaalsContact C-N 3.28Å; T181-K183 PolarHBondContact O-N 3.49Å
182H38.5Very low41Very low178 Ų178134.4 Ų134.482%0.82473%0.729SS**THydrogen-bonded Turntrans-75.4-3.1177.8-98.1-82.1000115.7
183K33.9Very low41.6Very low215 Ų215136.8 Ų136.894%0.93574%0.74SS**THydrogen-bonded Turntrans-108.94.7-179.9-83.2-174176.5179.30115.8T181T181-K183 VanDerWaalsContact C-N 3.28Å; T181-K183 PolarHBondContact O-N 3.49Å
184M28.7Very low43Very low158 Ų158137 Ų13778%0.77874%0.744SS**SBendtrans-13527.3178.6-153179.3155.500112.2
185L36.3Very low45Very low95 Ų95133.2 Ų133.250%0.49773%0.731SS.*SBendtrans-109.611.5178-94.7161.8000113.5
186T32.1Very low47.1Very low119 Ų119134.4 Ų134.473%0.7373%0.725SS**SBendtrans-121.516.8178-10.60000114.3
187E36.3Very low49.4Very low163 Ų163130.8 Ų130.876%0.76270%0.7SS**SBendtrans-112.4-10.5172-93.5-172.6158.200114.9S189E187-S189 PolarHBondContact O-N 3.21Å; E187-S189 VanDerWaalsContact O-N 3.12Å
188N39.1Very low51.9Low158 Ų158128.6 Ų128.685%0.84567%0.67SS**  trans-80.826162.6-74.5-0.7000111.7I190N188-I190 VanDerWaalsContact C-N 3.35Å; N188-I190 PolarHBondContact O-N 3.36Å
189S41.6Very low54.5Low90 Ų90125.3 Ų125.363%0.62965%0.645SS**  trans-47.7110.4157.1-127.50000105.5E187 K191E187-S189 PolarHBondContact O-N 3.21Å; E187-S189 VanDerWaalsContact O-N 3.12Å; S189-K191 PolarHBondContact O-N 3.49Å
190I47.1Very low57Low141 Ų141121.5 Ų121.572%0.72362%0.622SS**  trans-43.795.5171.6-60.9162.1000105.2N188 N192N188-I190 VanDerWaalsContact C-N 3.35Å; N188-I190 PolarHBondContact O-N 3.36Å; I190-N192 WeakPolarHBondContact CG2-OD1 3.33Å; I190-N192 PolarHBondContact O-N 3.26Å
191K45.3Very low59.2Low191 Ų191118.3 Ų118.383%0.8361%0.611SS**  trans-69.290.6170.4-77.8-177.5-178.3174.60101.7S189 E193S189-K191 PolarHBondContact O-N 3.49Å; K191-E193 PolarHBondContact O-N 2.86Å
192N58Low61.7Low142 Ų142121 Ų12176%0.75962%0.617SS**  trans-50.5100.4165.9-73.9-25.4000104.3I190I190-N192 WeakPolarHBondContact CG2-OD1 3.33Å; I190-N192 PolarHBondContact O-N 3.26Å
193E65.9Low64.3Low163 Ų163115.3 Ų115.376%0.76259%0.589SS**PPolyproline II helixtrans-54.8132.7177.6-83.6-139.6144.200106.9K191 F195K191-E193 PolarHBondContact O-N 2.86Å; E193-F195 PolarHBondContact O-N 3.26Å
194P77.8Confident66.9Low112 Ų112109 Ų10973%0.72756%0.562SS**PPolyproline II helixtrans-57.7139.4-178.324.1-33.1000109.4K196P194-K196 PolarHBondContact O-N 3.01Å; P194-K196 VanDerWaalsContact O-N 3.11Å
195F86.3Confident70Confident60 Ų60108.9 Ų108.926%0.26356%0.558SS.*PPolyproline II helixtrans-52.1120.6-179.3173.1-89.6000110.9R79 P83 C86 E193 C197R79-F195 WeakPolarHBondContact O-CE1 3.49Å; P83-F195 VanDerWaalsContact CA-CZ 3.44Å; P83-F195 HydrophobicContact CB-CE2 3.88Å; P83-F195 HydrophobicContact CB-CZ 4.02Å; C86-F195 HydrophobicContact CB-CE1 3.81Å; C86-F195 HydrophobicContact CB-CZ 4.07Å; E193-F195 PolarHBondContact O-N 3.26Å; F195-C197 HydrophobicContact CE1-CB 4.18Å
196K88.2Confident72.7Confident155 Ų155108.1 Ų108.167%0.67455%0.553SS**  trans-111.3118.6177.7-170.7176-178.81790110.7H155 P194 T198H155-K196 PolarHBondContact N-O 3.07Å; P194-K196 PolarHBondContact O-N 3.01Å; P194-K196 VanDerWaalsContact O-N 3.11Å; K196-T198 PolarHBondContact O-N 3.39Å
197C91.9Very high75.6Confident27 Ų27104.2 Ų104.218%0.18253%0.526CS..EExtended strand (participates in β ladder)trans-70.8113.4177.4-1770000110.9R79 C86 G153 F195R79-C197 HydrophobicContact CB-CB 3.77Å; C86-C197 HydrophobicContact CB-CB 3.68Å; C86-C197 WeakPolarHBondContact CB-SG 3.38Å; C86-C197 WeakPolarHBondContact SG-CB 3.41Å; C86-C197 CovalentContact SG-SG 2.02Å; C86-C197 PolarHBondContact SG-SG 3.48Å; G153-C197 WeakPolarHBondContact O-CA 3.29Å; F195-C197 HydrophobicContact CE1-CB 4.18Å
198T91.6Very high78.2Confident35 Ų35103.5 Ų103.522%0.21552%0.517CS..EExtended strand (participates in β ladder)trans-147.1169.7179.4-1760000110.3G153 H155 K196G153-T198 CarbonylContact C-O 3.6Å; G153-T198 PolarHBondContact N-O 3.24Å; G153-T198 PolarHBondContact O-N 3.42Å; H155-T198 HydrophobicContact CB-CG2 3.85Å; K196-T198 PolarHBondContact O-N 3.39Å
199F91.5Very high80.8Confident59 Ų59100.3 Ų100.326%0.25950%0.499SS..EExtended strand (participates in β ladder)trans-66.8148.2167.469.9-88.2000110.1M151 M152 E204 F207M151-F199 WeakPolarHBondContact O-CA 3.33Å; M152-F199 HydrophobicContact SD-CB 4.14Å; F199-E204 HydrophobicContact CE2-CB 3.87Å; F199-E204 HydrophobicContact CE2-CG 3.85Å; F199-E204 HydrophobicContact CZ-CG 4.24Å; F199-F207 HydrophobicContact CB-CD1 4.28Å; F199-F207 HydrophobicContact CB-CD2 3.9Å; F199-F207 HydrophobicContact CB-CE2 4.16Å; F199-F207 HydrophobicContact CB-CG 3.96Å; F199-F207 HydrophobicContact CB-CZ 4.47Å; F199-F207 AromaticContact CD1-CD1 3.87Å; F199-F207 HydrophobicContact CD1-CD1 3.87Å; F199-F207 AromaticContact CD1-CE1 3.79Å; F199-F207 HydrophobicContact CD1-CE1 3.79Å; F199-F207 HydrophobicContact CD1-CG 4.42Å; F199-F207 HydrophobicContact CD1-CZ 4.27Å; F199-F207 HydrophobicContact CD2-CD1 4.49Å; F199-F207 HydrophobicContact CE1-CD1 4.36Å; F199-F207 HydrophobicContact CE1-CE1 4.33Å; F199-F207 AromaticContact CG-CD1 3.96Å; F199-F207 HydrophobicContact CG-CD1 3.96Å; F199-F207 HydrophobicContact CG-CD2 4.46Å; F199-F207 HydrophobicContact CG-CE1 4.27Å; F199-F207 HydrophobicContact CG-CG 4.07Å
200V90.9Very high83.3Confident37 Ų3796.5 Ų96.522%0.22447%0.471CS..  trans-75.9132.9174.2-178.50000109M151 E202 Y203M151-V200 PolarHBondContact O-N 2.65Å; V200-E202 HydrophobicContact CG1-CB 4.34Å; V200-E202 PolarHBondContact O-N 3.46Å; V200-Y203 HydrophobicContact CB-CD2 3.88Å; V200-Y203 HydrophobicContact CB-CE2 4.26Å; V200-Y203 HydrophobicContact CG1-CD2 4.4Å; V200-Y203 HydrophobicContact CG1-CE2 4.47Å; V200-Y203 PolarHBondContact O-N 3.26Å
201S86.3Confident85.4Confident86 Ų8693.5 Ų93.560%0.60146%0.455SS*.G310 helixtrans-55.1-36.1-173.746.80000113.8Y203 E204S201-Y203 PolarHBondContact O-N 2.9Å; S201-Y203 VanDerWaalsContact O-N 3.09Å; S201-E204 WeakPolarHBondContact O-CB 3.31Å; S201-E204 PolarHBondContact O-N 3.44Å; S201-E204 VanDerWaalsContact O-N 3.13Å
202E89.3Confident87.7Confident157 Ų15789.4 Ų89.473%0.73444%0.437SS*.G310 helixtrans-56.8-25176.5-65.6171-151.500113.5V200V200-E202 HydrophobicContact CG1-CB 4.34Å; V200-E202 PolarHBondContact O-N 3.46Å
203Y91.6Very high89.3Confident59 Ų5987.8 Ų87.823%0.23142%0.423CS..G310 helixtrans-106.315-177.4-52.8-51.9000113.5W150 M151 V200 S201 F205 I206 F207W150-Y203 AromaticContact NE1-CE2 3.92Å; W150-Y203 AromaticContact NE1-CZ 3.59Å; W150-Y203 PolarHBondContact NE1-OH 3.24Å; M151-Y203 HydrophobicContact CB-CD2 4.48Å; M151-Y203 HydrophobicContact CG-CD2 4.43Å; M151-Y203 HydrophobicContact CG-CG 4.32Å; V200-Y203 HydrophobicContact CB-CD2 3.88Å; V200-Y203 HydrophobicContact CB-CE2 4.26Å; V200-Y203 HydrophobicContact CG1-CD2 4.4Å; V200-Y203 HydrophobicContact CG1-CE2 4.47Å; V200-Y203 PolarHBondContact O-N 3.26Å; S201-Y203 PolarHBondContact O-N 2.9Å; S201-Y203 VanDerWaalsContact O-N 3.09Å; Y203-F205 VanDerWaalsContact C-N 3.32Å; Y203-F205 PolarHBondContact O-N 3.06Å; Y203-I206 PolarHBondContact O-N 3.16Å; Y203-F207 VanDerWaalsContact O-CB 3.31Å; Y203-F207 WeakPolarHBondContact O-CB 3.17Å; Y203-F207 PolarHBondContact O-N 3.49Å
204E90Very high90.6Very high82 Ų8281.8 Ų81.838%0.38340%0.396SS..Hα-helixtrans-52.6-48-175.8-173.2-172.6156.900112.6F199 S201 F207 R208F199-E204 HydrophobicContact CE2-CB 3.87Å; F199-E204 HydrophobicContact CE2-CG 3.85Å; F199-E204 HydrophobicContact CZ-CG 4.24Å; S201-E204 WeakPolarHBondContact O-CB 3.31Å; S201-E204 PolarHBondContact O-N 3.44Å; S201-E204 VanDerWaalsContact O-N 3.13Å; E204-F207 PolarHBondContact O-N 3.06Å; E204-R208 WeakPolarHBondContact O-CG 3.18Å; E204-R208 PolarHBondContact O-N 2.98Å; E204-R208 IonicContact OE1-CZ 2.67Å; E204-R208 IonicContact OE1-NE 3.58Å; E204-R208 PolarHBondContact OE1-NE 3.4Å; E204-R208 IonicContact OE1-NH2 2.6Å; E204-R208 PolarHBondContact OE1-NH2 3.18Å
205F92.7Very high91.2Very high155 Ų15577.9 Ų77.968%0.6837%0.369SS*.Hα-helixtrans-62.2-46.9-178.7179.8-103.3000112.2Y203 F207 R208 I209Y203-F205 VanDerWaalsContact C-N 3.32Å; Y203-F205 PolarHBondContact O-N 3.06Å; F205-F207 VanDerWaalsContact C-N 3.34Å; F205-F207 PolarHBondContact O-N 3.08Å; F205-R208 PolarHBondContact O-N 3.05Å; F205-I209 HydrophobicContact CD1-CD1 3.95Å; F205-I209 HydrophobicContact CE1-CD1 3.37Å; F205-I209 HydrophobicContact CE1-CG1 4.5Å; F205-I209 HydrophobicContact CE2-CD1 4.33Å; F205-I209 HydrophobicContact CZ-CD1 3.6Å; F205-I209 PolarHBondContact O-N 3.46Å; F205-I209 VanDerWaalsContact O-N 3.15Å
206I93.4Very high91.5Very high79 Ų7978.7 Ų78.741%0.40538%0.376SS..Hα-helixtrans-65.2-41.3179.2-57176.8000110.1M151 Y203 R208 I209 F210M151-I206 HydrophobicContact SD-CB 4.08Å; M151-I206 HydrophobicContact SD-CG2 3.65Å; Y203-I206 PolarHBondContact O-N 3.16Å; I206-R208 VanDerWaalsContact C-N 3.35Å; I206-R208 PolarHBondContact O-N 2.82Å; I206-I209 PolarHBondContact O-N 3.01Å; I206-F210 WeakPolarHBondContact O-CB 3.34Å; I206-F210 PolarHBondContact O-N 2.93Å
207F93.1Very high91.7Very high37 Ų3772.6 Ų72.616%0.16235%0.352CS..Hα-helixtrans-60.2-43.4176.5-179.3-100.7000111.6H148 M151 M152 F199 Y203 E204 F205 I209 F210 M211H148-F207 AromaticContact NE2-CE2 3.74Å; M151-F207 HydrophobicContact CE-CD2 4.2Å; M151-F207 HydrophobicContact SD-CB 4.08Å; M152-F207 HydrophobicContact SD-CE2 4.31Å; F199-F207 HydrophobicContact CB-CD1 4.28Å; F199-F207 HydrophobicContact CB-CD2 3.9Å; F199-F207 HydrophobicContact CB-CE2 4.16Å; F199-F207 HydrophobicContact CB-CG 3.96Å; F199-F207 HydrophobicContact CB-CZ 4.47Å; F199-F207 AromaticContact CD1-CD1 3.87Å; F199-F207 HydrophobicContact CD1-CD1 3.87Å; F199-F207 AromaticContact CD1-CE1 3.79Å; F199-F207 HydrophobicContact CD1-CE1 3.79Å; F199-F207 HydrophobicContact CD1-CG 4.42Å; F199-F207 HydrophobicContact CD1-CZ 4.27Å; F199-F207 HydrophobicContact CD2-CD1 4.49Å; F199-F207 HydrophobicContact CE1-CD1 4.36Å; F199-F207 HydrophobicContact CE1-CE1 4.33Å; F199-F207 AromaticContact CG-CD1 3.96Å; F199-F207 HydrophobicContact CG-CD1 3.96Å; F199-F207 HydrophobicContact CG-CD2 4.46Å; F199-F207 HydrophobicContact CG-CE1 4.27Å; F199-F207 HydrophobicContact CG-CG 4.07Å; Y203-F207 VanDerWaalsContact O-CB 3.31Å; Y203-F207 WeakPolarHBondContact O-CB 3.17Å; Y203-F207 PolarHBondContact O-N 3.49Å; E204-F207 PolarHBondContact O-N 3.06Å; F205-F207 VanDerWaalsContact C-N 3.34Å; F205-F207 PolarHBondContact O-N 3.08Å; F207-I209 PolarHBondContact O-N 2.96Å; F207-F210 WeakPolarHBondContact O-CB 3.3Å; F207-F210 PolarHBondContact O-N 3.48Å; F207-M211 HydrophobicContact CD1-CG 4.23Å; F207-M211 HydrophobicContact CE1-CG 3.82Å; F207-M211 HydrophobicContact CE1-SD 4.45Å; F207-M211 HydrophobicContact CE2-CG 4.23Å; F207-M211 HydrophobicContact CE2-SD 4.07Å; F207-M211 HydrophobicContact CZ-CG 3.82Å; F207-M211 HydrophobicContact CZ-SD 3.84Å; F207-M211 WeakPolarHBondContact O-CG 3.15Å; F207-M211 PolarHBondContact O-N 2.96Å
208R91.6Very high91.7Very high149 Ų14972.9 Ų72.956%0.56235%0.351SS*.Hα-helixtrans-61.8-40.4175.6-72.1177.1-175.7-77.12.7112.5E204 F205 I206 K212E204-R208 WeakPolarHBondContact O-CG 3.18Å; E204-R208 PolarHBondContact O-N 2.98Å; E204-R208 IonicContact OE1-CZ 2.67Å; E204-R208 IonicContact OE1-NE 3.58Å; E204-R208 PolarHBondContact OE1-NE 3.4Å; E204-R208 IonicContact OE1-NH2 2.6Å; E204-R208 PolarHBondContact OE1-NH2 3.18Å; F205-R208 PolarHBondContact O-N 3.05Å; I206-R208 VanDerWaalsContact C-N 3.35Å; I206-R208 PolarHBondContact O-N 2.82Å; R208-K212 PolarHBondContact O-N 2.93Å
209I93.1Very high91.6Very high91 Ų9171.6 Ų71.647%0.46734%0.343SS..Hα-helixtrans-65.7-46174.9-67.9173.5000110.6F205 I206 F207 M211 K212 F213F205-I209 HydrophobicContact CD1-CD1 3.95Å; F205-I209 HydrophobicContact CE1-CD1 3.37Å; F205-I209 HydrophobicContact CE1-CG1 4.5Å; F205-I209 HydrophobicContact CE2-CD1 4.33Å; F205-I209 HydrophobicContact CZ-CD1 3.6Å; F205-I209 PolarHBondContact O-N 3.46Å; F205-I209 VanDerWaalsContact O-N 3.15Å; I206-I209 PolarHBondContact O-N 3.01Å; F207-I209 PolarHBondContact O-N 2.96Å; I209-M211 VanDerWaalsContact C-N 3.33Å; I209-M211 PolarHBondContact O-N 3.15Å; I209-K212 WeakPolarHBondContact O-CB 3.37Å; I209-K212 PolarHBondContact O-N 3.35Å; I209-K212 VanDerWaalsContact O-N 3.14Å; I209-F213 PolarHBondContact O-N 3.26Å; I209-F213 VanDerWaalsContact O-N 3.08Å
210F94.6Very high91.6Very high9 Ų972.1 Ų72.14%0.03935%0.351CS..Hα-helixtrans-56.2-46.7177.7175.6-92.4000111.6K144 L147 H148 M151 I206 F207 K212 F213 D214K144-F210 HydrophobicContact CG-CE2 4.13Å; K144-F210 WeakPolarHBondContact O-CE2 3.39Å; L147-F210 HydrophobicContact CD2-CD2 4.13Å; H148-F210 HydrophobicContact CB-CE1 3.88Å; H148-F210 HydrophobicContact CB-CE2 4.28Å; H148-F210 HydrophobicContact CB-CZ 3.67Å; H148-F210 AromaticContact CG-CE1 3.77Å; H148-F210 AromaticContact ND1-CE1 3.83Å; M151-F210 HydrophobicContact CE-CB 3.78Å; M151-F210 HydrophobicContact CE-CD1 4.09Å; M151-F210 HydrophobicContact CE-CD2 4.15Å; M151-F210 HydrophobicContact CE-CG 3.73Å; I206-F210 WeakPolarHBondContact O-CB 3.34Å; I206-F210 PolarHBondContact O-N 2.93Å; F207-F210 WeakPolarHBondContact O-CB 3.3Å; F207-F210 PolarHBondContact O-N 3.48Å; F210-K212 VanDerWaalsContact C-N 3.27Å; F210-K212 PolarHBondContact O-N 3.44Å; F210-F213 CarbonylContact O-C 3.59Å; F210-F213 WeakPolarHBondContact O-CB 3.48Å; F210-F213 PolarHBondContact O-N 3.31Å; F210-F213 VanDerWaalsContact O-N 3.11Å; F210-D214 HydrophobicContact CE1-CB 4.29Å; F210-D214 WeakPolarHBondContact O-CB 3.37Å; F210-D214 PolarHBondContact O-N 3.11Å
211M91.5Very high91.7Very high78 Ų7874.4 Ų74.438%0.38436%0.362SS..Hα-helixtrans-62.8-31.7179.4-68.2-53.9-57.500113.1F207 I209 L215F207-M211 HydrophobicContact CD1-CG 4.23Å; F207-M211 HydrophobicContact CE1-CG 3.82Å; F207-M211 HydrophobicContact CE1-SD 4.45Å; F207-M211 HydrophobicContact CE2-CG 4.23Å; F207-M211 HydrophobicContact CE2-SD 4.07Å; F207-M211 HydrophobicContact CZ-CG 3.82Å; F207-M211 HydrophobicContact CZ-SD 3.84Å; F207-M211 WeakPolarHBondContact O-CG 3.15Å; F207-M211 PolarHBondContact O-N 2.96Å; I209-M211 VanDerWaalsContact C-N 3.33Å; I209-M211 PolarHBondContact O-N 3.15Å; M211-L215 WeakPolarHBondContact O-CB 3.32Å; M211-L215 PolarHBondContact O-N 3.09Å
212K91.6Very high92.1Very high106 Ų10670.4 Ų70.446%0.46133%0.334SS..Hα-helixtrans-68.1-44.5172.4-69.1178.6178.4-177.90111.4R208 I209 F210 D214 L215 I216R208-K212 PolarHBondContact O-N 2.93Å; I209-K212 WeakPolarHBondContact O-CB 3.37Å; I209-K212 PolarHBondContact O-N 3.35Å; I209-K212 VanDerWaalsContact O-N 3.14Å; F210-K212 VanDerWaalsContact C-N 3.27Å; F210-K212 PolarHBondContact O-N 3.44Å; K212-D214 VanDerWaalsContact C-N 3.32Å; K212-L215 PolarHBondContact O-N 2.86Å; K212-I216 WeakPolarHBondContact O-CG1 3.32Å; K212-I216 PolarHBondContact O-N 3.1Å
213F92.6Very high92.3Very high108 Ų10864.3 Ų64.347%0.47430%0.304SS..Hα-helixtrans-64.3-38.8176.1-178.6-98.3000112.2K144 I209 F210 I216 S217K144-F213 HydrophobicContact CD-CD1 3.95Å; K144-F213 HydrophobicContact CD-CE1 3.58Å; K144-F213 HydrophobicContact CG-CD1 4.26Å; K144-F213 HydrophobicContact CG-CE1 3.87Å; I209-F213 PolarHBondContact O-N 3.26Å; I209-F213 VanDerWaalsContact O-N 3.08Å; F210-F213 CarbonylContact O-C 3.59Å; F210-F213 WeakPolarHBondContact O-CB 3.48Å; F210-F213 PolarHBondContact O-N 3.31Å; F210-F213 VanDerWaalsContact O-N 3.11Å; F213-I216 PolarHBondContact O-N 2.95Å; F213-S217 WeakPolarHBondContact CE1-OG 3.48Å; F213-S217 WeakPolarHBondContact O-CB 3.25Å; F213-S217 PolarHBondContact O-N 3.44Å; F213-S217 PolarHBondContact O-OG 3.48Å
214D92.7Very high92.5Very high37 Ų3766.3 Ų66.320%0.19832%0.318CS..Hα-helixtrans-60.8-48.6175.1-166.166.9000110.9K144 F210 K212 I216 S217 F218K144-D214 IonicContact NZ-OD1 3.16Å; K144-D214 PolarHBondContact NZ-OD1 2.96Å; F210-D214 HydrophobicContact CE1-CB 4.29Å; F210-D214 WeakPolarHBondContact O-CB 3.37Å; F210-D214 PolarHBondContact O-N 3.11Å; K212-D214 VanDerWaalsContact C-N 3.32Å; D214-I216 VanDerWaalsContact C-N 3.35Å; D214-I216 PolarHBondContact O-N 2.69Å; D214-S217 PolarHBondContact O-N 2.91Å; D214-F218 WeakPolarHBondContact O-CB 3.43Å; D214-F218 PolarHBondContact O-N 2.85Å
215L91.7Very high92.7Very high30 Ų3065.2 Ų65.216%0.15731%0.314CS..Hα-helixtrans-58.3-43.7175.2-177.666.5000112.2M211 K212 A219 Y332M211-L215 WeakPolarHBondContact O-CB 3.32Å; M211-L215 PolarHBondContact O-N 3.09Å; K212-L215 PolarHBondContact O-N 2.86Å; L215-A219 HydrophobicContact CD1-CB 4.21Å; L215-A219 WeakPolarHBondContact O-CA 3.38Å; L215-A219 WeakPolarHBondContact O-CB 3.38Å; L215-A219 PolarHBondContact O-N 3.5Å; L215-Y332 HydrophobicContact CD2-CE2 4.07Å
216I92.1Very high92.8Very high77 Ų7757.9 Ų57.940%0.39528%0.282SS..Iπ-helixtrans-63.6-46177.4-68.3166.5000110.7K212 F213 D214 V220 L221K212-I216 WeakPolarHBondContact O-CG1 3.32Å; K212-I216 PolarHBondContact O-N 3.1Å; F213-I216 PolarHBondContact O-N 2.95Å; D214-I216 VanDerWaalsContact C-N 3.35Å; D214-I216 PolarHBondContact O-N 2.69Å; I216-V220 HydrophobicContact CG2-CB 4.3Å; I216-V220 WeakPolarHBondContact O-CA 3.39Å; I216-V220 WeakPolarHBondContact O-CB 3.5Å; I216-V220 PolarHBondContact O-N 3.02Å; I216-L221 PolarHBondContact O-N 3.29Å
217S92Very high92.8Very high26 Ų2659.1 Ų59.118%0.18229%0.285CS..Iπ-helixtrans-68.5-37.4-177-58.70000112.5F213 D214 P222F213-S217 WeakPolarHBondContact CE1-OG 3.48Å; F213-S217 WeakPolarHBondContact O-CB 3.25Å; F213-S217 PolarHBondContact O-N 3.44Å; F213-S217 PolarHBondContact O-OG 3.48Å; D214-S217 PolarHBondContact O-N 2.91Å; S217-P222 WeakPolarHBondContact O-CD 3.34Å
218F91.9Very high92.8Very high34 Ų3460.8 Ų60.815%0.14930%0.298CS..Iπ-helixtrans-85.5-33.4-177.1-175.4-96.2000113.3V101 D214 P222 I355V101-F218 HydrophobicContact CG2-CD2 4.04Å; V101-F218 HydrophobicContact CG2-CE2 3.7Å; V101-F218 HydrophobicContact CG2-CZ 4.48Å; D214-F218 WeakPolarHBondContact O-CB 3.43Å; D214-F218 PolarHBondContact O-N 2.85Å; F218-P222 WeakPolarHBondContact O-CG 3.35Å; F218-I355 HydrophobicContact CE1-CG2 4.14Å; F218-I355 HydrophobicContact CZ-CG2 3.74Å
219A89.3Confident92.9Very high7 Ų753.8 Ų53.86%0.05827%0.272CS..Iπ-helixtrans-105.9-54.8-175.900000112.6L215 P222 Y223 T324L215-A219 HydrophobicContact CD1-CB 4.21Å; L215-A219 WeakPolarHBondContact O-CA 3.38Å; L215-A219 WeakPolarHBondContact O-CB 3.38Å; L215-A219 PolarHBondContact O-N 3.5Å; A219-P222 WeakPolarHBondContact O-CD 3.11Å; A219-Y223 WeakPolarHBondContact O-CD2 3.34Å; A219-Y223 WeakPolarHBondContact O-CE2 3.5Å; A219-T324 HydrophobicContact CB-CG2 3.47Å; A219-T324 VanDerWaalsContact CB-CG2 3.47Å
220V91.3Very high92.9Very high71 Ų7150.3 Ų50.343%0.4326%0.255SS..Iπ-helixtrans-74.2-50.1-168.8-178.70000111.6I216 Y223 L224I216-V220 HydrophobicContact CG2-CB 4.3Å; I216-V220 WeakPolarHBondContact O-CA 3.39Å; I216-V220 WeakPolarHBondContact O-CB 3.5Å; I216-V220 PolarHBondContact O-N 3.02Å; V220-Y223 PolarHBondContact O-N 3.33Å; V220-L224 HydrophobicContact CG1-CD1 4.02Å; V220-L224 HydrophobicContact CG1-CG 4.37Å; V220-L224 WeakPolarHBondContact O-CG 3.48Å; V220-L224 PolarHBondContact O-N 2.87Å
221L93.4Very high92.9Very high84 Ų8453.8 Ų53.844%0.4428%0.276SS..Hα-helixtrans-60.3-45.3-176.6-65-178.8000113.4I216 Y223 L224 I225I216-L221 PolarHBondContact O-N 3.29Å; L221-Y223 PolarHBondContact O-N 2.99Å; L221-L224 PolarHBondContact O-N 3Å; L221-I225 WeakPolarHBondContact O-CG1 3.45Å; L221-I225 PolarHBondContact O-N 3.34Å
222P94.9Very high93Very high2 Ų253.5 Ų53.51%0.01328%0.276CS..Hα-helixtrans-63.8-40.8-180-2538.3000111.9V101 S217 F218 A219 L224 I225 L226V101-P222 HydrophobicContact CG1-CB 3.83Å; V101-P222 HydrophobicContact CG1-CG 3.17Å; S217-P222 WeakPolarHBondContact O-CD 3.34Å; F218-P222 WeakPolarHBondContact O-CG 3.35Å; A219-P222 WeakPolarHBondContact O-CD 3.11Å; P222-L224 PolarHBondContact O-N 3.15Å; P222-I225 PolarHBondContact O-N 2.92Å; P222-L226 WeakPolarHBondContact O-CB 3.44Å; P222-L226 WeakPolarHBondContact O-CG 3.12Å; P222-L226 PolarHBondContact O-N 3.33Å
223Y93.9Very high93Very high30 Ų3048.7 Ų48.712%0.11826%0.255CS..Hα-helixtrans-61.4-47.4175-70.4-47.1000111.8A219 V220 L221 I225 L226 F227 H316 V317 T320 L321A219-Y223 WeakPolarHBondContact O-CD2 3.34Å; A219-Y223 WeakPolarHBondContact O-CE2 3.5Å; V220-Y223 PolarHBondContact O-N 3.33Å; L221-Y223 PolarHBondContact O-N 2.99Å; Y223-I225 VanDerWaalsContact C-N 3.31Å; Y223-I225 PolarHBondContact O-N 2.91Å; Y223-L226 PolarHBondContact O-N 2.93Å; Y223-F227 HydrophobicContact CD1-CD2 4.06Å; Y223-F227 AromaticContact CD1-CE2 3.5Å; Y223-F227 HydrophobicContact CD1-CE2 3.5Å; Y223-F227 HydrophobicContact CE1-CE2 4.32Å; Y223-F227 HydrophobicContact CG-CD2 4.38Å; Y223-F227 HydrophobicContact CG-CE2 4.08Å; Y223-F227 VanDerWaalsContact O-CB 3.28Å; Y223-F227 WeakPolarHBondContact O-CB 3.47Å; Y223-F227 WeakPolarHBondContact O-CD2 3.44Å; Y223-F227 PolarHBondContact O-N 3.47Å; Y223-H316 AromaticContact CE1-CD2 3.62Å; Y223-H316 AromaticContact CE1-NE2 3.83Å; Y223-V317 HydrophobicContact CD1-CG2 4.1Å; Y223-V317 HydrophobicContact CE1-CB 4.36Å; Y223-V317 HydrophobicContact CE1-CG2 3.73Å; Y223-T320 PolarHBondContact OH-OG1 3.4Å; Y223-L321 HydrophobicContact CE2-CD1 4.15Å; Y223-L321 WeakPolarHBondContact OH-CA 3.42Å; Y223-L321 WeakPolarHBondContact OH-CB 3.46Å; Y223-L321 PolarHBondContact OH-N 2.93Å
224L94.5Very high92.9Very high100 Ų10049.2 Ų49.252%0.52426%0.255SS..Hα-helixtrans-56.4-46.9177.6-69.4178000111.1V220 L221 P222 T228V220-L224 HydrophobicContact CG1-CD1 4.02Å; V220-L224 HydrophobicContact CG1-CG 4.37Å; V220-L224 WeakPolarHBondContact O-CG 3.48Å; V220-L224 PolarHBondContact O-N 2.87Å; L221-L224 PolarHBondContact O-N 3Å; P222-L224 PolarHBondContact O-N 3.15Å; L224-T228 VanDerWaalsContact O-CB 3.23Å; L224-T228 WeakPolarHBondContact O-CB 3.12Å; L224-T228 WeakPolarHBondContact O-CG2 3.49Å; L224-T228 PolarHBondContact O-N 3.25Å; L224-T228 VanDerWaalsContact O-N 3.16Å; L224-T228 PolarHBondContact O-OG1 2.98Å
225I95.5Very high92.9Very high59 Ų5951.5 Ų51.530%0.30327%0.266SS..Hα-helixtrans-69-49.2-179-65168.2000111.6C105 V109 L221 P222 Y223 T228 S229C105-I225 HydrophobicContact CB-CD1 4.15Å; C105-I225 HydrophobicContact CB-CG2 4.02Å; V109-I225 HydrophobicContact CG2-CG2 3.85Å; L221-I225 WeakPolarHBondContact O-CG1 3.45Å; L221-I225 PolarHBondContact O-N 3.34Å; P222-I225 PolarHBondContact O-N 2.92Å; Y223-I225 VanDerWaalsContact C-N 3.31Å; Y223-I225 PolarHBondContact O-N 2.91Å; I225-T228 PolarHBondContact O-OG1 3.32Å; I225-S229 WeakPolarHBondContact O-CB 3.39Å; I225-S229 PolarHBondContact O-N 3.14Å; I225-S229 PolarHBondContact O-OG 3.03Å
226L93.9Very high92.8Very high2 Ų254 Ų541%0.0128%0.276CS..Hα-helixtrans-67.9-43.5-174.2-69.6-176.8000112.1L104 A108 P222 Y223 N230 T313 H316L104-L226 HydrophobicContact CD2-CD1 4.04Å; L104-L226 HydrophobicContact CG-CD1 4.37Å; L104-L226 HydrophobicContact CG-CD2 4.32Å; A108-L226 HydrophobicContact CB-CD2 3.64Å; P222-L226 WeakPolarHBondContact O-CB 3.44Å; P222-L226 WeakPolarHBondContact O-CG 3.12Å; P222-L226 PolarHBondContact O-N 3.33Å; Y223-L226 PolarHBondContact O-N 2.93Å; L226-N230 WeakPolarHBondContact O-CB 3.49Å; L226-N230 PolarHBondContact O-N 3.01Å; L226-N230 VanDerWaalsContact O-N 3.09Å; L226-N230 PolarHBondContact O-ND2 2.91Å; L226-T313 HydrophobicContact CB-CG2 3.77Å; L226-T313 HydrophobicContact CD1-CG2 4.12Å; L226-T313 HydrophobicContact CD2-CG2 3.84Å; L226-T313 HydrophobicContact CG-CG2 4.1Å; L226-H316 HydrophobicContact CD1-CB 4.29Å
227F92.9Very high92.6Very high104 Ų10450.7 Ų50.746%0.45626%0.258SS..Hα-helixtrans-70.1-49.2178-77.6-71.4000111.7Y223 S229 N230 V231 V317Y223-F227 HydrophobicContact CD1-CD2 4.06Å; Y223-F227 AromaticContact CD1-CE2 3.5Å; Y223-F227 HydrophobicContact CD1-CE2 3.5Å; Y223-F227 HydrophobicContact CE1-CE2 4.32Å; Y223-F227 HydrophobicContact CG-CD2 4.38Å; Y223-F227 HydrophobicContact CG-CE2 4.08Å; Y223-F227 VanDerWaalsContact O-CB 3.28Å; Y223-F227 WeakPolarHBondContact O-CB 3.47Å; Y223-F227 WeakPolarHBondContact O-CD2 3.44Å; Y223-F227 PolarHBondContact O-N 3.47Å; F227-S229 VanDerWaalsContact C-N 3.3Å; F227-S229 PolarHBondContact O-N 3.16Å; F227-N230 PolarHBondContact O-N 2.85Å; F227-V231 VanDerWaalsContact O-CG2 3.32Å; F227-V231 WeakPolarHBondContact O-CG2 3.34Å; F227-V231 PolarHBondContact O-N 3.35Å; F227-V317 HydrophobicContact CE1-CG2 4.24Å; F227-V317 HydrophobicContact CE2-CG2 3.75Å; F227-V317 HydrophobicContact CZ-CG1 4.46Å; F227-V317 HydrophobicContact CZ-CG2 3.34Å
228T94.5Very high92.4Very high73 Ų7355.1 Ų55.145%0.44827%0.271SS..Hα-helixtrans-61.1-41.9179.6590000111.3L224 I225 V231 I232L224-T228 VanDerWaalsContact O-CB 3.23Å; L224-T228 WeakPolarHBondContact O-CB 3.12Å; L224-T228 WeakPolarHBondContact O-CG2 3.49Å; L224-T228 PolarHBondContact O-N 3.25Å; L224-T228 VanDerWaalsContact O-N 3.16Å; L224-T228 PolarHBondContact O-OG1 2.98Å; I225-T228 PolarHBondContact O-OG1 3.32Å; T228-V231 PolarHBondContact O-N 2.85Å; T228-I232 WeakPolarHBondContact O-CB 2.9Å; T228-I232 VanDerWaalsContact O-CG1 3.26Å; T228-I232 WeakPolarHBondContact O-CG1 3.34Å; T228-I232 PolarHBondContact O-N 3.17Å
229S93.9Very high92.3Very high2 Ų256.6 Ų56.61%0.01428%0.281CS..Hα-helixtrans-60.7-48.5176.6-630000111.7I225 F227 V231 I232 I233I225-S229 WeakPolarHBondContact O-CB 3.39Å; I225-S229 PolarHBondContact O-N 3.14Å; I225-S229 PolarHBondContact O-OG 3.03Å; F227-S229 VanDerWaalsContact C-N 3.3Å; F227-S229 PolarHBondContact O-N 3.16Å; S229-V231 PolarHBondContact O-N 3.29Å; S229-I232 PolarHBondContact O-N 3.14Å; S229-I233 VanDerWaalsContact O-CB 3.24Å; S229-I233 WeakPolarHBondContact O-CB 3.38Å; S229-I233 WeakPolarHBondContact O-CD1 3.48Å; S229-I233 WeakPolarHBondContact O-CG1 3.15Å; S229-I233 PolarHBondContact O-N 3.41Å
230N92.6Very high92.2Very high18 Ų1858.9 Ų58.910%0.09629%0.29CS..Hα-helixtrans-62.3-43.1178.3-84.7-59.7000112.8L226 F227 I233 Y234 T310 T313L226-N230 WeakPolarHBondContact O-CB 3.49Å; L226-N230 PolarHBondContact O-N 3.01Å; L226-N230 VanDerWaalsContact O-N 3.09Å; L226-N230 PolarHBondContact O-ND2 2.91Å; F227-N230 PolarHBondContact O-N 2.85Å; N230-I233 PolarHBondContact O-N 3.18Å; N230-Y234 VanDerWaalsContact O-CB 3.25Å; N230-Y234 WeakPolarHBondContact O-CB 3.47Å; N230-Y234 PolarHBondContact O-N 2.84Å; N230-T310 PolarHBondContact OD1-OG1 2.78Å; N230-T313 VanDerWaalsContact ND2-CB 3.3Å; N230-T313 WeakPolarHBondContact ND2-CB 3.29Å; N230-T313 WeakPolarHBondContact ND2-CG2 3.37Å; N230-T313 PolarHBondContact ND2-OG1 2.92Å
231V93.5Very high92Very high81 Ų8159.7 Ų59.749%0.49129%0.285SS..Hα-helixtrans-61.7-48.8178.8170.80000110.4F227 T228 S229 Y234 I235F227-V231 VanDerWaalsContact O-CG2 3.32Å; F227-V231 WeakPolarHBondContact O-CG2 3.34Å; F227-V231 PolarHBondContact O-N 3.35Å; T228-V231 PolarHBondContact O-N 2.85Å; S229-V231 PolarHBondContact O-N 3.29Å; V231-Y234 PolarHBondContact O-N 2.94Å; V231-I235 HydrophobicContact CG1-CD1 3.83Å; V231-I235 VanDerWaalsContact O-CG1 3.31Å; V231-I235 WeakPolarHBondContact O-CG1 3.3Å; V231-I235 PolarHBondContact O-N 3.01Å
232I93.3Very high91.7Very high73 Ų7361.7 Ų61.737%0.37429%0.287SS..Hα-helixtrans-65.9-43.9-179.8-63.6165.2000111.1L112 T116 T228 S229 Y234 I235 K236L112-I232 HydrophobicContact CD1-CB 3.66Å; L112-I232 HydrophobicContact CD1-CD1 4.23Å; L112-I232 HydrophobicContact CD1-CG2 3.46Å; L112-I232 VanDerWaalsContact CD1-CG2 3.46Å; T116-I232 HydrophobicContact CG2-CG2 3.84Å; T228-I232 WeakPolarHBondContact O-CB 2.9Å; T228-I232 VanDerWaalsContact O-CG1 3.26Å; T228-I232 WeakPolarHBondContact O-CG1 3.34Å; T228-I232 PolarHBondContact O-N 3.17Å; S229-I232 PolarHBondContact O-N 3.14Å; I232-Y234 VanDerWaalsContact C-N 3.31Å; I232-Y234 PolarHBondContact O-N 3.21Å; I232-I235 PolarHBondContact O-N 2.92Å; I232-K236 WeakPolarHBondContact O-CB 3.36Å; I232-K236 PolarHBondContact O-N 3.04Å
233I91.7Very high91.4Very high4 Ų466.6 Ų66.62%0.02131%0.313CS..Hα-helixtrans-58.1-46.4176.3-73.4166000110.1R111 L112 V115 S229 N230 K236 L237 I306 L309R111-I233 HydrophobicContact CB-CD1 3.8Å; L112-I233 HydrophobicContact CB-CD1 4.48Å; L112-I233 HydrophobicContact CD1-CG1 4.22Å; V115-I233 HydrophobicContact CB-CG1 4.45Å; V115-I233 HydrophobicContact CG1-CG2 4.48Å; V115-I233 HydrophobicContact CG2-CG2 4.48Å; S229-I233 VanDerWaalsContact O-CB 3.24Å; S229-I233 WeakPolarHBondContact O-CB 3.38Å; S229-I233 WeakPolarHBondContact O-CD1 3.48Å; S229-I233 WeakPolarHBondContact O-CG1 3.15Å; S229-I233 PolarHBondContact O-N 3.41Å; N230-I233 PolarHBondContact O-N 3.18Å; I233-K236 PolarHBondContact O-N 3.01Å; I233-L237 HydrophobicContact CG2-CD1 3.69Å; I233-L237 HydrophobicContact CG2-CG 4.42Å; I233-L237 WeakPolarHBondContact O-CB 3.19Å; I233-L237 VanDerWaalsContact O-CG 3.27Å; I233-L237 WeakPolarHBondContact O-CG 3.45Å; I233-L237 PolarHBondContact O-N 2.97Å; I233-I306 HydrophobicContact CG2-CB 4.46Å; I233-I306 HydrophobicContact CG2-CD1 4.1Å; I233-I306 HydrophobicContact CG2-CG1 3.97Å; I233-L309 HydrophobicContact CD1-CD2 3.43Å; I233-L309 VanDerWaalsContact CD1-CD2 3.43Å
234Y91.1Very high91Very high120 Ų12069.8 Ų69.847%0.47133%0.33SS..Hα-helixtrans-60.2-49.9177.9174.7-103.3000112N230 V231 I232 K236 L237 R238 I306N230-Y234 VanDerWaalsContact O-CB 3.25Å; N230-Y234 WeakPolarHBondContact O-CB 3.47Å; N230-Y234 PolarHBondContact O-N 2.84Å; V231-Y234 PolarHBondContact O-N 2.94Å; I232-Y234 VanDerWaalsContact C-N 3.31Å; I232-Y234 PolarHBondContact O-N 3.21Å; Y234-K236 PolarHBondContact O-N 3.32Å; Y234-L237 PolarHBondContact O-N 2.8Å; Y234-R238 WeakPolarHBondContact O-CB 3.5Å; Y234-R238 PolarHBondContact O-N 3.41Å; Y234-I306 HydrophobicContact CD2-CD1 4.41Å
235I92.1Very high90.5Very high85 Ų8572.9 Ų72.944%0.43634%0.335SS..Hα-helixtrans-59.2-47.6178.5-69167.8000110.5V231 I232 L237 R238 N239V231-I235 HydrophobicContact CG1-CD1 3.83Å; V231-I235 VanDerWaalsContact O-CG1 3.31Å; V231-I235 WeakPolarHBondContact O-CG1 3.3Å; V231-I235 PolarHBondContact O-N 3.01Å; I232-I235 PolarHBondContact O-N 2.92Å; I235-L237 PolarHBondContact O-N 3.29Å; I235-R238 PolarHBondContact O-N 2.89Å; I235-N239 WeakPolarHBondContact O-CB 3.42Å; I235-N239 VanDerWaalsContact O-CG 3.3Å; I235-N239 PolarHBondContact O-N 3.2Å
236K89.8Confident89.9Confident83 Ų8373.8 Ų73.836%0.36135%0.345SS..Hα-helixtrans-64.2-42-177.4-16966.9171.9-171.10111.7V115 I232 I233 Y234 N239 Q240V115-K236 HydrophobicContact CG1-CB 4.03Å; V115-K236 HydrophobicContact CG1-CG 3.98Å; I232-K236 WeakPolarHBondContact O-CB 3.36Å; I232-K236 PolarHBondContact O-N 3.04Å; I233-K236 PolarHBondContact O-N 3.01Å; Y234-K236 PolarHBondContact O-N 3.32Å; K236-N239 PolarHBondContact O-N 3.37Å; K236-Q240 WeakPolarHBondContact O-CG 3.26Å; K236-Q240 PolarHBondContact O-N 3.03Å
237L87.7Confident89.2Confident6 Ų679.8 Ų79.83%0.03137%0.373CS..Hα-helixtrans-67.8-40.4176.6-71.5173.4000112V115 I233 Y234 I235 N239 Q240 R241 P302 I306V115-L237 HydrophobicContact CG1-CD2 4.12Å; V115-L237 HydrophobicContact CG1-CG 4.01Å; I233-L237 HydrophobicContact CG2-CD1 3.69Å; I233-L237 HydrophobicContact CG2-CG 4.42Å; I233-L237 WeakPolarHBondContact O-CB 3.19Å; I233-L237 VanDerWaalsContact O-CG 3.27Å; I233-L237 WeakPolarHBondContact O-CG 3.45Å; I233-L237 PolarHBondContact O-N 2.97Å; Y234-L237 PolarHBondContact O-N 2.8Å; I235-L237 PolarHBondContact O-N 3.29Å; L237-N239 VanDerWaalsContact C-N 3.31Å; L237-N239 PolarHBondContact O-N 3.25Å; L237-Q240 PolarHBondContact O-N 2.88Å; L237-R241 WeakPolarHBondContact O-CG 3.31Å; L237-R241 PolarHBondContact O-N 3.44Å; L237-P302 HydrophobicContact CD1-CB 4.37Å; L237-P302 HydrophobicContact CD2-CB 3.54Å; L237-P302 HydrophobicContact CD2-CG 3.5Å; L237-I306 HydrophobicContact CD1-CB 3.98Å; L237-I306 HydrophobicContact CD1-CD1 3.86Å; L237-I306 HydrophobicContact CD1-CG1 4.29Å; L237-I306 HydrophobicContact CD1-CG2 4.34Å
238R89.3Confident88.7Confident119 Ų11977.9 Ų77.945%0.44938%0.376SS..Hα-helixtrans-59.5-43.5173.9-172.1178.8-173.7-170.23.4111.2Y234 I235 R241 R242Y234-R238 WeakPolarHBondContact O-CB 3.5Å; Y234-R238 PolarHBondContact O-N 3.41Å; I235-R238 PolarHBondContact O-N 2.89Å; R238-R241 PolarHBondContact O-N 3.43Å; R238-R242 WeakPolarHBondContact O-CG 3.5Å; R238-R242 PolarHBondContact O-N 3.23Å
239N89.9Confident87.8Confident65 Ų6581.3 Ų81.335%0.34839%0.392SS..Hα-helixtrans-64.6-45.4177.3-71.6-6.4000111.4I235 K236 L237 R241 R242 L243I235-N239 WeakPolarHBondContact O-CB 3.42Å; I235-N239 VanDerWaalsContact O-CG 3.3Å; I235-N239 PolarHBondContact O-N 3.2Å; K236-N239 PolarHBondContact O-N 3.37Å; L237-N239 VanDerWaalsContact C-N 3.31Å; L237-N239 PolarHBondContact O-N 3.25Å; N239-R241 VanDerWaalsContact C-N 3.29Å; N239-R241 PolarHBondContact O-N 2.82Å; N239-R242 WeakPolarHBondContact O-CB 2.93Å; N239-R242 PolarHBondContact O-N 2.86Å; N239-R242 VanDerWaalsContact O-N 3.12Å; N239-L243 WeakPolarHBondContact O-CD1 3.41Å; N239-L243 PolarHBondContact O-N 2.96Å
240Q86.9Confident87Confident56 Ų5686.5 Ų86.526%0.26242%0.423SS..Hα-helixtrans-57.5-41.8174.7-72.7174.21.700112.1K236 L237 L243 M244K236-Q240 WeakPolarHBondContact O-CG 3.26Å; K236-Q240 PolarHBondContact O-N 3.03Å; L237-Q240 PolarHBondContact O-N 2.88Å; Q240-L243 PolarHBondContact O-N 3.2Å; Q240-M244 WeakPolarHBondContact O-CG 3.36Å; Q240-M244 PolarHBondContact O-N 3.34Å
241R85.9Confident85.4Confident87 Ų8790.5 Ų90.533%0.32845%0.449SS..Hα-helixtrans-63.8-41.7175.3-70.2-175.8-166.4159.49.4112.4L237 R238 N239 M244 R245 E303L237-R241 WeakPolarHBondContact O-CG 3.31Å; L237-R241 PolarHBondContact O-N 3.44Å; R238-R241 PolarHBondContact O-N 3.43Å; N239-R241 VanDerWaalsContact C-N 3.29Å; N239-R241 PolarHBondContact O-N 2.82Å; R241-M244 HydrophobicContact CG-CE 4.24Å; R241-M244 PolarHBondContact O-N 3.38Å; R241-R245 WeakPolarHBondContact O-CG 3.26Å; R241-R245 PolarHBondContact O-N 2.91Å; R241-E303 IonicContact CZ-OE1 3.15Å; R241-E303 IonicContact CZ-OE2 3.66Å; R241-E303 IonicContact NE-OE1 2.87Å; R241-E303 PolarHBondContact NE-OE1 3.38Å; R241-E303 IonicContact NH2-OE1 2.73Å; R241-E303 PolarHBondContact NH2-OE1 3.34Å; R241-E303 IonicContact NH2-OE2 2.65Å; R241-E303 PolarHBondContact NH2-OE2 3.06Å
242R88.6Confident83.4Confident127 Ų12791.5 Ų91.548%0.47946%0.457SS..Hα-helixtrans-59.1-49.8175.5-75.5177.8172.5178.3-4.8110.9R238 N239 M244 R245 C246R238-R242 WeakPolarHBondContact O-CG 3.5Å; R238-R242 PolarHBondContact O-N 3.23Å; N239-R242 WeakPolarHBondContact O-CB 2.93Å; N239-R242 PolarHBondContact O-N 2.86Å; N239-R242 VanDerWaalsContact O-N 3.12Å; R242-M244 VanDerWaalsContact C-N 3.33Å; R242-M244 PolarHBondContact O-N 2.64Å; R242-R245 PolarHBondContact O-N 3.49Å; R242-C246 PolarHBondContact O-N 3.45Å; R242-C246 PolarHBondContact O-SG 3.22Å
243L87.8Confident81.5Confident105 Ų10597 Ų9755%0.5548%0.483SS..Hα-helixtrans-58.7-44.6177.5-8579.6000111.5N239 Q240 R245 C246 H247N239-L243 WeakPolarHBondContact O-CD1 3.41Å; N239-L243 PolarHBondContact O-N 2.96Å; Q240-L243 PolarHBondContact O-N 3.2Å; L243-R245 VanDerWaalsContact C-N 3.34Å; L243-R245 PolarHBondContact O-N 3.42Å; L243-C246 PolarHBondContact O-N 2.86Å; L243-H247 PolarHBondContact O-N 3.42Å; L243-H247 PolarHBondContact O-ND1 3.01Å
244M84.9Confident79.5Confident96 Ų96103.1 Ų103.147%0.47352%0.521SS..Hα-helixtrans-63.6-37.1178.8-71.2-174.7-63.100113.1Q240 R241 R242 A248Q240-M244 WeakPolarHBondContact O-CG 3.36Å; Q240-M244 PolarHBondContact O-N 3.34Å; R241-M244 HydrophobicContact CG-CE 4.24Å; R241-M244 PolarHBondContact O-N 3.38Å; R242-M244 VanDerWaalsContact C-N 3.33Å; R242-M244 PolarHBondContact O-N 2.64Å; M244-A248 WeakPolarHBondContact O-CB 3.47Å; M244-A248 PolarHBondContact O-N 3.38Å
245R85Confident77.3Confident166 Ų166100 Ų10063%0.62653%0.525SS*.Hα-helixtrans-67.2-40.6175.5-71.4175.7-173.2177.6-1111.9R241 R242 L243 A248 N249R241-R245 WeakPolarHBondContact O-CG 3.26Å; R241-R245 PolarHBondContact O-N 2.91Å; R242-R245 PolarHBondContact O-N 3.49Å; L243-R245 VanDerWaalsContact C-N 3.34Å; L243-R245 PolarHBondContact O-N 3.42Å; R245-A248 PolarHBondContact O-N 3.3Å; R245-N249 PolarHBondContact O-N 3.49Å; R245-N249 PolarHBondContact O-OD1 2.9Å
246C82.7Confident74.9Confident77 Ų77102.4 Ų102.452%0.5254%0.539SS..Hα-helixtrans-60.9-47.6174.7-63.80000111.3R242 L243 A248 N249 T250R242-C246 PolarHBondContact O-N 3.45Å; R242-C246 PolarHBondContact O-SG 3.22Å; L243-C246 PolarHBondContact O-N 2.86Å; C246-A248 VanDerWaalsContact C-N 3.33Å; C246-A248 PolarHBondContact O-N 2.84Å; C246-N249 PolarHBondContact O-N 3.31Å; C246-T250 PolarHBondContact O-N 3.04Å; C246-T250 PolarHBondContact O-OG1 2.75Å
247H79.5Confident72.5Confident129 Ų129104.1 Ų104.160%0.59756%0.556SS**Hα-helixtrans-62.6-38.1177.2-71.380.9000112.6L243 N249 T250 T251L243-H247 PolarHBondContact O-N 3.42Å; L243-H247 PolarHBondContact O-ND1 3.01Å; H247-N249 VanDerWaalsContact C-N 3.33Å; H247-N249 PolarHBondContact O-N 3.03Å; H247-T250 PolarHBondContact O-N 3.39Å; H247-T251 PolarHBondContact O-N 2.95Å; H247-T251 PolarHBondContact O-OG1 3.14Å
248A81.4Confident70.2Confident64 Ų64109.1 Ų109.153%0.52959%0.587SS.*Hα-helixtrans-63.5-38.1176.400000112.2M244 R245 C246M244-A248 WeakPolarHBondContact O-CB 3.47Å; M244-A248 PolarHBondContact O-N 3.38Å; R245-A248 PolarHBondContact O-N 3.3Å; C246-A248 VanDerWaalsContact C-N 3.33Å; C246-A248 PolarHBondContact O-N 2.84Å
249N77Confident67.8Low144 Ų144109.8 Ų109.877%0.7760%0.6SS**Hα-helixtrans-74.3-25.8176.9-68.42.7000113R245 C246 H247R245-N249 PolarHBondContact O-N 3.49Å; R245-N249 PolarHBondContact O-OD1 2.9Å; C246-N249 PolarHBondContact O-N 3.31Å; H247-N249 VanDerWaalsContact C-N 3.33Å; H247-N249 PolarHBondContact O-N 3.03Å
250T76Confident65.2Low111 Ų111111.9 Ų111.968%0.68162%0.615SS**Hα-helixtrans-86.4-7.8178.8-48.70000113.3C246 H247 P252C246-T250 PolarHBondContact O-N 3.04Å; C246-T250 PolarHBondContact O-OG1 2.75Å; H247-T250 PolarHBondContact O-N 3.39Å; T250-P252 WeakPolarHBondContact O-CD 3.24Å
251T59.2Low62.7Low102 Ų102115.6 Ų115.663%0.62664%0.637SS**SBendtrans-87.698.8174.8-310000108.3H247 M253H247-T251 PolarHBondContact O-N 2.95Å; H247-T251 PolarHBondContact O-OG1 3.14Å; T251-M253 PolarHBondContact O-N 3.35Å
252P52.3Low60.3Low103 Ų103118.8 Ų118.867%0.66966%0.659SS**  trans-61.9136.8176.825.3-33.3000109.2T250 V254T250-P252 WeakPolarHBondContact O-CD 3.24Å; P252-V254 PolarHBondContact O-N 2.87Å
253M52.7Low57.9Low187 Ų187120.1 Ų120.192%0.92167%0.674SS**  trans-57.2107.6164.6-68.1-154.9108.400107T251 G255T251-M253 PolarHBondContact O-N 3.35Å; M253-G255 PolarHBondContact O-N 3.29Å
254V49.3Very low55.3Low133 Ų133120 Ų12081%0.80668%0.682SS**  trans-67.676154.5-179.70000105.1P252 N256P252-V254 PolarHBondContact O-N 2.87Å; V254-N256 PolarHBondContact O-N 3.35Å
255G45.3Very low52.8Low54 Ų54122.8 Ų122.856%0.55770%0.698SS**  trans-71.4111163.400000105.7M253 T257M253-G255 PolarHBondContact O-N 3.29Å; G255-T257 PolarHBondContact O-N 2.82Å
256N40.8Very low50.3Low136 Ų136119.7 Ų119.773%0.72770%0.703SS**  trans-44.2105.8166.9-70.8-16.5000109.8V254 T258V254-N256 PolarHBondContact O-N 3.35Å; N256-T258 PolarHBondContact O-N 3.46Å
257T40.7Very low47.8Very low119 Ų119121.1 Ų121.173%0.7371%0.713SS**  trans-77.277.2155.7-47.40000107G255 N259G255-T257 PolarHBondContact O-N 2.82Å; T257-N259 HydrophobicContact CG2-CB 4.02Å; T257-N259 PolarHBondContact O-N 2.87Å
258T39.9Very low45.5Very low111 Ų111124.1 Ų124.168%0.68173%0.727SS**  trans-74.285.1150.941.30000107.1N256N256-T258 PolarHBondContact O-N 3.46Å
259N38Very low42.9Very low134 Ų134126 Ų12672%0.71774%0.736SS**  trans-116.190155.7-74.7-7.7000104.7T257T257-N259 HydrophobicContact CG2-CB 4.02Å; T257-N259 PolarHBondContact O-N 2.87Å
260T34.5Very low40.7Very low109 Ų109124.5 Ų124.567%0.66974%0.737SS**  20.6108.990.749.80000113.6
261N36Very low38.3Very low134 Ų134128.7 Ų128.772%0.71775%0.746SS**  trans117.2130.5141.2-62.1-13.9000117.2
262I34.2Very low36.8Very low154 Ų154135.4 Ų135.479%0.7976%0.76SS**  trans86111158.6-50.6137.9000111.4
263I38.5Very low35.3Very low155 Ų155139.9 Ų139.980%0.79577%0.769SS**  -144.812364.9-70.9163.8000111.3
264S33.1Very low34.1Very low103 Ų103138.3 Ų138.372%0.7276%0.764SS**  trans-55.5134.1157.5-43.50000110.7
265N32.9Very low33.1Very low153 Ų153139 Ų13982%0.81876%0.763SS**  trans-166.6138.4138.7-99.4-10.3000114.1
266S32.8Very low32.1Very low102 Ų102146.1 Ų146.171%0.71377%0.773SS**  trans64.594.7161.756.90000119.5
267S29.2Very low31.3Very low107 Ų107148 Ų14875%0.74878%0.775SS**  -3.3115.8121.750.30000117
268H32.7Very low30.6Very low191 Ų191146.5 Ų146.588%0.88477%0.769SS**  trans-156.5122.3130.9-110.8-73000111.1
269S26.7Very low30Very low104 Ų104147.9 Ų147.973%0.72777%0.771SS**  trans-51.6134.1164.5169.80000112
270S30.3Very low29.7Very low113 Ų113148.9 Ų148.979%0.7977%0.771SS**  174.3138.2121.4-800000113.7
271K25.4Very low29.3Very low199 Ų199150.7 Ų150.787%0.86577%0.772SS**  trans-54.1143.8170.5-63.6163.8174172.60113.2
272R27.2Very low29.1Very low243 Ų243152 Ų15292%0.91778%0.778SS**  trans174.7108.1142-96.6162.2-170.6-171.23.5108.1
273K22.1Very low28.7Very low196 Ų196152.7 Ų152.785%0.85278%0.777SS**  46.8111.886.4-92.2-170.5177.1-176.20115.2
274L27.4Very low28.4Very low155 Ų155149.2 Ų149.281%0.81277%0.767SS**  trans45.5115.6137.3-95.9140.4000120.4
275D27.2Very low28.2Very low148 Ų148149.6 Ų149.679%0.79177%0.765SS**  trans-177120.7130.9-99.9-31.1000108
276R23.8Very low28Very low203 Ų203148.8 Ų148.877%0.76676%0.761SS**  60.8118.373-162.7177.2-165.1-1706114.5
277K24.2Very low27.9Very low176 Ų176152.2 Ų152.277%0.76577%0.765SS**  trans67.4139.3164.4-82.9176.2172.3-175.50114.2
278S27Very low28Very low87 Ų87153.6 Ų153.661%0.60876%0.764SS**  cis177.4167.16.449.90000107.5
279I27.8Very low28Very low140 Ų140153.5 Ų153.572%0.71876%0.764SS**  trans100.2121.3148.7-64.3163.5000118.8
280H29.9Very low28.3Very low155 Ų155156.3 Ų156.372%0.71877%0.765SS**  trans77.5101.2157.3-74-57000121.9
281Q26.2Very low28.5Very low147 Ų147153.2 Ų153.269%0.68775%0.751SS**  41.6102.6121-79.2169.2-4000117.7
282L33.5Very low29.1Very low162 Ų162151.1 Ų151.185%0.84875%0.749SS**  -136.193.6127.4-157.671.8000109.2S284L282-S284 PolarHBondContact O-N 3.24Å
283E24.8Very low29.5Very low167 Ų167145.4 Ų145.478%0.7874%0.741SS**  trans-70.8100.1168.7-165.1168.2-160.700107.6
284S32.2Very low30.3Very low83 Ų83146.2 Ų146.258%0.5874%0.739SS**  trans-141.977.7160.438.60000108.6L282 N286L282-S284 PolarHBondContact O-N 3.24Å; S284-N286 PolarHBondContact O-N 3.44Å
285T28.4Very low30.7Very low110 Ų110143.4 Ų143.468%0.67573%0.731SS**  trans-62.868.9160.5-50.90000109.1Q287T285-Q287 VanDerWaalsContact C-N 3.27Å; T285-Q287 HydrophobicContact CG2-CG 4.19Å; T285-Q287 PolarHBondContact O-N 2.91Å
286N30.3Very low30.9Very low137 Ų137145.8 Ų145.873%0.73374%0.735SS**  trans-9376.2161.4-83.5-21.2000107.5S284 L288S284-N286 PolarHBondContact O-N 3.44Å; N286-L288 PolarHBondContact O-N 3.45Å
287Q30.2Very low31.9Very low173 Ų173144.2 Ų144.281%0.80873%0.729SS**  trans-59.874.6149.1-69.8-175.5-2.300108.3T285 Q289T285-Q287 VanDerWaalsContact C-N 3.27Å; T285-Q287 HydrophobicContact CG2-CG 4.19Å; T285-Q287 PolarHBondContact O-N 2.91Å; Q287-Q289 VanDerWaalsContact C-N 3.31Å
288L31.1Very low32.7Very low137 Ų137140.7 Ų140.772%0.71773%0.726SS**  trans-10542.8160.9-129.4102.2000109.1N286 H290N286-L288 PolarHBondContact O-N 3.45Å; L288-H290 PolarHBondContact O-N 3.1Å
289Q31.9Very low33.5Very low189 Ų189142 Ų14288%0.88373%0.731SS**  trans-71.671.4144.8-76.8-178.6-6.900106.9Q287 G291Q287-Q289 VanDerWaalsContact C-N 3.31Å; Q289-G291 PolarHBondContact O-N 2.67Å
290H33.1Very low34.7Very low163 Ų163140.1 Ų140.176%0.75572%0.715SS**  trans-63.977.2143.4-111.3-66.5000104.7L288 D292L288-H290 PolarHBondContact O-N 3.1Å; H290-D292 PolarHBondContact O-N 2.6Å; H290-D292 VanDerWaalsContact O-N 3.12Å
291G35.3Very low35.8Very low47 Ų47142.2 Ų142.249%0.48572%0.716SS.*  trans-47.8125.915900000104.6Q289 T293Q289-G291 PolarHBondContact O-N 2.67Å; G291-T293 PolarHBondContact O-N 2.78Å; G291-T293 PolarHBondContact O-OG1 3.11Å
292D38.3Very low37.3Very low155 Ų155137.3 Ų137.383%0.82970%0.697SS**  trans-5079.8174.3-89.5-51.6000109H290 R294H290-D292 PolarHBondContact O-N 2.6Å; H290-D292 VanDerWaalsContact O-N 3.12Å; D292-R294 HydrophobicContact CB-CB 4.32Å; D292-R294 PolarHBondContact O-N 3.16Å
293T34.1Very low38.5Very low124 Ų124132.8 Ų132.876%0.76167%0.671SS**  trans-72.555.1143.1-34.20000104G291 C295G291-T293 PolarHBondContact O-N 2.78Å; G291-T293 PolarHBondContact O-OG1 3.11Å; T293-C295 PolarHBondContact O-N 3.3Å
294R39.3Very low40.6Very low213 Ų213126.3 Ų126.380%0.80465%0.65SS**  trans-51.785.7140.3-172.7-178.8-166.1-174.37.4101.6D292 K296D292-R294 HydrophobicContact CB-CB 4.32Å; D292-R294 PolarHBondContact O-N 3.16Å; R294-K296 PolarHBondContact O-N 3.08Å
295C36.3Very low42.1Very low95 Ų95123.9 Ų123.964%0.64263%0.631SS**  trans-38.5115.2179.2-177.50000102T293 R297T293-C295 PolarHBondContact O-N 3.3Å; C295-R297 PolarHBondContact O-N 3.14Å
296K32.1Very low44.4Very low199 Ų199119.7 Ų119.787%0.86561%0.605SS**  trans-56.188.1171.1-81.4177.3178.5172.30101.6R294 S298R294-K296 PolarHBondContact O-N 3.08Å; K296-S298 PolarHBondContact O-N 2.92Å
297R44.2Very low46.9Very low170 Ų170118.9 Ų118.964%0.64260%0.595SS**  trans-65.489.8178.7-179.7-177.4-168.51675.897.5C295 T299C295-R297 PolarHBondContact O-N 3.14Å; R297-T299 WeakPolarHBondContact O-CA 3.44Å; R297-T299 VanDerWaalsContact O-CG2 3.25Å; R297-T299 WeakPolarHBondContact O-CG2 3.28Å; R297-T299 PolarHBondContact O-N 2.69Å
298S41.9Very low49.6Very low102 Ų102111.3 Ų111.371%0.71356%0.56SS**  trans-48.9106.9-175.3166.90000101.7K296 R300K296-S298 PolarHBondContact O-N 2.92Å; S298-R300 PolarHBondContact O-N 3Å
299T43.4Very low52.2Low114 Ų114104.9 Ų104.970%0.69953%0.526SS*.  trans-77.467.9-169.438.40000102.9R297 R301R297-T299 WeakPolarHBondContact O-CA 3.44Å; R297-T299 VanDerWaalsContact O-CG2 3.25Å; R297-T299 WeakPolarHBondContact O-CG2 3.28Å; R297-T299 PolarHBondContact O-N 2.69Å; T299-R301 WeakPolarHBondContact O-CG 3.44Å; T299-R301 PolarHBondContact O-N 2.86Å
300R52.2Low54.9Low101 Ų10198.1 Ų98.138%0.38150%0.498SS..  trans-63.292.4170.1-179.6-175.8172111.90.5103.2S41 S298 P302S41-R300 PolarHBondContact O-NH1 3.43Å; S298-R300 PolarHBondContact O-N 3Å; R300-P302 WeakPolarHBondContact O-CD 3.29Å
301R53.1Low57.7Low198 Ų19891.4 Ų91.475%0.74747%0.47SS*.  trans-60.8103.2-170.9-64.6-176.2-178.7170.2-1.6106.8T299 E303T299-R301 WeakPolarHBondContact O-CG 3.44Å; T299-R301 PolarHBondContact O-N 2.86Å; R301-E303 HydrophobicContact CB-CB 4.45Å; R301-E303 PolarHBondContact O-N 2.82Å
302P57.6Low60.2Low45 Ų4589.3 Ų89.329%0.29245%0.448SS..Hα-helixtrans-64.6-16.3178.929.5-33.2000111L237 R300 G304 V305 I306L237-P302 HydrophobicContact CD1-CB 4.37Å; L237-P302 HydrophobicContact CD2-CB 3.54Å; L237-P302 HydrophobicContact CD2-CG 3.5Å; R300-P302 WeakPolarHBondContact O-CD 3.29Å; P302-G304 PolarHBondContact O-N 3.4Å; P302-V305 WeakPolarHBondContact O-CB 3.32Å; P302-V305 PolarHBondContact O-N 2.99Å; P302-V305 VanDerWaalsContact O-N 3.08Å; P302-I306 PolarHBondContact O-N 3.04Å
303E58.8Low62.8Low66 Ų6682.3 Ų82.331%0.30841%0.411SS..Hα-helixtrans-53.2-45.3178-59.6-62.8153.900114.9R241 R301 V305 I306 K307R241-E303 IonicContact CZ-OE1 3.15Å; R241-E303 IonicContact CZ-OE2 3.66Å; R241-E303 IonicContact NE-OE1 2.87Å; R241-E303 PolarHBondContact NE-OE1 3.38Å; R241-E303 IonicContact NH2-OE1 2.73Å; R241-E303 PolarHBondContact NH2-OE1 3.34Å; R241-E303 IonicContact NH2-OE2 2.65Å; R241-E303 PolarHBondContact NH2-OE2 3.06Å; R301-E303 HydrophobicContact CB-CB 4.45Å; R301-E303 PolarHBondContact O-N 2.82Å; E303-V305 PolarHBondContact O-N 2.9Å; E303-I306 WeakPolarHBondContact O-CG2 3.28Å; E303-K307 WeakPolarHBondContact O-CG 3.44Å; E303-K307 PolarHBondContact O-N 3.2Å
304G68.1Low65.6Low32 Ų3280.8 Ų80.833%0.3340%0.397SS..Hα-helixtrans-67.6-31.4178.100000111.7P302 L308P302-G304 PolarHBondContact O-N 3.4Å; G304-L308 PolarHBondContact O-N 3.45Å
305V64.8Low68.2Low31 Ų3171.9 Ų71.919%0.18837%0.365CS..Hα-helixtrans-80.4-37.8-173.9-172.30000111.8R111 P302 E303 L308 L309R111-V305 HydrophobicContact CG-CG1 4.12Å; P302-V305 WeakPolarHBondContact O-CB 3.32Å; P302-V305 PolarHBondContact O-N 2.99Å; P302-V305 VanDerWaalsContact O-N 3.08Å; E303-V305 PolarHBondContact O-N 2.9Å; V305-L308 PolarHBondContact O-N 3.35Å; V305-L309 PolarHBondContact O-N 2.85Å
306I76.7Confident71Confident22 Ų2267.3 Ų67.311%0.11333%0.334CS..Hα-helixtrans-65.2-44.8173.4-166.9-177.2000110.8I233 Y234 L237 P302 E303 L308 L309 T310I233-I306 HydrophobicContact CG2-CB 4.46Å; I233-I306 HydrophobicContact CG2-CD1 4.1Å; I233-I306 HydrophobicContact CG2-CG1 3.97Å; Y234-I306 HydrophobicContact CD2-CD1 4.41Å; L237-I306 HydrophobicContact CD1-CB 3.98Å; L237-I306 HydrophobicContact CD1-CD1 3.86Å; L237-I306 HydrophobicContact CD1-CG1 4.29Å; L237-I306 HydrophobicContact CD1-CG2 4.34Å; P302-I306 PolarHBondContact O-N 3.04Å; E303-I306 WeakPolarHBondContact O-CG2 3.28Å; I306-L308 PolarHBondContact O-N 3.11Å; I306-L309 PolarHBondContact O-N 3.39Å; I306-T310 VanDerWaalsContact O-CB 3.31Å; I306-T310 WeakPolarHBondContact O-CB 3.14Å; I306-T310 PolarHBondContact O-N 2.89Å; I306-T310 PolarHBondContact O-OG1 2.82Å
307K83.7Confident74Confident121 Ų12159.4 Ų59.453%0.52630%0.303SS..Hα-helixtrans-56.1-42.4177.4-72.7178.7-178.2-171.40111.2E303 A311E303-K307 WeakPolarHBondContact O-CG 3.44Å; E303-K307 PolarHBondContact O-N 3.2Å; K307-A311 VanDerWaalsContact O-CB 3.26Å; K307-A311 WeakPolarHBondContact O-CB 3.37Å; K307-A311 PolarHBondContact O-N 3.01Å
308L84.9Confident76.4Confident14 Ų1456.4 Ų56.47%0.07330%0.298CS..Hα-helixtrans-62.2-57176.5171.657.7000112.4M36 G304 V305 I306 T310 A311 L312 Y366M36-L308 HydrophobicContact CE-CD2 3.36Å; G304-L308 PolarHBondContact O-N 3.45Å; V305-L308 PolarHBondContact O-N 3.35Å; I306-L308 PolarHBondContact O-N 3.11Å; L308-T310 VanDerWaalsContact C-N 3.31Å; L308-T310 PolarHBondContact O-N 3.42Å; L308-A311 WeakPolarHBondContact O-CB 3.32Å; L308-A311 PolarHBondContact O-N 3.15Å; L308-L312 HydrophobicContact CD1-CD1 4.15Å; L308-L312 HydrophobicContact CD1-CG 4.14Å; L308-L312 HydrophobicContact CG-CD1 4.42Å; L308-L312 PolarHBondContact O-N 3.38Å; L308-Y366 HydrophobicContact CD1-CD1 3.2Å; L308-Y366 HydrophobicContact CD1-CE1 3.31Å; L308-Y366 HydrophobicContact CD1-CG 4.43Å; L308-Y366 HydrophobicContact CD2-CD1 4.28Å; L308-Y366 HydrophobicContact CD2-CE1 4.03Å; L308-Y366 HydrophobicContact CG-CD1 4.33Å; L308-Y366 HydrophobicContact CG-CE1 4.19Å
309L86.9Confident79Confident2 Ų251.8 Ų51.81%0.0127%0.266CS..Hα-helixtrans-60.2-45.4-176.2-179.862.3000110.8V107 A108 R111 I233 V305 I306 A311 L312 T313V107-L309 HydrophobicContact CG1-CD1 4.37Å; A108-L309 HydrophobicContact CB-CD1 3.91Å; A108-L309 HydrophobicContact CB-CD2 4.39Å; R111-L309 HydrophobicContact CB-CD2 4Å; R111-L309 HydrophobicContact CG-CD2 4.21Å; I233-L309 HydrophobicContact CD1-CD2 3.43Å; I233-L309 VanDerWaalsContact CD1-CD2 3.43Å; V305-L309 PolarHBondContact O-N 2.85Å; I306-L309 PolarHBondContact O-N 3.39Å; L309-A311 VanDerWaalsContact C-N 3.32Å; L309-A311 PolarHBondContact O-N 2.66Å; L309-L312 PolarHBondContact O-N 2.99Å; L309-T313 HydrophobicContact CD1-CG2 4.35Å; L309-T313 VanDerWaalsContact O-CG2 3.32Å; L309-T313 WeakPolarHBondContact O-CG2 3.05Å; L309-T313 PolarHBondContact O-N 3.37Å; L309-T313 PolarHBondContact O-OG1 3.08Å
310T88.5Confident81.4Confident47 Ų4746.5 Ų46.529%0.28823%0.234SC..Hα-helixtrans-59.6-41.7177.3-57.20000111.7N230 I306 L308 T313 I314N230-T310 PolarHBondContact OD1-OG1 2.78Å; I306-T310 VanDerWaalsContact O-CB 3.31Å; I306-T310 WeakPolarHBondContact O-CB 3.14Å; I306-T310 PolarHBondContact O-N 2.89Å; I306-T310 PolarHBondContact O-OG1 2.82Å; L308-T310 VanDerWaalsContact C-N 3.31Å; L308-T310 PolarHBondContact O-N 3.42Å; T310-T313 WeakPolarHBondContact CA-OG1 3.37Å; T310-T313 PolarHBondContact O-N 3.28Å; T310-T313 PolarHBondContact O-OG1 3.5Å; T310-I314 HydrophobicContact CG2-CD1 3.86Å; T310-I314 HydrophobicContact CG2-CG1 4.43Å; T310-I314 VanDerWaalsContact O-CG1 3.3Å; T310-I314 WeakPolarHBondContact O-CG1 3.41Å; T310-I314 PolarHBondContact O-N 3.32Å
311A90.9Very high83.5Confident21 Ų2145 Ų4517%0.17423%0.233CC..Hα-helixtrans-61.2-47175.900000112.3K307 L308 L309 T313 I314 I315K307-A311 VanDerWaalsContact O-CB 3.26Å; K307-A311 WeakPolarHBondContact O-CB 3.37Å; K307-A311 PolarHBondContact O-N 3.01Å; L308-A311 WeakPolarHBondContact O-CB 3.32Å; L308-A311 PolarHBondContact O-N 3.15Å; L309-A311 VanDerWaalsContact C-N 3.32Å; L309-A311 PolarHBondContact O-N 2.66Å; A311-T313 VanDerWaalsContact C-N 3.28Å; A311-T313 PolarHBondContact O-N 2.93Å; A311-I314 PolarHBondContact O-N 3.02Å; A311-I315 WeakPolarHBondContact O-CB 3.27Å; A311-I315 VanDerWaalsContact O-CG1 3.28Å; A311-I315 WeakPolarHBondContact O-CG1 3.4Å; A311-I315 PolarHBondContact O-N 3.38Å
312L89.5Confident85.5Confident3 Ų338.2 Ų38.22%0.01621%0.214CC..Hα-helixtrans-61-38.1176.8-66177.5000111.9L104 L308 L309 I315 H316 N362 Y366L104-L312 HydrophobicContact CD1-CB 4.12Å; L104-L312 HydrophobicContact CD1-CD1 4.21Å; L308-L312 HydrophobicContact CD1-CD1 4.15Å; L308-L312 HydrophobicContact CD1-CG 4.14Å; L308-L312 HydrophobicContact CG-CD1 4.42Å; L308-L312 PolarHBondContact O-N 3.38Å; L309-L312 PolarHBondContact O-N 2.99Å; L312-I315 PolarHBondContact O-N 2.89Å; L312-H316 WeakPolarHBondContact O-CB 3.37Å; L312-H316 PolarHBondContact O-N 2.66Å; L312-N362 VanDerWaalsContact CD2-OD1 3.31Å; L312-N362 WeakPolarHBondContact CD2-OD1 3.39Å; L312-Y366 HydrophobicContact CD1-CE1 4.28Å; L312-Y366 HydrophobicContact CD2-CE1 4.44Å
313T92.4Very high87.2Confident9 Ų936.1 Ų36.16%0.05520%0.201CC..Hα-helixtrans-72-35.6177.958.20000113.6L226 N230 L309 T310 A311 H316 V317L226-T313 HydrophobicContact CB-CG2 3.77Å; L226-T313 HydrophobicContact CD1-CG2 4.12Å; L226-T313 HydrophobicContact CD2-CG2 3.84Å; L226-T313 HydrophobicContact CG-CG2 4.1Å; N230-T313 VanDerWaalsContact ND2-CB 3.3Å; N230-T313 WeakPolarHBondContact ND2-CB 3.29Å; N230-T313 WeakPolarHBondContact ND2-CG2 3.37Å; N230-T313 PolarHBondContact ND2-OG1 2.92Å; L309-T313 HydrophobicContact CD1-CG2 4.35Å; L309-T313 VanDerWaalsContact O-CG2 3.32Å; L309-T313 WeakPolarHBondContact O-CG2 3.05Å; L309-T313 PolarHBondContact O-N 3.37Å; L309-T313 PolarHBondContact O-OG1 3.08Å; T310-T313 WeakPolarHBondContact CA-OG1 3.37Å; T310-T313 PolarHBondContact O-N 3.28Å; T310-T313 PolarHBondContact O-OG1 3.5Å; A311-T313 VanDerWaalsContact C-N 3.28Å; A311-T313 PolarHBondContact O-N 2.93Å; T313-H316 PolarHBondContact O-N 3.31Å; T313-V317 WeakPolarHBondContact O-CG2 3.44Å; T313-V317 PolarHBondContact O-N 3.39Å
314I93.3Very high88.9Confident91 Ų9133.8 Ų33.847%0.46719%0.191SC..Hα-helixtrans-65.6-45.8173.7-70.4167.1000109.7T310 A311 H316 V317 I318T310-I314 HydrophobicContact CG2-CD1 3.86Å; T310-I314 HydrophobicContact CG2-CG1 4.43Å; T310-I314 VanDerWaalsContact O-CG1 3.3Å; T310-I314 WeakPolarHBondContact O-CG1 3.41Å; T310-I314 PolarHBondContact O-N 3.32Å; A311-I314 PolarHBondContact O-N 3.02Å; I314-H316 VanDerWaalsContact C-N 3.32Å; I314-H316 PolarHBondContact O-N 2.94Å; I314-V317 PolarHBondContact O-N 3.45Å; I314-I318 HydrophobicContact CG2-CD1 3.68Å; I314-I318 HydrophobicContact CG2-CG1 4.39Å; I314-I318 WeakPolarHBondContact O-CG1 3.39Å; I314-I318 PolarHBondContact O-N 2.99Å
315I94.2Very high90.1Very high26 Ų2636 Ų3613%0.13320%0.195CC..Hα-helixtrans-56-49.4175.1-74.1166.1000110.2A311 L312 V317 I318 C319 I361A311-I315 WeakPolarHBondContact O-CB 3.27Å; A311-I315 VanDerWaalsContact O-CG1 3.28Å; A311-I315 WeakPolarHBondContact O-CG1 3.4Å; A311-I315 PolarHBondContact O-N 3.38Å; L312-I315 PolarHBondContact O-N 2.89Å; I315-V317 PolarHBondContact O-N 3.29Å; I315-I318 PolarHBondContact O-N 3.45Å; I315-C319 WeakPolarHBondContact O-CB 3.41Å; I315-C319 PolarHBondContact O-N 3.35Å; I315-C319 PolarHBondContact O-SG 2.95Å; I315-I361 HydrophobicContact CD1-CG2 4.35Å; I315-I361 HydrophobicContact CG2-CG2 3.34Å
316H94Very high91.5Very high0 Ų035.5 Ų35.50%019%0.19CC..Hα-helixtrans-56-51.9177.9-179.877.9000111.2L104 Y223 L226 L312 T313 I314 I318 C319 T320 N358L104-H316 HydrophobicContact CD2-CB 4.24Å; Y223-H316 AromaticContact CE1-CD2 3.62Å; Y223-H316 AromaticContact CE1-NE2 3.83Å; L226-H316 HydrophobicContact CD1-CB 4.29Å; L312-H316 WeakPolarHBondContact O-CB 3.37Å; L312-H316 PolarHBondContact O-N 2.66Å; T313-H316 PolarHBondContact O-N 3.31Å; I314-H316 VanDerWaalsContact C-N 3.32Å; I314-H316 PolarHBondContact O-N 2.94Å; H316-I318 PolarHBondContact O-N 3.44Å; H316-C319 PolarHBondContact O-N 3.19Å; H316-T320 PolarHBondContact NE2-OG1 3.42Å; H316-T320 WeakPolarHBondContact O-CB 3.37Å; H316-T320 PolarHBondContact O-N 3.22Å; H316-T320 PolarHBondContact O-OG1 3.4Å; H316-N358 VanDerWaalsContact CA-OD1 3.26Å; H316-N358 WeakPolarHBondContact CA-OD1 3.35Å
317V94.5Very high92.2Very high33 Ų3337.6 Ų37.620%0.220%0.204CC..Hα-helixtrans-57.4-47.6179173.10000112Y223 F227 T313 I314 I315 C319 L321Y223-V317 HydrophobicContact CD1-CG2 4.1Å; Y223-V317 HydrophobicContact CE1-CB 4.36Å; Y223-V317 HydrophobicContact CE1-CG2 3.73Å; F227-V317 HydrophobicContact CE1-CG2 4.24Å; F227-V317 HydrophobicContact CE2-CG2 3.75Å; F227-V317 HydrophobicContact CZ-CG1 4.46Å; F227-V317 HydrophobicContact CZ-CG2 3.34Å; T313-V317 WeakPolarHBondContact O-CG2 3.44Å; T313-V317 PolarHBondContact O-N 3.39Å; I314-V317 PolarHBondContact O-N 3.45Å; I315-V317 PolarHBondContact O-N 3.29Å; V317-C319 VanDerWaalsContact C-N 3.3Å; V317-C319 PolarHBondContact O-N 2.93Å; V317-L321 HydrophobicContact CG1-CB 4.39Å; V317-L321 HydrophobicContact CG1-CD2 4.22Å; V317-L321 WeakPolarHBondContact O-CB 3.21Å; V317-L321 PolarHBondContact O-N 2.9Å
318I95.2Very high92.6Very high106 Ų10635.9 Ų35.954%0.54420%0.197SC..Hα-helixtrans-61.9-41179.5-68.8170000111I314 I315 H316 P322I314-I318 HydrophobicContact CG2-CD1 3.68Å; I314-I318 HydrophobicContact CG2-CG1 4.39Å; I314-I318 WeakPolarHBondContact O-CG1 3.39Å; I314-I318 PolarHBondContact O-N 2.99Å; I315-I318 PolarHBondContact O-N 3.45Å; H316-I318 PolarHBondContact O-N 3.44Å; I318-P322 WeakPolarHBondContact O-CD 3.47Å
319C95.7Very high92.9Very high6 Ų637.8 Ų37.84%0.04121%0.207CC..Hα-helixtrans-79.2-34.7-174.8-65.10000113I315 H316 V317 L354 I355 N358I315-C319 WeakPolarHBondContact O-CB 3.41Å; I315-C319 PolarHBondContact O-N 3.35Å; I315-C319 PolarHBondContact O-SG 2.95Å; H316-C319 PolarHBondContact O-N 3.19Å; V317-C319 VanDerWaalsContact C-N 3.3Å; V317-C319 PolarHBondContact O-N 2.93Å; C319-L354 WeakPolarHBondContact CB-O 3.32Å; C319-L354 CarbonylContact O-C 3.56Å; C319-I355 WeakPolarHBondContact O-CA 3.46Å; C319-I355 PolarHBondContact O-N 2.89Å; C319-N358 HydrophobicContact CB-CB 3.77Å
320T95.2Very high93Very high3 Ų339.3 Ų39.32%0.01822%0.217CC..Hα-helixtrans-102.5-30.6-170.762.40000113.8Y223 H316 G323 T324 I355Y223-T320 PolarHBondContact OH-OG1 3.4Å; H316-T320 PolarHBondContact NE2-OG1 3.42Å; H316-T320 WeakPolarHBondContact O-CB 3.37Å; H316-T320 PolarHBondContact O-N 3.22Å; H316-T320 PolarHBondContact O-OG1 3.4Å; T320-G323 PolarHBondContact O-N 3.47Å; T320-T324 VanDerWaalsContact O-CG2 3.24Å; T320-T324 WeakPolarHBondContact O-CG2 3.49Å; T320-T324 PolarHBondContact O-N 2.97Å; T320-T324 PolarHBondContact O-OG1 3.37Å; T320-I355 HydrophobicContact CG2-CG2 4.39Å
321L95.2Very high92.9Very high69 Ų6940.4 Ų40.436%0.36123%0.227SC..Hα-helixtrans-63.4-46.8-171.6-173.666.5000113.1Y223 V317 G323 T324 I325Y223-L321 HydrophobicContact CE2-CD1 4.15Å; Y223-L321 WeakPolarHBondContact OH-CA 3.42Å; Y223-L321 WeakPolarHBondContact OH-CB 3.46Å; Y223-L321 PolarHBondContact OH-N 2.93Å; V317-L321 HydrophobicContact CG1-CB 4.39Å; V317-L321 HydrophobicContact CG1-CD2 4.22Å; V317-L321 WeakPolarHBondContact O-CB 3.21Å; V317-L321 PolarHBondContact O-N 2.9Å; L321-G323 VanDerWaalsContact C-N 3.32Å; L321-G323 PolarHBondContact O-N 3.09Å; L321-T324 WeakPolarHBondContact CA-OG1 3.49Å; L321-T324 PolarHBondContact O-N 3.26Å; L321-T324 PolarHBondContact O-OG1 2.93Å; L321-I325 HydrophobicContact CD1-CD1 3.94Å; L321-I325 HydrophobicContact CD1-CG1 4.07Å; L321-I325 HydrophobicContact CD2-CD1 4.27Å; L321-I325 HydrophobicContact CG-CD1 3.71Å; L321-I325 HydrophobicContact CG-CG1 4.24Å; L321-I325 WeakPolarHBondContact O-CG1 3.17Å; L321-I325 PolarHBondContact O-N 3.18Å
322P95.9Very high92.8Very high55 Ų5544.1 Ų44.136%0.35724%0.237SC..Hα-helixtrans-59.9-41.6-179.1-2536.7000112.9I318 F326 L351 L354I318-P322 WeakPolarHBondContact O-CD 3.47Å; P322-F326 WeakPolarHBondContact O-CB 3.13Å; P322-F326 PolarHBondContact O-N 3.02Å; P322-L351 HydrophobicContact CB-CD2 3.74Å; P322-L354 HydrophobicContact CB-CD2 4.29Å; P322-L354 HydrophobicContact CG-CD2 4.06Å
323G93.8Very high92.9Very high2 Ų250.5 Ų50.52%0.02127%0.265CS..Hα-helixtrans-67.6-38.3177.900000113.2T320 L321 T327T320-G323 PolarHBondContact O-N 3.47Å; L321-G323 VanDerWaalsContact C-N 3.32Å; L321-G323 PolarHBondContact O-N 3.09Å; G323-T327 WeakPolarHBondContact O-CB 3.44Å; G323-T327 PolarHBondContact O-N 3.41Å; G323-T327 PolarHBondContact O-OG1 2.72Å
324T92.9Very high92.7Very high16 Ų1655.4 Ų55.410%0.09829%0.291CS..Hα-helixtrans-68.4-42.9176.860.70000111.9A219 T320 L321 T327 F328A219-T324 HydrophobicContact CB-CG2 3.47Å; A219-T324 VanDerWaalsContact CB-CG2 3.47Å; T320-T324 VanDerWaalsContact O-CG2 3.24Å; T320-T324 WeakPolarHBondContact O-CG2 3.49Å; T320-T324 PolarHBondContact O-N 2.97Å; T320-T324 PolarHBondContact O-OG1 3.37Å; L321-T324 WeakPolarHBondContact CA-OG1 3.49Å; L321-T324 PolarHBondContact O-N 3.26Å; L321-T324 PolarHBondContact O-OG1 2.93Å; T324-T327 PolarHBondContact O-N 3.23Å; T324-F328 VanDerWaalsContact O-CB 3.25Å; T324-F328 WeakPolarHBondContact O-CB 3.37Å; T324-F328 PolarHBondContact O-N 3.33Å
325I94.3Very high92.6Very high80 Ų8058.9 Ų58.941%0.4130%0.3SS..Hα-helixtrans-61.7-47.8175.7-67.9172.4000110.5L321 T327 F328 L329L321-I325 HydrophobicContact CD1-CD1 3.94Å; L321-I325 HydrophobicContact CD1-CG1 4.07Å; L321-I325 HydrophobicContact CD2-CD1 4.27Å; L321-I325 HydrophobicContact CG-CD1 3.71Å; L321-I325 HydrophobicContact CG-CG1 4.24Å; L321-I325 WeakPolarHBondContact O-CG1 3.17Å; L321-I325 PolarHBondContact O-N 3.18Å; I325-T327 PolarHBondContact O-N 2.94Å; I325-F328 PolarHBondContact O-N 2.82Å; I325-L329 HydrophobicContact CG2-CD1 3.84Å; I325-L329 HydrophobicContact CG2-CG 4.27Å; I325-L329 WeakPolarHBondContact O-CB 3.39Å; I325-L329 WeakPolarHBondContact O-CG 3.21Å; I325-L329 PolarHBondContact O-N 3.15Å
326F94.3Very high92.5Very high19 Ų1959.9 Ų59.98%0.08330%0.303CS..Hα-helixtrans-58.9-47.2178.6-179.5-94.4000111.9P322 F328 L329 S330 F336 H344 I347 K348 L351P322-F326 WeakPolarHBondContact O-CB 3.13Å; P322-F326 PolarHBondContact O-N 3.02Å; F326-F328 VanDerWaalsContact C-N 3.32Å; F326-F328 PolarHBondContact O-N 3.48Å; F326-L329 PolarHBondContact O-N 3.36Å; F326-S330 VanDerWaalsContact O-CB 3.24Å; F326-S330 WeakPolarHBondContact O-CB 3.13Å; F326-S330 PolarHBondContact O-N 2.92Å; F326-F336 HydrophobicContact CD2-CD2 4.12Å; F326-F336 AromaticContact CD2-CE2 3.61Å; F326-F336 HydrophobicContact CD2-CE2 3.61Å; F326-F336 HydrophobicContact CD2-CZ 4.12Å; F326-F336 AromaticContact CE2-CD2 3.77Å; F326-F336 HydrophobicContact CE2-CD2 3.77Å; F326-F336 AromaticContact CE2-CE2 3.7Å; F326-F336 HydrophobicContact CE2-CE2 3.7Å; F326-F336 HydrophobicContact CE2-CG 4.34Å; F326-F336 HydrophobicContact CE2-CZ 4.2Å; F326-F336 HydrophobicContact CZ-CD2 4.37Å; F326-H344 AromaticContact CE1-NE2 3.84Å; F326-H344 AromaticContact CZ-CD2 3.73Å; F326-H344 AromaticContact CZ-NE2 3.59Å; F326-I347 HydrophobicContact CD2-CG2 3.89Å; F326-I347 HydrophobicContact CE1-CG2 4.44Å; F326-I347 HydrophobicContact CE2-CB 4.37Å; F326-I347 HydrophobicContact CE2-CG2 3.55Å; F326-I347 HydrophobicContact CG-CG2 4.47Å; F326-I347 HydrophobicContact CZ-CB 4.34Å; F326-I347 HydrophobicContact CZ-CG2 3.85Å; F326-K348 HydrophobicContact CE1-CB 4.26Å; F326-L351 HydrophobicContact CB-CD1 3.39Å; F326-L351 HydrophobicContact CD1-CD1 3.81Å; F326-L351 HydrophobicContact CD2-CD1 3.99Å; F326-L351 HydrophobicContact CG-CD1 3.45Å; F326-L351 VanDerWaalsContact CG-CD1 3.45Å
327T91.4Very high92.2Very high67 Ų6767.1 Ų67.141%0.41134%0.336SS..Hα-helixtrans-63.9-39.5178.6-57.80000111.4G323 T324 I325 S331G323-T327 WeakPolarHBondContact O-CB 3.44Å; G323-T327 PolarHBondContact O-N 3.41Å; G323-T327 PolarHBondContact O-OG1 2.72Å; T324-T327 PolarHBondContact O-N 3.23Å; I325-T327 PolarHBondContact O-N 2.94Å; T327-S331 WeakPolarHBondContact O-CB 3.5Å; T327-S331 PolarHBondContact O-N 3.09Å
328F91.4Very high92.1Very high85 Ų8573 Ų7337%0.37337%0.367SS..Hα-helixtrans-65.3-49.5177.4177.1-102.6000112.1T324 I325 F326 S330 S331 Y332 F333T324-F328 VanDerWaalsContact O-CB 3.25Å; T324-F328 WeakPolarHBondContact O-CB 3.37Å; T324-F328 PolarHBondContact O-N 3.33Å; I325-F328 PolarHBondContact O-N 2.82Å; F326-F328 VanDerWaalsContact C-N 3.32Å; F326-F328 PolarHBondContact O-N 3.48Å; F328-S330 VanDerWaalsContact C-N 3.33Å; F328-S330 PolarHBondContact O-N 2.87Å; F328-S331 PolarHBondContact O-N 3.41Å; F328-Y332 AromaticContact CD2-CD2 3.38Å; F328-Y332 HydrophobicContact CD2-CD2 3.38Å; F328-Y332 AromaticContact CD2-CE2 3.7Å; F328-Y332 HydrophobicContact CD2-CE2 3.7Å; F328-Y332 HydrophobicContact CD2-CG 4.11Å; F328-Y332 HydrophobicContact CE2-CD1 4.44Å; F328-Y332 AromaticContact CE2-CD2 3.58Å; F328-Y332 HydrophobicContact CE2-CD2 3.58Å; F328-Y332 AromaticContact CE2-CE2 3.9Å; F328-Y332 HydrophobicContact CE2-CE2 3.9Å; F328-Y332 AromaticContact CE2-CG 3.87Å; F328-Y332 HydrophobicContact CE2-CG 3.87Å; F328-Y332 HydrophobicContact CG-CD2 4.23Å; F328-Y332 WeakPolarHBondContact O-CB 3.43Å; F328-Y332 PolarHBondContact O-N 3.03Å; F328-F333 HydrophobicContact CD1-CE2 4.42Å; F328-F333 HydrophobicContact CE1-CD2 4.25Å; F328-F333 AromaticContact CE1-CE2 3.61Å; F328-F333 HydrophobicContact CE1-CE2 3.61Å; F328-F333 AromaticContact CZ-CE2 3.94Å; F328-F333 HydrophobicContact CZ-CE2 3.94Å
329L92.5Very high91.9Very high53 Ų5370.6 Ų70.628%0.27735%0.354SS..Hα-helixtrans-61.8-40.6177.5-70.7175.9000112.2I325 F326 F333 N334 Y335 F336I325-L329 HydrophobicContact CG2-CD1 3.84Å; I325-L329 HydrophobicContact CG2-CG 4.27Å; I325-L329 WeakPolarHBondContact O-CB 3.39Å; I325-L329 WeakPolarHBondContact O-CG 3.21Å; I325-L329 PolarHBondContact O-N 3.15Å; F326-L329 PolarHBondContact O-N 3.36Å; L329-F333 HydrophobicContact CD2-CD2 4.09Å; L329-F333 CarbonylContact O-C 3.48Å; L329-F333 WeakPolarHBondContact O-CB 2.84Å; L329-F333 PolarHBondContact O-N 3.23Å; L329-N334 PolarHBondContact O-N 3.47Å; L329-Y335 PolarHBondContact O-N 3.28Å; L329-F336 HydrophobicContact CB-CE2 4.05Å; L329-F336 HydrophobicContact CD1-CE2 4.42Å
330S89Confident91.7Very high34 Ų3476.9 Ų76.924%0.23838%0.383CS..Hα-helixtrans-65.5-46.7175.4-176.20000111.4F326 F328 N334 H344F326-S330 VanDerWaalsContact O-CB 3.24Å; F326-S330 WeakPolarHBondContact O-CB 3.13Å; F326-S330 PolarHBondContact O-N 2.92Å; F328-S330 VanDerWaalsContact C-N 3.33Å; F328-S330 PolarHBondContact O-N 2.87Å; S330-N334 WeakPolarHBondContact O-CA 3.45Å; S330-N334 PolarHBondContact O-N 3.02Å; S330-N334 PolarHBondContact O-OD1 3.27Å; S330-H344 PolarHBondContact OG-NE2 2.96Å
331S86.3Confident91.3Very high71 Ų7184.5 Ų84.550%0.49742%0.416SS..Hα-helixtrans-80.7-28.8-172.6-174.50000115.3T327 F328T327-S331 WeakPolarHBondContact O-CB 3.5Å; T327-S331 PolarHBondContact O-N 3.09Å; F328-S331 PolarHBondContact O-N 3.41Å
332Y87.7Confident90.8Very high98 Ų9884.9 Ų84.938%0.38442%0.416SS..Hα-helixtrans-105.6-37.2-175-76.7-93.3000113.1L215 F328L215-Y332 HydrophobicContact CD2-CE2 4.07Å; F328-Y332 AromaticContact CD2-CD2 3.38Å; F328-Y332 HydrophobicContact CD2-CD2 3.38Å; F328-Y332 AromaticContact CD2-CE2 3.7Å; F328-Y332 HydrophobicContact CD2-CE2 3.7Å; F328-Y332 HydrophobicContact CD2-CG 4.11Å; F328-Y332 HydrophobicContact CE2-CD1 4.44Å; F328-Y332 AromaticContact CE2-CD2 3.58Å; F328-Y332 HydrophobicContact CE2-CD2 3.58Å; F328-Y332 AromaticContact CE2-CE2 3.9Å; F328-Y332 HydrophobicContact CE2-CE2 3.9Å; F328-Y332 AromaticContact CE2-CG 3.87Å; F328-Y332 HydrophobicContact CE2-CG 3.87Å; F328-Y332 HydrophobicContact CG-CD2 4.23Å; F328-Y332 WeakPolarHBondContact O-CB 3.43Å; F328-Y332 PolarHBondContact O-N 3.03Å
333F90.9Very high90.4Very high137 Ų13784.8 Ų84.860%0.60141%0.414SS*.Hα-helixtrans-105.6-5.4-176.2-66.3-79.7000113F328 L329 Y335F328-F333 HydrophobicContact CD1-CE2 4.42Å; F328-F333 HydrophobicContact CE1-CD2 4.25Å; F328-F333 AromaticContact CE1-CE2 3.61Å; F328-F333 HydrophobicContact CE1-CE2 3.61Å; F328-F333 AromaticContact CZ-CE2 3.94Å; F328-F333 HydrophobicContact CZ-CE2 3.94Å; L329-F333 HydrophobicContact CD2-CD2 4.09Å; L329-F333 CarbonylContact O-C 3.48Å; L329-F333 WeakPolarHBondContact O-CB 2.84Å; L329-F333 PolarHBondContact O-N 3.23Å; F333-Y335 PolarHBondContact O-N 3.36Å
334N88.6Confident90.2Very high112 Ų11286.4 Ų86.460%0.59942%0.421SS*.  trans46.532.6-171.6-67.7-31000112.2L329 S330 F336 H337L329-N334 PolarHBondContact O-N 3.47Å; S330-N334 WeakPolarHBondContact O-CA 3.45Å; S330-N334 PolarHBondContact O-N 3.02Å; S330-N334 PolarHBondContact O-OD1 3.27Å; N334-F336 PolarHBondContact O-N 3.34Å; N334-F336 VanDerWaalsContact O-N 3.09Å; N334-H337 WeakPolarHBondContact O-CB 3.3Å; N334-H337 PolarHBondContact O-N 2.98Å
335Y91.4Very high89.9Confident164 Ų16488.6 Ų88.664%0.64343%0.432SS*.THydrogen-bonded Turntrans-62.7-26.9-166-176.4-98000113.1L329 F333L329-Y335 PolarHBondContact O-N 3.28Å; F333-Y335 PolarHBondContact O-N 3.36Å
336F91.4Very high89.6Confident48 Ų4887.9 Ų87.921%0.21143%0.427CS..THydrogen-bonded Turntrans-103.924.6-179.5-56.3-68.1000113.1F326 L329 N334 D338 M339F326-F336 HydrophobicContact CD2-CD2 4.12Å; F326-F336 AromaticContact CD2-CE2 3.61Å; F326-F336 HydrophobicContact CD2-CE2 3.61Å; F326-F336 HydrophobicContact CD2-CZ 4.12Å; F326-F336 AromaticContact CE2-CD2 3.77Å; F326-F336 HydrophobicContact CE2-CD2 3.77Å; F326-F336 AromaticContact CE2-CE2 3.7Å; F326-F336 HydrophobicContact CE2-CE2 3.7Å; F326-F336 HydrophobicContact CE2-CG 4.34Å; F326-F336 HydrophobicContact CE2-CZ 4.2Å; F326-F336 HydrophobicContact CZ-CD2 4.37Å; L329-F336 HydrophobicContact CB-CE2 4.05Å; L329-F336 HydrophobicContact CD1-CE2 4.42Å; N334-F336 PolarHBondContact O-N 3.34Å; N334-F336 VanDerWaalsContact O-N 3.09Å; F336-D338 VanDerWaalsContact C-N 3.3Å; F336-D338 PolarHBondContact O-N 3.26Å; F336-M339 HydrophobicContact CB-CB 4.26Å; F336-M339 HydrophobicContact CB-CE 4.36Å; F336-M339 HydrophobicContact CD1-CE 3.53Å; F336-M339 HydrophobicContact CE1-CE 4.11Å; F336-M339 HydrophobicContact CG-CE 4.19Å; F336-M339 VanDerWaalsContact O-CB 3.29Å; F336-M339 WeakPolarHBondContact O-CB 3.26Å; F336-M339 PolarHBondContact O-N 3.05Å
337H89.2Confident89.4Confident151 Ų15190 Ų9070%0.69944%0.438SS*.THydrogen-bonded Turntrans-58.7-39.4-179.2177.7-88.7000113N334 M339N334-H337 WeakPolarHBondContact O-CB 3.3Å; N334-H337 PolarHBondContact O-N 2.98Å; H337-M339 PolarHBondContact O-N 3.49Å
338D92Very high89.4Confident156 Ų15692 Ų9283%0.83444%0.441SS*.THydrogen-bonded Turntrans-81.2-3.7-177.9-57.4-27.4000113.2F336F336-D338 VanDerWaalsContact C-N 3.3Å; F336-D338 PolarHBondContact O-N 3.26Å
339M90.8Very high89.3Confident57 Ų5791.9 Ų91.928%0.28144%0.439SS..SBendtrans-73.3135.8179.4-173.5-178.3-74.300110.8F336 H337 K341 T343 H344 I347F336-M339 HydrophobicContact CB-CB 4.26Å; F336-M339 HydrophobicContact CB-CE 4.36Å; F336-M339 HydrophobicContact CD1-CE 3.53Å; F336-M339 HydrophobicContact CE1-CE 4.11Å; F336-M339 HydrophobicContact CG-CE 4.19Å; F336-M339 VanDerWaalsContact O-CB 3.29Å; F336-M339 WeakPolarHBondContact O-CB 3.26Å; F336-M339 PolarHBondContact O-N 3.05Å; H337-M339 PolarHBondContact O-N 3.49Å; M339-K341 PolarHBondContact O-N 3.23Å; M339-T343 HydrophobicContact CG-CG2 4.33Å; M339-T343 HydrophobicContact SD-CG2 4.13Å; M339-H344 HydrophobicContact CG-CB 4.26Å; M339-H344 HydrophobicContact SD-CB 3.84Å; M339-I347 HydrophobicContact CE-CD1 4.02Å; M339-I347 HydrophobicContact SD-CD1 3.88Å
340Q91.6Very high89.3Confident137 Ų13791.2 Ų91.264%0.6445%0.445SS*.  trans-54.3129.7173.3-170.5-178.67.800110.9H342 T343 H344Q340-H342 VanDerWaalsContact C-N 3.25Å; Q340-H342 PolarHBondContact O-N 3.01Å; Q340-H342 VanDerWaalsContact O-N 3.14Å; Q340-T343 WeakPolarHBondContact O-CB 3.31Å; Q340-T343 PolarHBondContact O-N 3.22Å; Q340-H344 PolarHBondContact O-N 3.36Å
341K86.9Confident89.5Confident163 Ų16391 Ų9171%0.70944%0.441SS*.Hα-helixtrans-50-42.6-177-175.9177.9179.1179.70113.6M339 H344 D345M339-K341 PolarHBondContact O-N 3.23Å; K341-H344 PolarHBondContact O-N 3.48Å; K341-D345 WeakPolarHBondContact O-CB 3.32Å; K341-D345 VanDerWaalsContact O-CG 3.29Å; K341-D345 PolarHBondContact O-N 2.79Å
342H84.8Confident89.8Confident78 Ų7889 Ų8936%0.36143%0.426SS..Hα-helixtrans-60.1-47.3178.1177.4-90.3000112.3Q340 D345 Q346Q340-H342 VanDerWaalsContact C-N 3.25Å; Q340-H342 PolarHBondContact O-N 3.01Å; Q340-H342 VanDerWaalsContact O-N 3.14Å; H342-D345 PolarHBondContact O-N 3.33Å; H342-Q346 PolarHBondContact CE1-NE2 3.25Å; H342-Q346 WeakPolarHBondContact O-CG 3.2Å; H342-Q346 PolarHBondContact O-N 3.17Å
343T88.3Confident90.1Very high52 Ų5284.4 Ų84.432%0.31941%0.408SS..Hα-helixtrans-64.7-43.9177.9-53.60000111.2M339 Q340 D345 Q346 I347M339-T343 HydrophobicContact CG-CG2 4.33Å; M339-T343 HydrophobicContact SD-CG2 4.13Å; Q340-T343 WeakPolarHBondContact O-CB 3.31Å; Q340-T343 PolarHBondContact O-N 3.22Å; T343-D345 VanDerWaalsContact C-N 3.32Å; T343-D345 PolarHBondContact O-N 3.5Å; T343-Q346 PolarHBondContact O-N 3.4Å; T343-I347 HydrophobicContact CG2-CD1 4.11Å; T343-I347 WeakPolarHBondContact O-CG1 3.36Å; T343-I347 PolarHBondContact O-N 3.44Å
344H88.9Confident90.3Very high37 Ų3780 Ų8017%0.17139%0.39CS..Hα-helixtrans-59-44.6176.4-178.2-78.7000111.5F326 S330 M339 Q340 K341 K348F326-H344 AromaticContact CE1-NE2 3.84Å; F326-H344 AromaticContact CZ-CD2 3.73Å; F326-H344 AromaticContact CZ-NE2 3.59Å; S330-H344 PolarHBondContact OG-NE2 2.96Å; M339-H344 HydrophobicContact CG-CB 4.26Å; M339-H344 HydrophobicContact SD-CB 3.84Å; Q340-H344 PolarHBondContact O-N 3.36Å; K341-H344 PolarHBondContact O-N 3.48Å; H344-K348 WeakPolarHBondContact O-CB 3.34Å; H344-K348 PolarHBondContact O-N 3.22Å
345D86.6Confident90.7Very high61 Ų6175.8 Ų75.833%0.32637%0.367SS..Hα-helixtrans-64.2-47.3177.4-73.3-20.2000111.1K341 H342 T343 I347 K348 Y349K341-D345 WeakPolarHBondContact O-CB 3.32Å; K341-D345 VanDerWaalsContact O-CG 3.29Å; K341-D345 PolarHBondContact O-N 2.79Å; H342-D345 PolarHBondContact O-N 3.33Å; T343-D345 VanDerWaalsContact C-N 3.32Å; T343-D345 PolarHBondContact O-N 3.5Å; D345-I347 VanDerWaalsContact C-N 3.35Å; D345-I347 PolarHBondContact O-N 3.07Å; D345-K348 WeakPolarHBondContact O-CB 3.01Å; D345-K348 PolarHBondContact O-N 3.04Å; D345-K348 VanDerWaalsContact O-N 3.12Å; D345-Y349 HydrophobicContact CB-CD2 4.46Å; D345-Y349 HydrophobicContact CB-CE2 4.34Å; D345-Y349 WeakPolarHBondContact O-CD2 3.47Å; D345-Y349 PolarHBondContact O-N 2.97Å
346Q87.8Confident90.9Very high65 Ų6568.8 Ų68.830%0.30434%0.341SS..Hα-helixtrans-57.1-44.5177.5-76.7-170.3-28.900112.9H342 T343 Y349 G350H342-Q346 PolarHBondContact CE1-NE2 3.25Å; H342-Q346 WeakPolarHBondContact O-CG 3.2Å; H342-Q346 PolarHBondContact O-N 3.17Å; T343-Q346 PolarHBondContact O-N 3.4Å; Q346-Y349 PolarHBondContact O-N 3.23Å; Q346-G350 PolarHBondContact O-N 3.29Å
347I90.9Very high91.1Very high64 Ų6467.3 Ų67.333%0.32834%0.335SS..Hα-helixtrans-61.2-47.2175.7-68.2168.5000110.1F326 M339 T343 D345 Y349 G350 L351F326-I347 HydrophobicContact CD2-CG2 3.89Å; F326-I347 HydrophobicContact CE1-CG2 4.44Å; F326-I347 HydrophobicContact CE2-CB 4.37Å; F326-I347 HydrophobicContact CE2-CG2 3.55Å; F326-I347 HydrophobicContact CG-CG2 4.47Å; F326-I347 HydrophobicContact CZ-CB 4.34Å; F326-I347 HydrophobicContact CZ-CG2 3.85Å; M339-I347 HydrophobicContact CE-CD1 4.02Å; M339-I347 HydrophobicContact SD-CD1 3.88Å; T343-I347 HydrophobicContact CG2-CD1 4.11Å; T343-I347 WeakPolarHBondContact O-CG1 3.36Å; T343-I347 PolarHBondContact O-N 3.44Å; D345-I347 VanDerWaalsContact C-N 3.35Å; D345-I347 PolarHBondContact O-N 3.07Å; I347-Y349 VanDerWaalsContact C-N 3.35Å; I347-Y349 PolarHBondContact O-N 3.39Å; I347-G350 PolarHBondContact O-N 2.87Å; I347-L351 HydrophobicContact CG2-CD1 3.72Å; I347-L351 HydrophobicContact CG2-CG 4.28Å; I347-L351 VanDerWaalsContact O-CG 3.3Å; I347-L351 WeakPolarHBondContact O-CG 3.3Å; I347-L351 PolarHBondContact O-N 2.9Å
348K90.5Very high91.4Very high109 Ų10960.4 Ų60.447%0.47430%0.304SS..Hα-helixtrans-58.8-44.4178.1-175.9178.8179.9177.90111.9F326 H344 D345 L351 V352F326-K348 HydrophobicContact CE1-CB 4.26Å; H344-K348 WeakPolarHBondContact O-CB 3.34Å; H344-K348 PolarHBondContact O-N 3.22Å; D345-K348 WeakPolarHBondContact O-CB 3.01Å; D345-K348 PolarHBondContact O-N 3.04Å; D345-K348 VanDerWaalsContact O-N 3.12Å; K348-L351 PolarHBondContact O-N 3.01Å; K348-V352 HydrophobicContact CG-CG2 4.49Å; K348-V352 WeakPolarHBondContact O-CB 3.48Å; K348-V352 VanDerWaalsContact O-CG2 3.24Å; K348-V352 WeakPolarHBondContact O-CG2 3.27Å; K348-V352 PolarHBondContact O-N 3.28Å
349Y89.2Confident91.6Very high82 Ų8253.4 Ų53.432%0.32227%0.266SS..Hα-helixtrans-60-49.2175.5-81.9-79.4000111.4I14 Y68 D345 Q346 I347 L351 V352 M353I14-Y349 HydrophobicContact CD1-CG 4.26Å; Y68-Y349 AromaticContact CD1-CD1 3.92Å; Y68-Y349 HydrophobicContact CD1-CD1 3.92Å; Y68-Y349 AromaticContact CD1-CE1 3.88Å; Y68-Y349 HydrophobicContact CD1-CE1 3.88Å; Y68-Y349 AromaticContact CE1-CD1 3.54Å; Y68-Y349 HydrophobicContact CE1-CD1 3.54Å; Y68-Y349 AromaticContact CE1-CE1 3.44Å; Y68-Y349 HydrophobicContact CE1-CE1 3.44Å; Y68-Y349 VanDerWaalsContact CE1-CE1 3.44Å; D345-Y349 HydrophobicContact CB-CD2 4.46Å; D345-Y349 HydrophobicContact CB-CE2 4.34Å; D345-Y349 WeakPolarHBondContact O-CD2 3.47Å; D345-Y349 PolarHBondContact O-N 2.97Å; Q346-Y349 PolarHBondContact O-N 3.23Å; I347-Y349 VanDerWaalsContact C-N 3.35Å; I347-Y349 PolarHBondContact O-N 3.39Å; Y349-L351 VanDerWaalsContact C-N 3.32Å; Y349-L351 PolarHBondContact O-N 2.93Å; Y349-V352 PolarHBondContact O-N 2.79Å; Y349-M353 WeakPolarHBondContact O-CG 3.26Å; Y349-M353 PolarHBondContact O-N 2.86Å
350G91.8Very high91.9Very high39 Ų3951 Ų5140%0.40226%0.255SS..Hα-helixtrans-57.2-44.1178.200000112.7Q346 I347 M353 L354Q346-G350 PolarHBondContact O-N 3.29Å; I347-G350 PolarHBondContact O-N 2.87Å; G350-M353 PolarHBondContact O-N 3.27Å; G350-L354 PolarHBondContact O-N 3.45Å
351L94.4Very high92.1Very high29 Ų2947 Ų4715%0.15224%0.238CC..Hα-helixtrans-68-37.1178-68.3174.2000113P322 F326 I347 K348 Y349 L354 I355P322-L351 HydrophobicContact CB-CD2 3.74Å; F326-L351 HydrophobicContact CB-CD1 3.39Å; F326-L351 HydrophobicContact CD1-CD1 3.81Å; F326-L351 HydrophobicContact CD2-CD1 3.99Å; F326-L351 HydrophobicContact CG-CD1 3.45Å; F326-L351 VanDerWaalsContact CG-CD1 3.45Å; I347-L351 HydrophobicContact CG2-CD1 3.72Å; I347-L351 HydrophobicContact CG2-CG 4.28Å; I347-L351 VanDerWaalsContact O-CG 3.3Å; I347-L351 WeakPolarHBondContact O-CG 3.3Å; I347-L351 PolarHBondContact O-N 2.9Å; K348-L351 PolarHBondContact O-N 3.01Å; Y349-L351 VanDerWaalsContact C-N 3.32Å; Y349-L351 PolarHBondContact O-N 2.93Å; L351-L354 WeakPolarHBondContact O-CB 3.31Å; L351-L354 PolarHBondContact O-N 2.94Å; L351-I355 WeakPolarHBondContact O-CG1 3.44Å; L351-I355 PolarHBondContact O-N 3.27Å
352V92.9Very high92.4Very high30 Ų3039.4 Ų39.418%0.18221%0.205CC..Hα-helixtrans-65.4-40.6174.5167.80000111.2Y68 K348 Y349 L354 I355 F356Y68-V352 HydrophobicContact CE2-CG1 4.11Å; K348-V352 HydrophobicContact CG-CG2 4.49Å; K348-V352 WeakPolarHBondContact O-CB 3.48Å; K348-V352 VanDerWaalsContact O-CG2 3.24Å; K348-V352 WeakPolarHBondContact O-CG2 3.27Å; K348-V352 PolarHBondContact O-N 3.28Å; Y349-V352 PolarHBondContact O-N 2.79Å; V352-L354 VanDerWaalsContact C-N 3.33Å; V352-I355 WeakPolarHBondContact O-CB 3.35Å; V352-I355 PolarHBondContact O-N 3.41Å; V352-F356 HydrophobicContact CG1-CD2 3.86Å; V352-F356 HydrophobicContact CG1-CE2 3.28Å; V352-F356 HydrophobicContact CG1-CZ 4.01Å; V352-F356 VanDerWaalsContact O-CD2 3.22Å; V352-F356 WeakPolarHBondContact O-CD2 3.32Å; V352-F356 PolarHBondContact O-N 3.32Å
353M93.4Very high92.8Very high1 Ų137.4 Ų37.41%0.00520%0.195CC..Hα-helixtrans-66.7-36.6175.2-63.8-59.8-85.900112I14 Y17 A18 L21 Y68 Y349 G350 F356 T357I14-M353 HydrophobicContact CG2-CE 4.44Å; Y17-M353 HydrophobicContact CD1-CB 3.69Å; Y17-M353 HydrophobicContact CD1-CG 4.41Å; Y17-M353 HydrophobicContact CE1-CB 3.63Å; A18-M353 VanDerWaalsContact CA-CE 3.41Å; A18-M353 HydrophobicContact CB-CE 3.44Å; A18-M353 VanDerWaalsContact CB-CE 3.44Å; L21-M353 HydrophobicContact CD1-CE 4.01Å; Y68-M353 HydrophobicContact CD2-SD 4.43Å; Y68-M353 HydrophobicContact CG-SD 4.24Å; Y349-M353 WeakPolarHBondContact O-CG 3.26Å; Y349-M353 PolarHBondContact O-N 2.86Å; G350-M353 PolarHBondContact O-N 3.27Å; M353-F356 PolarHBondContact O-N 3.09Å; M353-F356 HydrophobicContact SD-CD2 4.48Å; M353-T357 PolarHBondContact O-N 2.91Å; M353-T357 PolarHBondContact O-OG1 3.02Å
354L95.7Very high93.1Very high45 Ų4539 Ų3924%0.23620%0.198CC..Hα-helixtrans-61.5-43.1171.8-17862.7000111.3C319 P322 G350 L351 V352 F356 T357C319-L354 WeakPolarHBondContact CB-O 3.32Å; C319-L354 CarbonylContact O-C 3.56Å; P322-L354 HydrophobicContact CB-CD2 4.29Å; P322-L354 HydrophobicContact CG-CD2 4.06Å; G350-L354 PolarHBondContact O-N 3.45Å; L351-L354 WeakPolarHBondContact O-CB 3.31Å; L351-L354 PolarHBondContact O-N 2.94Å; V352-L354 VanDerWaalsContact C-N 3.33Å; L354-F356 PolarHBondContact O-N 2.92Å; L354-T357 WeakPolarHBondContact O-CB 3.39Å; L354-T357 PolarHBondContact O-N 3.26Å; L354-T357 VanDerWaalsContact O-N 3.1Å; L354-T357 PolarHBondContact O-OG1 3.1Å
355I95.5Very high93.2Very high23 Ų2337.4 Ų37.412%0.11819%0.191CC..Hα-helixtrans-57.1-48.1174.1-72.1162.8000110.8F218 C319 T320 L351 V352 T357 N358F218-I355 HydrophobicContact CE1-CG2 4.14Å; F218-I355 HydrophobicContact CZ-CG2 3.74Å; C319-I355 WeakPolarHBondContact O-CA 3.46Å; C319-I355 PolarHBondContact O-N 2.89Å; T320-I355 HydrophobicContact CG2-CG2 4.39Å; L351-I355 WeakPolarHBondContact O-CG1 3.44Å; L351-I355 PolarHBondContact O-N 3.27Å; V352-I355 WeakPolarHBondContact O-CB 3.35Å; V352-I355 PolarHBondContact O-N 3.41Å; I355-T357 PolarHBondContact O-N 2.96Å; I355-N358 WeakPolarHBondContact O-CB 3.21Å; I355-N358 PolarHBondContact O-N 3.24Å; I355-N358 VanDerWaalsContact O-N 3.16Å
356F95.9Very high93.5Very high18 Ų1834.8 Ų34.88%0.07918%0.177CC..Hα-helixtrans-68.7-16.7179.5-64.7-47.4000114.3L21 V60 A64 V65 Y68 T97 V352 M353 L354 N358 N359 A360L21-F356 HydrophobicContact CD1-CB 4.39Å; V60-F356 HydrophobicContact CG1-CD1 3.6Å; V60-F356 HydrophobicContact CG1-CE1 3.82Å; A64-F356 HydrophobicContact CB-CD1 4.3Å; A64-F356 HydrophobicContact CB-CE1 3.57Å; A64-F356 HydrophobicContact CB-CE2 4Å; A64-F356 HydrophobicContact CB-CZ 3.41Å; A64-F356 VanDerWaalsContact CB-CZ 3.41Å; V65-F356 HydrophobicContact CG2-CB 3.59Å; V65-F356 HydrophobicContact CG2-CD1 4.42Å; V65-F356 HydrophobicContact CG2-CD2 3.91Å; V65-F356 HydrophobicContact CG2-CG 3.73Å; Y68-F356 HydrophobicContact CD2-CE2 4.24Å; Y68-F356 AromaticContact CE2-CE2 3.74Å; Y68-F356 HydrophobicContact CE2-CE2 3.74Å; T97-F356 HydrophobicContact CG2-CE1 4Å; V352-F356 HydrophobicContact CG1-CD2 3.86Å; V352-F356 HydrophobicContact CG1-CE2 3.28Å; V352-F356 HydrophobicContact CG1-CZ 4.01Å; V352-F356 VanDerWaalsContact O-CD2 3.22Å; V352-F356 WeakPolarHBondContact O-CD2 3.32Å; V352-F356 PolarHBondContact O-N 3.32Å; M353-F356 PolarHBondContact O-N 3.09Å; M353-F356 HydrophobicContact SD-CD2 4.48Å; L354-F356 PolarHBondContact O-N 2.92Å; F356-N358 PolarHBondContact O-N 2.87Å; F356-N359 PolarHBondContact O-N 3.32Å; F356-A360 PolarHBondContact O-N 2.92Å
357T96.5Very high93.7Very high16 Ų1633 Ų3310%0.09817%0.171CC..Hα-helixtrans-60.7-32.1172.3-58.70000111.6Y17 L21 M353 L354 I355 N359 A360 I361Y17-T357 PolarHBondContact OH-OG1 3.42Å; L21-T357 HydrophobicContact CD2-CG2 4.35Å; M353-T357 PolarHBondContact O-N 2.91Å; M353-T357 PolarHBondContact O-OG1 3.02Å; L354-T357 WeakPolarHBondContact O-CB 3.39Å; L354-T357 PolarHBondContact O-N 3.26Å; L354-T357 VanDerWaalsContact O-N 3.1Å; L354-T357 PolarHBondContact O-OG1 3.1Å; I355-T357 PolarHBondContact O-N 2.96Å; T357-N359 PolarHBondContact O-N 3.31Å; T357-N359 VanDerWaalsContact O-N 3.1Å; T357-A360 PolarHBondContact O-N 3.5Å; T357-A360 VanDerWaalsContact O-N 3.09Å; T357-I361 HydrophobicContact CG2-CB 4.17Å; T357-I361 HydrophobicContact CG2-CD1 4.19Å; T357-I361 HydrophobicContact CG2-CG2 4.44Å; T357-I361 VanDerWaalsContact O-CB 3.3Å; T357-I361 WeakPolarHBondContact O-CB 3.29Å; T357-I361 WeakPolarHBondContact O-CG2 3.44Å; T357-I361 PolarHBondContact O-N 2.67Å
358N95.1Very high93.7Very high7 Ų736.6 Ų36.64%0.03719%0.19CC..Hα-helixtrans-52-33.8173.5179.970000112.6H316 C319 I355 F356 N362H316-N358 VanDerWaalsContact CA-OD1 3.26Å; H316-N358 WeakPolarHBondContact CA-OD1 3.35Å; C319-N358 HydrophobicContact CB-CB 3.77Å; I355-N358 WeakPolarHBondContact O-CB 3.21Å; I355-N358 PolarHBondContact O-N 3.24Å; I355-N358 VanDerWaalsContact O-N 3.16Å; F356-N358 PolarHBondContact O-N 2.87Å; N358-N362 PolarHBondContact O-OD1 3.39Å
359N96.8Very high93.6Very high9 Ų932 Ų325%0.04817%0.172CC..Hα-helixtrans-92.9-18-174.8-62.631.6000112.2N29 D57 V60 F356 T357N29-N359 PolarHBondContact ND2-O 3.2Å; D57-N359 HydrophobicContact CB-CB 4.18Å; D57-N359 WeakPolarHBondContact CB-O 3.28Å; V60-N359 VanDerWaalsContact CB-ND2 3.29Å; V60-N359 WeakPolarHBondContact CB-ND2 3.34Å; V60-N359 HydrophobicContact CG1-CB 4.48Å; V60-N359 VanDerWaalsContact CG1-ND2 3.35Å; V60-N359 WeakPolarHBondContact CG1-ND2 3.07Å; V60-N359 VanDerWaalsContact CG2-ND2 3.31Å; V60-N359 WeakPolarHBondContact CG2-ND2 3.41Å; F356-N359 PolarHBondContact O-N 3.32Å; T357-N359 PolarHBondContact O-N 3.31Å; T357-N359 VanDerWaalsContact O-N 3.1Å
360A97.4Very high93.5Very high5 Ų528.7 Ų28.74%0.04116%0.16CC..Hα-helixtrans-92.3-31.3176.400000112.9L21 L61 F356 T357 N362L21-A360 HydrophobicContact CB-CB 4.38Å; L21-A360 HydrophobicContact CD2-CB 3.66Å; L61-A360 HydrophobicContact CD1-CB 4.5Å; L61-A360 HydrophobicContact CD2-CB 4.15Å; F356-A360 PolarHBondContact O-N 2.92Å; T357-A360 PolarHBondContact O-N 3.5Å; T357-A360 VanDerWaalsContact O-N 3.09Å; A360-N362 PolarHBondContact O-N 3.01Å
361I95.7Very high93.2Very high54 Ų5430.3 Ų30.328%0.27716%0.162SC..SBendtrans-87.4-4.9-165.9-157.6169.4000114.2I315 T357 F363 F364 G365I315-I361 HydrophobicContact CD1-CG2 4.35Å; I315-I361 HydrophobicContact CG2-CG2 3.34Å; T357-I361 HydrophobicContact CG2-CB 4.17Å; T357-I361 HydrophobicContact CG2-CD1 4.19Å; T357-I361 HydrophobicContact CG2-CG2 4.44Å; T357-I361 VanDerWaalsContact O-CB 3.3Å; T357-I361 WeakPolarHBondContact O-CB 3.29Å; T357-I361 WeakPolarHBondContact O-CG2 3.44Å; T357-I361 PolarHBondContact O-N 2.67Å; I361-F363 PolarHBondContact O-N 2.89Å; I361-F363 VanDerWaalsContact O-N 3.14Å; I361-F364 HydrophobicContact CG1-CB 4.05Å; I361-F364 HydrophobicContact CG1-CD2 3.95Å; I361-F364 HydrophobicContact CG1-CG 4.43Å; I361-F364 PolarHBondContact O-N 3.07Å; I361-G365 PolarHBondContact O-N 2.86Å
362N92.2Very high92.7Very high4 Ų431.7 Ų31.72%0.02117%0.172CC..Hα-helixtrans-52.1-42-176.1-77.3-24000112.5D57 L312 N358 A360 F364 G365 Y366D57-N362 PolarHBondContact OD2-ND2 2.83Å; L312-N362 VanDerWaalsContact CD2-OD1 3.31Å; L312-N362 WeakPolarHBondContact CD2-OD1 3.39Å; N358-N362 PolarHBondContact O-OD1 3.39Å; A360-N362 PolarHBondContact O-N 3.01Å; N362-F364 VanDerWaalsContact C-N 3.34Å; N362-F364 PolarHBondContact O-N 3.03Å; N362-G365 CarbonylContact O-C 3.2Å; N362-G365 WeakPolarHBondContact O-CA 3.4Å; N362-G365 PolarHBondContact O-N 3.19Å; N362-G365 VanDerWaalsContact O-N 3.08Å; N362-Y366 VanDerWaalsContact C-CD2 3.43Å; N362-Y366 HydrophobicContact CB-CD2 4.43Å; N362-Y366 HydrophobicContact CB-CE2 3.81Å; N362-Y366 WeakPolarHBondContact O-CD2 3.08Å; N362-Y366 PolarHBondContact O-N 3.45Å
363F94.1Very high92.6Very high35 Ų3530.3 Ų30.315%0.15416%0.164CC..Hα-helixtrans-50.3-48.4172.8173.9-101.3000113.8I31 I361 Y366 C367 F373 I377I31-F363 HydrophobicContact CB-CD2 4.45Å; I31-F363 HydrophobicContact CB-CE2 4.38Å; I31-F363 HydrophobicContact CG2-CD2 4.26Å; I31-F363 HydrophobicContact CG2-CE2 3.83Å; I361-F363 PolarHBondContact O-N 2.89Å; I361-F363 VanDerWaalsContact O-N 3.14Å; F363-Y366 PolarHBondContact O-N 2.75Å; F363-C367 PolarHBondContact O-N 3.5Å; F363-C367 PolarHBondContact O-SG 2.95Å; F363-F373 HydrophobicContact CD2-CE1 4.01Å; F363-F373 AromaticContact CD2-CZ 3.84Å; F363-F373 HydrophobicContact CD2-CZ 3.84Å; F363-F373 AromaticContact CE2-CE1 3.9Å; F363-F373 HydrophobicContact CE2-CE1 3.9Å; F363-F373 AromaticContact CE2-CZ 3.95Å; F363-F373 HydrophobicContact CE2-CZ 3.95Å; F363-I377 HydrophobicContact CE2-CD1 3.66Å; F363-I377 HydrophobicContact CZ-CD1 3.82Å
364F93.5Very high92.5Very high85 Ų8535.4 Ų35.437%0.37318%0.183SC..Hα-helixtrans-70-38.3178.9-61.3-77.1000111F24 I361 N362 Y366 C367 I368F24-F364 HydrophobicContact CB-CE2 4.17Å; F24-F364 HydrophobicContact CB-CZ 4.39Å; F24-F364 HydrophobicContact CD1-CZ 4.17Å; F24-F364 HydrophobicContact CG-CZ 4.33Å; I361-F364 HydrophobicContact CG1-CB 4.05Å; I361-F364 HydrophobicContact CG1-CD2 3.95Å; I361-F364 HydrophobicContact CG1-CG 4.43Å; I361-F364 PolarHBondContact O-N 3.07Å; N362-F364 VanDerWaalsContact C-N 3.34Å; N362-F364 PolarHBondContact O-N 3.03Å; F364-Y366 VanDerWaalsContact C-N 3.3Å; F364-Y366 PolarHBondContact O-N 2.9Å; F364-C367 WeakPolarHBondContact O-CB 3.28Å; F364-C367 PolarHBondContact O-N 3.45Å; F364-I368 WeakPolarHBondContact O-CG1 3.45Å; F364-I368 PolarHBondContact O-N 3.41Å
365G92.2Very high92.3Very high4 Ų437.9 Ų37.94%0.04119%0.193CC..Hα-helixtrans-54.7-4517100000112.2I361 N362 S369I361-G365 PolarHBondContact O-N 2.86Å; N362-G365 CarbonylContact O-C 3.2Å; N362-G365 WeakPolarHBondContact O-CA 3.4Å; N362-G365 PolarHBondContact O-N 3.19Å; N362-G365 VanDerWaalsContact O-N 3.08Å; G365-S369 VanDerWaalsContact O-CB 3.29Å; G365-S369 WeakPolarHBondContact O-CB 3.1Å; G365-S369 PolarHBondContact O-N 3.42Å; G365-S369 PolarHBondContact O-OG 2.86Å
366Y91.6Very high92Very high6 Ų639.1 Ų39.12%0.02420%0.202CC..Hα-helixtrans-65.8-42.9175-61.4-58.3000112.2S32 M36 L308 L312 N362 F363 F364 I368 C370S32-Y366 WeakPolarHBondContact OG-CD2 3.39Å; M36-Y366 HydrophobicContact CE-CD1 3.95Å; M36-Y366 HydrophobicContact CE-CE1 3.85Å; M36-Y366 HydrophobicContact SD-CD1 3.17Å; M36-Y366 WeakPolarHBondContact SD-CD1 3.44Å; M36-Y366 HydrophobicContact SD-CD2 4.07Å; M36-Y366 HydrophobicContact SD-CE1 3.21Å; M36-Y366 WeakPolarHBondContact SD-CE1 3.26Å; M36-Y366 HydrophobicContact SD-CE2 4.12Å; M36-Y366 HydrophobicContact SD-CG 3.68Å; L308-Y366 HydrophobicContact CD1-CD1 3.2Å; L308-Y366 HydrophobicContact CD1-CE1 3.31Å; L308-Y366 HydrophobicContact CD1-CG 4.43Å; L308-Y366 HydrophobicContact CD2-CD1 4.28Å; L308-Y366 HydrophobicContact CD2-CE1 4.03Å; L308-Y366 HydrophobicContact CG-CD1 4.33Å; L308-Y366 HydrophobicContact CG-CE1 4.19Å; L312-Y366 HydrophobicContact CD1-CE1 4.28Å; L312-Y366 HydrophobicContact CD2-CE1 4.44Å; N362-Y366 VanDerWaalsContact C-CD2 3.43Å; N362-Y366 HydrophobicContact CB-CD2 4.43Å; N362-Y366 HydrophobicContact CB-CE2 3.81Å; N362-Y366 WeakPolarHBondContact O-CD2 3.08Å; N362-Y366 PolarHBondContact O-N 3.45Å; F363-Y366 PolarHBondContact O-N 2.75Å; F364-Y366 VanDerWaalsContact C-N 3.3Å; F364-Y366 PolarHBondContact O-N 2.9Å; Y366-I368 VanDerWaalsContact C-N 3.33Å; Y366-I368 PolarHBondContact O-N 3.24Å; Y366-C370 WeakPolarHBondContact O-CA 3.23Å; Y366-C370 WeakPolarHBondContact O-CB 3.21Å; Y366-C370 PolarHBondContact O-N 3.42Å
367C91.8Very high91.8Very high27 Ų2739.7 Ų39.718%0.18221%0.205CC..Hα-helixtrans-58.8-41.4177.9-71.50000113.3F363 F364 F373 R374F363-C367 PolarHBondContact O-N 3.5Å; F363-C367 PolarHBondContact O-SG 2.95Å; F364-C367 WeakPolarHBondContact O-CB 3.28Å; F364-C367 PolarHBondContact O-N 3.45Å; C367-F373 VanDerWaalsContact SG-CE1 3.58Å; C367-R374 PolarHBondContact O-NH1 2.68Å
368I90.7Very high91.6Very high140 Ų14043.8 Ų43.872%0.71823%0.226SC*.Hα-helixtrans-75-49.7-178.3-66.1167.7000110.1F364 Y366F364-I368 WeakPolarHBondContact O-CG1 3.45Å; F364-I368 PolarHBondContact O-N 3.41Å; Y366-I368 VanDerWaalsContact C-N 3.33Å; Y366-I368 PolarHBondContact O-N 3.24Å
369S88.6Confident91.4Very high14 Ų1451.2 Ų51.210%0.09825%0.253CS..Hα-helixtrans-82.3-31.5-170.464.40000114.5G365G365-S369 VanDerWaalsContact O-CB 3.29Å; G365-S369 WeakPolarHBondContact O-CB 3.1Å; G365-S369 PolarHBondContact O-N 3.42Å; G365-S369 PolarHBondContact O-OG 2.86Å
370C87.2Confident91Very high12 Ų1253.8 Ų53.88%0.08127%0.272CS..  trans-112.5111.3-168.1-170.50000112.2Y366 T372 F373 R374Y366-C370 WeakPolarHBondContact O-CA 3.23Å; Y366-C370 WeakPolarHBondContact O-CB 3.21Å; Y366-C370 PolarHBondContact O-N 3.42Å; C370-T372 PolarHBondContact SG-OG1 2.99Å; C370-F373 HydrophobicContact CB-CB 3.73Å; C370-F373 WeakPolarHBondContact O-CB 3.35Å; C370-F373 PolarHBondContact O-N 2.59Å; C370-R374 PolarHBondContact O-N 3.27Å; C370-R374 VanDerWaalsContact O-N 3.15Å
371T86.4Confident90.6Very high72 Ų7258.3 Ų58.344%0.44230%0.295SS..Hα-helixtrans-69.6-36.2-178.754.40000113F373 R374 Q375T371-F373 VanDerWaalsContact C-N 3.34Å; T371-R374 PolarHBondContact O-N 2.89Å; T371-Q375 WeakPolarHBondContact O-CB 3.36Å; T371-Q375 VanDerWaalsContact O-CG 3.28Å; T371-Q375 WeakPolarHBondContact O-CG 3.45Å; T371-Q375 PolarHBondContact O-N 3.42Å
372T84.7Confident90.3Very high58 Ų5859 Ų5936%0.35630%0.304SS..Hα-helixtrans-67.7-38178.555.30000111.3C370 Q375 T376C370-T372 PolarHBondContact SG-OG1 2.99Å; T372-Q375 PolarHBondContact O-N 3.34Å; T372-T376 PolarHBondContact O-N 3.08Å; T372-T376 PolarHBondContact O-OG1 2.97Å
373F89.8Confident89.8Confident2 Ų265.1 Ų65.11%0.00933%0.333CS..Hα-helixtrans-59.1-53.7172.7-171-97.3000111.1I35 M36 F363 C367 C370 T371 Q375 T376 I377I35-F373 HydrophobicContact CB-CD2 3.89Å; I35-F373 HydrophobicContact CB-CE2 3.67Å; I35-F373 HydrophobicContact CD1-CD2 4.35Å; I35-F373 HydrophobicContact CD1-CE2 3.89Å; I35-F373 HydrophobicContact CD1-CZ 4.1Å; I35-F373 HydrophobicContact CG1-CE2 4.33Å; I35-F373 HydrophobicContact CG2-CD2 3.4Å; I35-F373 HydrophobicContact CG2-CE2 3.74Å; I35-F373 HydrophobicContact CG2-CG 4.26Å; M36-F373 HydrophobicContact CG-CD2 3.66Å; M36-F373 HydrophobicContact CG-CE2 3.95Å; M36-F373 HydrophobicContact SD-CD2 4.35Å; F363-F373 HydrophobicContact CD2-CE1 4.01Å; F363-F373 AromaticContact CD2-CZ 3.84Å; F363-F373 HydrophobicContact CD2-CZ 3.84Å; F363-F373 AromaticContact CE2-CE1 3.9Å; F363-F373 HydrophobicContact CE2-CE1 3.9Å; F363-F373 AromaticContact CE2-CZ 3.95Å; F363-F373 HydrophobicContact CE2-CZ 3.95Å; C367-F373 VanDerWaalsContact SG-CE1 3.58Å; C370-F373 HydrophobicContact CB-CB 3.73Å; C370-F373 WeakPolarHBondContact O-CB 3.35Å; C370-F373 PolarHBondContact O-N 2.59Å; T371-F373 VanDerWaalsContact C-N 3.34Å; F373-Q375 PolarHBondContact O-N 3.16Å; F373-T376 WeakPolarHBondContact O-CB 3.32Å; F373-T376 PolarHBondContact O-N 3.44Å; F373-T376 VanDerWaalsContact O-N 3.11Å; F373-I377 HydrophobicContact CD1-CD1 3.68Å; F373-I377 HydrophobicContact CD1-CG1 4.49Å; F373-I377 HydrophobicContact CE1-CD1 3.28Å; F373-I377 HydrophobicContact CE1-CG1 4.3Å; F373-I377 HydrophobicContact CZ-CD1 3.97Å; F373-I377 PolarHBondContact O-N 2.98Å
374R92.1Very high89.3Confident108 Ų10868.3 Ų68.341%0.40835%0.351SS..Hα-helixtrans-59.6-42.4178.8-174.9169.264.4-118.99.5112.8C367 C370 T371 T376 I377 I378C367-R374 PolarHBondContact O-NH1 2.68Å; C370-R374 PolarHBondContact O-N 3.27Å; C370-R374 VanDerWaalsContact O-N 3.15Å; T371-R374 PolarHBondContact O-N 2.89Å; R374-T376 VanDerWaalsContact C-N 3.31Å; R374-T376 PolarHBondContact O-N 3.4Å; R374-I377 PolarHBondContact O-N 3.22Å; R374-I378 HydrophobicContact CG-CD1 3.97Å; R374-I378 VanDerWaalsContact O-CG1 3.32Å; R374-I378 WeakPolarHBondContact O-CG1 3.24Å; R374-I378 PolarHBondContact O-N 2.87Å
375Q90.3Very high88.7Confident97 Ų9768.2 Ų68.245%0.45336%0.36SS..Hα-helixtrans-63.1-37.8176.3-75.8176.4-3.100112.3T371 T372 F373 I378 R379T371-Q375 WeakPolarHBondContact O-CB 3.36Å; T371-Q375 VanDerWaalsContact O-CG 3.28Å; T371-Q375 WeakPolarHBondContact O-CG 3.45Å; T371-Q375 PolarHBondContact O-N 3.42Å; T372-Q375 PolarHBondContact O-N 3.34Å; F373-Q375 PolarHBondContact O-N 3.16Å; Q375-I378 PolarHBondContact O-N 3.26Å; Q375-R379 WeakPolarHBondContact O-CB 3.43Å; Q375-R379 VanDerWaalsContact O-CG 3.26Å; Q375-R379 WeakPolarHBondContact O-CG 3.39Å; Q375-R379 PolarHBondContact O-N 3.09Å
376T89.9Confident87.9Confident49 Ų4973.4 Ų73.430%0.30138%0.383SS..Hα-helixtrans-66.4-43.1177.5-55.20000110.9I35 T372 F373 R374 R379 S380I35-T376 HydrophobicContact CD1-CG2 4.43Å; I35-T376 HydrophobicContact CG1-CG2 4.24Å; I35-T376 HydrophobicContact CG2-CG2 3.98Å; T372-T376 PolarHBondContact O-N 3.08Å; T372-T376 PolarHBondContact O-OG1 2.97Å; F373-T376 WeakPolarHBondContact O-CB 3.32Å; F373-T376 PolarHBondContact O-N 3.44Å; F373-T376 VanDerWaalsContact O-N 3.11Å; R374-T376 VanDerWaalsContact C-N 3.31Å; R374-T376 PolarHBondContact O-N 3.4Å; T376-R379 PolarHBondContact O-N 2.95Å; T376-S380 PolarHBondContact O-N 3.42Å; T376-S380 PolarHBondContact O-OG 3.12Å; T376-S380 VanDerWaalsContact O-OG 3.11Å
377I92.1Very high87.1Confident30 Ų3080.7 Ų80.715%0.15441%0.41CS..Hα-helixtrans-59.2-50.3174.2-68.6175.5000111.1I35 F363 F373 R374 R379 S380 L381I35-I377 HydrophobicContact CD1-CD1 4.27Å; I35-I377 HydrophobicContact CD1-CG1 3.57Å; F363-I377 HydrophobicContact CE2-CD1 3.66Å; F363-I377 HydrophobicContact CZ-CD1 3.82Å; F373-I377 HydrophobicContact CD1-CD1 3.68Å; F373-I377 HydrophobicContact CD1-CG1 4.49Å; F373-I377 HydrophobicContact CE1-CD1 3.28Å; F373-I377 HydrophobicContact CE1-CG1 4.3Å; F373-I377 HydrophobicContact CZ-CD1 3.97Å; F373-I377 PolarHBondContact O-N 2.98Å; R374-I377 PolarHBondContact O-N 3.22Å; I377-R379 VanDerWaalsContact C-N 3.27Å; I377-R379 PolarHBondContact O-N 3.44Å; I377-S380 PolarHBondContact O-N 3.26Å; I377-S380 VanDerWaalsContact O-N 3.15Å; I377-L381 HydrophobicContact CG2-CD1 3.71Å; I377-L381 HydrophobicContact CG2-CG 4.2Å; I377-L381 WeakPolarHBondContact O-CB 3.31Å; I377-L381 WeakPolarHBondContact O-CG 3.48Å; I377-L381 PolarHBondContact O-N 3.18Å
378I91.4Very high86.3Confident102 Ų10286.8 Ų86.852%0.52343%0.434SS..Hα-helixtrans-59.1-41.4-179.3-68.1166.8000110.8R374 Q375 L381 S382R374-I378 HydrophobicContact CG-CD1 3.97Å; R374-I378 VanDerWaalsContact O-CG1 3.32Å; R374-I378 WeakPolarHBondContact O-CG1 3.24Å; R374-I378 PolarHBondContact O-N 2.87Å; Q375-I378 PolarHBondContact O-N 3.26Å; I378-L381 PolarHBondContact O-N 3.41Å; I378-S382 WeakPolarHBondContact O-CB 3.11Å; I378-S382 PolarHBondContact O-N 3.36Å; I378-S382 PolarHBondContact O-OG 3.18Å
379R91Very high85.7Confident162 Ų16283.7 Ų83.761%0.61142%0.421SS*.Hα-helixtrans-65.3-41.9175.9-73.5173.3-176.2161.61.6112.6Q375 T376 I377 S382 H383Q375-R379 WeakPolarHBondContact O-CB 3.43Å; Q375-R379 VanDerWaalsContact O-CG 3.26Å; Q375-R379 WeakPolarHBondContact O-CG 3.39Å; Q375-R379 PolarHBondContact O-N 3.09Å; T376-R379 PolarHBondContact O-N 2.95Å; I377-R379 VanDerWaalsContact C-N 3.27Å; I377-R379 PolarHBondContact O-N 3.44Å; R379-S382 PolarHBondContact O-N 3.02Å; R379-S382 PolarHBondContact O-OG 2.59Å; R379-H383 WeakPolarHBondContact O-CB 3.44Å; R379-H383 PolarHBondContact O-N 2.85Å
380S89.5Confident85.1Confident64 Ų6486.2 Ų86.245%0.44843%0.434SS..Hα-helixtrans-65.2-43.1177-63.60000111.6T376 I377 H383 L384T376-S380 PolarHBondContact O-N 3.42Å; T376-S380 PolarHBondContact O-OG 3.12Å; T376-S380 VanDerWaalsContact O-OG 3.11Å; I377-S380 PolarHBondContact O-N 3.26Å; I377-S380 VanDerWaalsContact O-N 3.15Å; S380-H383 PolarHBondContact O-N 3.3Å; S380-L384 VanDerWaalsContact O-CG 3.3Å; S380-L384 WeakPolarHBondContact O-CG 3.18Å; S380-L384 PolarHBondContact O-N 3.28Å
381L88.9Confident84.5Confident100 Ų10087.7 Ų87.752%0.52444%0.444SS..Hα-helixtrans-66.6-41.5176.4-68.7175.5000111.9I377 I378 H383 L384 C385I377-L381 HydrophobicContact CG2-CD1 3.71Å; I377-L381 HydrophobicContact CG2-CG 4.2Å; I377-L381 WeakPolarHBondContact O-CB 3.31Å; I377-L381 WeakPolarHBondContact O-CG 3.48Å; I377-L381 PolarHBondContact O-N 3.18Å; I378-L381 PolarHBondContact O-N 3.41Å; L381-H383 VanDerWaalsContact C-N 3.34Å; L381-H383 PolarHBondContact O-N 3.36Å; L381-L384 HydrophobicContact CD2-CD1 4.48Å; L381-L384 PolarHBondContact O-N 3.39Å; L381-C385 PolarHBondContact O-N 3.23Å; L381-C385 PolarHBondContact O-SG 3.23Å
382S87.8Confident84Confident68 Ų6889.7 Ų89.748%0.47645%0.448SS..Hα-helixtrans-66.4-37.3177.171.90000112I378 R379 C385 H386I378-S382 WeakPolarHBondContact O-CB 3.11Å; I378-S382 PolarHBondContact O-N 3.36Å; I378-S382 PolarHBondContact O-OG 3.18Å; R379-S382 PolarHBondContact O-N 3.02Å; R379-S382 PolarHBondContact O-OG 2.59Å; S382-C385 PolarHBondContact O-N 3.28Å; S382-H386 WeakPolarHBondContact O-CB 3.4Å; S382-H386 PolarHBondContact O-N 3.03Å
383H82.9Confident83.5Confident133 Ų13393.2 Ų93.262%0.61646%0.458SS*.Hα-helixtrans-65.4-39.8173.6-170.3-88.8000111.7R379 S380 L381 H386 W387R379-H383 WeakPolarHBondContact O-CB 3.44Å; R379-H383 PolarHBondContact O-N 2.85Å; S380-H383 PolarHBondContact O-N 3.3Å; L381-H383 VanDerWaalsContact C-N 3.34Å; L381-H383 PolarHBondContact O-N 3.36Å; H383-H386 PolarHBondContact O-N 3.24Å; H383-W387 WeakPolarHBondContact O-CB 3.37Å; H383-W387 PolarHBondContact O-N 3.19Å
384L83.5Confident82.7Confident101 Ų101101.8 Ų101.853%0.52949%0.49SS..Hα-helixtrans-63.4-41.7173.5-73165.6000111.9S380 L381 K388S380-L384 VanDerWaalsContact O-CG 3.3Å; S380-L384 WeakPolarHBondContact O-CG 3.18Å; S380-L384 PolarHBondContact O-N 3.28Å; L381-L384 HydrophobicContact CD2-CD1 4.48Å; L381-L384 PolarHBondContact O-N 3.39Å; L384-K388 WeakPolarHBondContact O-CB 3.38Å; L384-K388 PolarHBondContact O-N 2.84Å
385C80.3Confident81.9Confident83 Ų83103.6 Ų103.656%0.56150%0.501SS*.Hα-helixtrans-64-47174.9-710000111.8L381 S382 W387 K388 T389L381-C385 PolarHBondContact O-N 3.23Å; L381-C385 PolarHBondContact O-SG 3.23Å; S382-C385 PolarHBondContact O-N 3.28Å; C385-W387 VanDerWaalsContact C-N 3.34Å; C385-W387 PolarHBondContact O-N 2.75Å; C385-K388 PolarHBondContact O-N 2.94Å; C385-T389 WeakPolarHBondContact O-CG2 3.32Å; C385-T389 PolarHBondContact O-N 3.37Å; C385-T389 PolarHBondContact O-OG1 3.43Å
386H76.3Confident81.1Confident113 Ų113103.8 Ų103.852%0.52350%0.502SS..Hα-helixtrans-68.3-34179.5-164-73.3000112.2S382 H383 T389 N390S382-H386 WeakPolarHBondContact O-CB 3.4Å; S382-H386 PolarHBondContact O-N 3.03Å; H383-H386 PolarHBondContact O-N 3.24Å; H386-T389 WeakPolarHBondContact CA-OG1 3.35Å; H386-T389 PolarHBondContact O-OG1 2.95Å; H386-N390 PolarHBondContact CE1-ND2 3.41Å; H386-N390 PolarHBondContact ND1-ND2 2.95Å; H386-N390 VanDerWaalsContact O-CB 3.27Å; H386-N390 WeakPolarHBondContact O-CB 3.12Å; H386-N390 VanDerWaalsContact O-CG 3.3Å; H386-N390 PolarHBondContact O-N 3.34Å
387W75.2Confident80.6Confident159 Ų159106.6 Ų106.660%0.60252%0.516SS*.Hα-helixtrans-66-43.5172.7-177.375000110.7H383 C385 T389 N390 C391H383-W387 WeakPolarHBondContact O-CB 3.37Å; H383-W387 PolarHBondContact O-N 3.19Å; C385-W387 VanDerWaalsContact C-N 3.34Å; C385-W387 PolarHBondContact O-N 2.75Å; W387-T389 PolarHBondContact O-N 3.07Å; W387-N390 PolarHBondContact O-N 2.88Å; W387-C391 VanDerWaalsContact O-CB 3.3Å; W387-C391 WeakPolarHBondContact O-CB 3.4Å; W387-C391 PolarHBondContact O-N 3.48Å; W387-C391 PolarHBondContact O-SG 2.97Å
388K75Confident80Confident155 Ų155109.6 Ų109.667%0.67453%0.532SS*.Hα-helixtrans-62.4-43.7176.4-167.8176.3-179-178.50112.1L384 C385 C391 H392L384-K388 WeakPolarHBondContact O-CB 3.38Å; L384-K388 PolarHBondContact O-N 2.84Å; C385-K388 PolarHBondContact O-N 2.94Å; K388-C391 PolarHBondContact O-N 2.89Å; K388-H392 WeakPolarHBondContact O-CB 3.47Å; K388-H392 PolarHBondContact O-N 3.48Å
389T76.6Confident79.4Confident75 Ų75110.4 Ų110.446%0.4653%0.533SS..Hα-helixtrans-66.4-41.8176.855.90000112C385 H386 W387 H392 K393C385-T389 WeakPolarHBondContact O-CG2 3.32Å; C385-T389 PolarHBondContact O-N 3.37Å; C385-T389 PolarHBondContact O-OG1 3.43Å; H386-T389 WeakPolarHBondContact CA-OG1 3.35Å; H386-T389 PolarHBondContact O-OG1 2.95Å; W387-T389 PolarHBondContact O-N 3.07Å; T389-H392 PolarHBondContact O-N 3.39Å; T389-K393 WeakPolarHBondContact O-CG 2.99Å; T389-K393 PolarHBondContact O-N 2.65Å
390N77Confident78.8Confident67 Ų67106.6 Ų106.636%0.35853%0.528SS..Hα-helixtrans-66.7-39175.9-79.7-8.9000112.9H386 W387 H392 K393 R394H386-N390 PolarHBondContact CE1-ND2 3.41Å; H386-N390 PolarHBondContact ND1-ND2 2.95Å; H386-N390 VanDerWaalsContact O-CB 3.27Å; H386-N390 WeakPolarHBondContact O-CB 3.12Å; H386-N390 VanDerWaalsContact O-CG 3.3Å; H386-N390 PolarHBondContact O-N 3.34Å; W387-N390 PolarHBondContact O-N 2.88Å; N390-H392 VanDerWaalsContact C-N 3.34Å; N390-K393 PolarHBondContact O-N 2.73Å; N390-R394 WeakPolarHBondContact O-CB 3.44Å; N390-R394 WeakPolarHBondContact O-CG 3.27Å; N390-R394 PolarHBondContact O-N 2.87Å
391C73.8Confident78.2Confident43 Ų43111.6 Ų111.629%0.29154%0.537SS..Hα-helixtrans-63.7-40.2174-81.80000111.5W387 K388 R394 K395W387-C391 VanDerWaalsContact O-CB 3.3Å; W387-C391 WeakPolarHBondContact O-CB 3.4Å; W387-C391 PolarHBondContact O-N 3.48Å; W387-C391 PolarHBondContact O-SG 2.97Å; K388-C391 PolarHBondContact O-N 2.89Å; C391-R394 PolarHBondContact O-N 3.45Å; C391-K395 PolarHBondContact O-N 3.49Å
392H75.3Confident77.7Confident115 Ų115111.2 Ų111.253%0.53254%0.536SS..Hα-helixtrans-65.7-42.3176.3-151.6-58.9000112.1K388 T389 N390 K395 Q396K388-H392 WeakPolarHBondContact O-CB 3.47Å; K388-H392 PolarHBondContact O-N 3.48Å; T389-H392 PolarHBondContact O-N 3.39Å; N390-H392 VanDerWaalsContact C-N 3.34Å; H392-K395 PolarHBondContact O-N 2.6Å; H392-Q396 PolarHBondContact O-N 2.74Å; H392-Q396 VanDerWaalsContact O-N 3.07Å
393K74.7Confident77.3Confident131 Ų131112.8 Ų112.857%0.5754%0.539SS*.Hα-helixtrans-61.9-41172.4-75.3-177.3178.2-177.40112.1T389 N390 Q396 N397T389-K393 WeakPolarHBondContact O-CG 2.99Å; T389-K393 PolarHBondContact O-N 2.65Å; N390-K393 PolarHBondContact O-N 2.73Å; K393-Q396 PolarHBondContact O-N 3.29Å; K393-N397 WeakPolarHBondContact O-CB 3.36Å; K393-N397 PolarHBondContact O-N 3.49Å; K393-N397 PolarHBondContact O-OD1 3.02Å
394R72.8Confident77.1Confident182 Ų182110.7 Ų110.769%0.68753%0.532SS*.Hα-helixtrans-62.6-40.8175.6-80.6-177.8177.2-177.1-1112.2N390 C391 N397 N398N390-R394 WeakPolarHBondContact O-CB 3.44Å; N390-R394 WeakPolarHBondContact O-CG 3.27Å; N390-R394 PolarHBondContact O-N 2.87Å; C391-R394 PolarHBondContact O-N 3.45Å; R394-N397 PolarHBondContact O-N 2.96Å; R394-N398 WeakPolarHBondContact O-CB 3.24Å; R394-N398 PolarHBondContact O-N 3.5Å; R394-N398 PolarHBondContact O-OD1 3.45Å
395K75Confident76.8Confident147 Ų147109.5 Ų109.564%0.63953%0.526SS*.Hα-helixtrans-62.9-48.4175.1-78.9-169.5174.9-170.20112.2C391 H392 N397 N398 E399C391-K395 PolarHBondContact O-N 3.49Å; H392-K395 PolarHBondContact O-N 2.6Å; K395-N397 VanDerWaalsContact C-N 3.33Å; K395-N397 PolarHBondContact O-N 3.29Å; K395-N398 PolarHBondContact O-N 3.33Å; K395-N398 VanDerWaalsContact O-N 3.14Å; K395-E399 PolarHBondContact O-N 3.47Å
396Q75.3Confident76.5Confident100 Ų100110 Ų11047%0.46752%0.523SS..Hα-helixtrans-60.4-42.3176.1-77.2178.4-15.100112.2H392 K393 N398 E399 V400H392-Q396 PolarHBondContact O-N 2.74Å; H392-Q396 VanDerWaalsContact O-N 3.07Å; K393-Q396 PolarHBondContact O-N 3.29Å; Q396-N398 VanDerWaalsContact C-N 3.29Å; Q396-N398 PolarHBondContact O-N 2.99Å; Q396-E399 PolarHBondContact O-N 3.44Å; Q396-V400 VanDerWaalsContact O-CG2 3.29Å; Q396-V400 WeakPolarHBondContact O-CG2 3.26Å; Q396-V400 PolarHBondContact O-N 2.67Å
397N78.1Confident76.4Confident109 Ų109109 Ų10958%0.58352%0.522SS*.Hα-helixtrans-63.6-36176.5-72.6-1.4000112.2K393 R394 K395 R401K393-N397 WeakPolarHBondContact O-CB 3.36Å; K393-N397 PolarHBondContact O-N 3.49Å; K393-N397 PolarHBondContact O-OD1 3.02Å; R394-N397 PolarHBondContact O-N 2.96Å; K395-N397 VanDerWaalsContact C-N 3.33Å; K395-N397 PolarHBondContact O-N 3.29Å; N397-R401 VanDerWaalsContact O-CB 3.29Å; N397-R401 WeakPolarHBondContact O-CB 3.5Å; N397-R401 PolarHBondContact O-N 2.63Å
398N79.2Confident76.4Confident92 Ų92106.3 Ų106.349%0.49252%0.519SS..Hα-helixtrans-69.1-44.6174.9-71.3-7.8000111.4R394 K395 Q396 V400 R401 D402R394-N398 WeakPolarHBondContact O-CB 3.24Å; R394-N398 PolarHBondContact O-N 3.5Å; R394-N398 PolarHBondContact O-OD1 3.45Å; K395-N398 PolarHBondContact O-N 3.33Å; K395-N398 VanDerWaalsContact O-N 3.14Å; Q396-N398 VanDerWaalsContact C-N 3.29Å; Q396-N398 PolarHBondContact O-N 2.99Å; N398-V400 PolarHBondContact O-N 2.67Å; N398-R401 WeakPolarHBondContact O-CB 3.25Å; N398-R401 PolarHBondContact O-N 3.39Å; N398-R401 VanDerWaalsContact O-N 3.15Å; N398-D402 VanDerWaalsContact O-CG 3.31Å; N398-D402 PolarHBondContact O-N 2.65Å
399E78.7Confident76.2Confident119 Ų119104.4 Ų104.456%0.55652%0.516SS*.Hα-helixtrans-61.1-42.3175.8-74.6171.3-174.600112.3K395 Q396 R401 D402 N403K395-E399 PolarHBondContact O-N 3.47Å; Q396-E399 PolarHBondContact O-N 3.44Å; E399-R401 VanDerWaalsContact C-N 3.34Å; E399-D402 PolarHBondContact O-N 2.92Å; E399-N403 WeakPolarHBondContact O-CB 3.31Å; E399-N403 PolarHBondContact O-N 3.38Å
400V79.6Confident76Confident83 Ų83104.5 Ų104.550%0.50351%0.514SS..Hα-helixtrans-63.9-40.3174.4172.50000111Q396 N398 N403 N404Q396-V400 VanDerWaalsContact O-CG2 3.29Å; Q396-V400 WeakPolarHBondContact O-CG2 3.26Å; Q396-V400 PolarHBondContact O-N 2.67Å; N398-V400 PolarHBondContact O-N 2.67Å; V400-N403 PolarHBondContact O-N 3.45Å; V400-N404 WeakPolarHBondContact O-CB 3.41Å; V400-N404 PolarHBondContact O-N 3.39Å
401R76.6Confident75.6Confident168 Ų168105.7 Ų105.763%0.63452%0.521SS*.Hα-helixtrans-64.4-41.8176.4-174.6179178.6-178.5-2111.8N397 N398 E399 N404 N405N397-R401 VanDerWaalsContact O-CB 3.29Å; N397-R401 WeakPolarHBondContact O-CB 3.5Å; N397-R401 PolarHBondContact O-N 2.63Å; N398-R401 WeakPolarHBondContact O-CB 3.25Å; N398-R401 PolarHBondContact O-N 3.39Å; N398-R401 VanDerWaalsContact O-N 3.15Å; E399-R401 VanDerWaalsContact C-N 3.34Å; R401-N404 PolarHBondContact O-N 2.88Å; R401-N405 WeakPolarHBondContact O-CB 3.5Å; R401-N405 PolarHBondContact O-N 3.45Å
402D77.2Confident75.4Confident93 Ų93105.5 Ų105.550%0.49753%0.526SS..Hα-helixtrans-68.3-40.4178.3-68.3-23.9000111.5N398 E399 N405 N406N398-D402 VanDerWaalsContact O-CG 3.31Å; N398-D402 PolarHBondContact O-N 2.65Å; E399-D402 PolarHBondContact O-N 2.92Å; D402-N405 PolarHBondContact O-N 2.97Å; D402-N406 PolarHBondContact O-N 3.32Å
403N79.4Confident74.9Confident100 Ų100107.3 Ų107.354%0.53553%0.532SS..Hα-helixtrans-63.3-42.3172.7-78.5-18.8000112.4E399 V400 N406 N407E399-N403 WeakPolarHBondContact O-CB 3.31Å; E399-N403 PolarHBondContact O-N 3.38Å; V400-N403 PolarHBondContact O-N 3.45Å; N403-N406 PolarHBondContact O-N 2.97Å; N403-N407 PolarHBondContact O-N 3.3Å
404N80.2Confident74.4Confident89 Ų89108.9 Ų108.948%0.47654%0.536SS..Hα-helixtrans-65.2-39175.8-78.4-14.1000112.1V400 R401 N407 N408V400-N404 WeakPolarHBondContact O-CB 3.41Å; V400-N404 PolarHBondContact O-N 3.39Å; R401-N404 PolarHBondContact O-N 2.88Å; N404-N407 PolarHBondContact O-N 2.88Å; N404-N408 WeakPolarHBondContact O-CB 3.19Å; N404-N408 PolarHBondContact O-N 2.94Å
405N76Confident74.3Confident77 Ų77107.1 Ų107.141%0.41253%0.533SS..Hα-helixtrans-63.5-42.4174.2-77.6-16.2000111.7R401 D402 N408 N409R401-N405 WeakPolarHBondContact O-CB 3.5Å; R401-N405 PolarHBondContact O-N 3.45Å; D402-N405 PolarHBondContact O-N 2.97Å; N405-N408 PolarHBondContact O-N 3.34Å; N405-N409 PolarHBondContact O-N 3.3Å
406N74Confident74Confident93 Ų93102.9 Ų102.950%0.49753%0.525SS..Hα-helixtrans-63.3-43.2174.9-78.4-19.6000112.3D402 N403 N409 N410D402-N406 PolarHBondContact O-N 3.32Å; N403-N406 PolarHBondContact O-N 2.97Å; N406-N409 PolarHBondContact O-N 3.43Å; N406-N410 PolarHBondContact O-N 2.91Å
407N75.6Confident73.8Confident91 Ų91101.9 Ų101.949%0.48753%0.526SS..Hα-helixtrans-64.7-40.6175.7-79-14.9000112.4N403 N404 N410 N411N403-N407 PolarHBondContact O-N 3.3Å; N404-N407 PolarHBondContact O-N 2.88Å; N407-N410 PolarHBondContact O-N 3.04Å; N407-N411 WeakPolarHBondContact O-CB 3.34Å; N407-N411 PolarHBondContact O-N 3.01Å
408N74.5Confident73.4Confident104 Ų104101.2 Ų101.256%0.55652%0.522SS*.Hα-helixtrans-65-39.6175.5-78.4-17.8000112.1N404 N405 N410 N411 G412N404-N408 WeakPolarHBondContact O-CB 3.19Å; N404-N408 PolarHBondContact O-N 2.94Å; N405-N408 PolarHBondContact O-N 3.34Å; N408-N410 VanDerWaalsContact C-N 3.34Å; N408-N411 PolarHBondContact O-N 3.06Å; N408-G412 PolarHBondContact O-N 3.07Å
409N70Confident73.1Confident114 Ų114103.5 Ų103.561%0.6153%0.53SS*.Hα-helixtrans-63.2-39.8173.3-80.5-13.6000112N405 N406 G412 K413N405-N409 PolarHBondContact O-N 3.3Å; N406-N409 PolarHBondContact O-N 3.43Å; N409-G412 PolarHBondContact O-N 2.53Å; N409-K413 PolarHBondContact O-N 3Å
410N72.2Confident72.8Confident78 Ų78105.1 Ų105.142%0.41754%0.535SS..Hα-helixtrans-66.7-44.9174.9-72.6-19.5000111.8N406 N407 N408 G412 K413 Y414N406-N410 PolarHBondContact O-N 2.91Å; N407-N410 PolarHBondContact O-N 3.04Å; N408-N410 VanDerWaalsContact C-N 3.34Å; N410-G412 VanDerWaalsContact C-N 3.31Å; N410-G412 PolarHBondContact O-N 2.8Å; N410-K413 WeakPolarHBondContact O-CB 3.25Å; N410-K413 PolarHBondContact O-N 3.36Å; N410-K413 VanDerWaalsContact O-N 3.13Å; N410-Y414 WeakPolarHBondContact O-CD2 3.37Å; N410-Y414 PolarHBondContact O-N 3.38Å
411N70.3Confident72.5Confident92 Ų92106 Ų10649%0.49254%0.536SS..Hα-helixtrans-64-35.6175.6-75.4-10000112.4N407 N408 K413 Y414 K415N407-N411 WeakPolarHBondContact O-CB 3.34Å; N407-N411 PolarHBondContact O-N 3.01Å; N408-N411 PolarHBondContact O-N 3.06Å; N411-K413 VanDerWaalsContact C-N 3.35Å; N411-Y414 PolarHBondContact O-N 3.43Å; N411-K415 PolarHBondContact O-N 2.97Å
412G68.9Low72.3Confident39 Ų39107 Ų10740%0.40254%0.54SS..Hα-helixtrans-61.3-41.6171.300000112.1N408 N409 N410 K415 A416N408-G412 PolarHBondContact O-N 3.07Å; N409-G412 PolarHBondContact O-N 2.53Å; N410-G412 VanDerWaalsContact C-N 3.31Å; N410-G412 PolarHBondContact O-N 2.8Å; G412-K415 PolarHBondContact O-N 2.84Å; G412-A416 WeakPolarHBondContact O-CB 3.24Å; G412-A416 PolarHBondContact O-N 3.33Å
413K64.1Low72.2Confident153 Ų153104 Ų10467%0.66553%0.531SS*.Hα-helixtrans-60.6-45.3171.6-87.6-178177.3176.50112.2N409 N410 N411 A416 V417N409-K413 PolarHBondContact O-N 3Å; N410-K413 WeakPolarHBondContact O-CB 3.25Å; N410-K413 PolarHBondContact O-N 3.36Å; N410-K413 VanDerWaalsContact O-N 3.13Å; N411-K413 VanDerWaalsContact C-N 3.35Å; K413-A416 PolarHBondContact O-N 3.12Å; K413-V417 WeakPolarHBondContact O-CG2 3.35Å; K413-V417 PolarHBondContact O-N 3.2Å; K413-V417 VanDerWaalsContact O-N 3.16Å
414Y64.4Low71.9Confident163 Ų163103.7 Ų103.764%0.63953%0.529SS*.Hα-helixtrans-66.2-42.3178.3-70.2-68.5000112.6N410 N411 A416 V417 D418N410-Y414 WeakPolarHBondContact O-CD2 3.37Å; N410-Y414 PolarHBondContact O-N 3.38Å; N411-Y414 PolarHBondContact O-N 3.43Å; Y414-A416 VanDerWaalsContact C-N 3.33Å; Y414-A416 PolarHBondContact O-N 3Å; Y414-V417 WeakPolarHBondContact O-CB 3.31Å; Y414-V417 PolarHBondContact O-N 3Å; Y414-V417 VanDerWaalsContact O-N 3.1Å; Y414-D418 PolarHBondContact O-N 2.55Å
415K70Confident71.5Confident145 Ų145104 Ų10463%0.6353%0.53SS*.Hα-helixtrans-60.6-40.4174.7-80.4-172.3176.8-176.50112.6N411 G412 V417 D418 E419N411-K415 PolarHBondContact O-N 2.97Å; G412-K415 PolarHBondContact O-N 2.84Å; K415-V417 VanDerWaalsContact C-N 3.27Å; K415-V417 PolarHBondContact O-N 3.31Å; K415-D418 PolarHBondContact O-N 2.89Å; K415-E419 WeakPolarHBondContact O-CB 3.4Å; K415-E419 WeakPolarHBondContact O-CG 3.47Å; K415-E419 PolarHBondContact O-N 2.64Å
416A69.4Low71.4Confident58 Ų58103.2 Ų103.248%0.47953%0.531SS..Hα-helixtrans-64.1-33.3175.500000112.3G412 K413 Y414 K420G412-A416 WeakPolarHBondContact O-CB 3.24Å; G412-A416 PolarHBondContact O-N 3.33Å; K413-A416 PolarHBondContact O-N 3.12Å; Y414-A416 VanDerWaalsContact C-N 3.33Å; Y414-A416 PolarHBondContact O-N 3Å; A416-K420 VanDerWaalsContact O-CB 3.31Å; A416-K420 WeakPolarHBondContact O-CB 3.33Å; A416-K420 PolarHBondContact O-N 3.04Å; A416-K420 VanDerWaalsContact O-N 3.12Å
417V70.3Confident71.1Confident79 Ų79104 Ų10448%0.47954%0.535SS..Hα-helixtrans-69.7-45.2172.9174.90000110.9K413 Y414 K415 K420 I421K413-V417 WeakPolarHBondContact O-CG2 3.35Å; K413-V417 PolarHBondContact O-N 3.2Å; K413-V417 VanDerWaalsContact O-N 3.16Å; Y414-V417 WeakPolarHBondContact O-CB 3.31Å; Y414-V417 PolarHBondContact O-N 3Å; Y414-V417 VanDerWaalsContact O-N 3.1Å; K415-V417 VanDerWaalsContact C-N 3.27Å; K415-V417 PolarHBondContact O-N 3.31Å; V417-K420 WeakPolarHBondContact O-CB 3.49Å; V417-K420 PolarHBondContact O-N 3.03Å; V417-I421 HydrophobicContact CG1-CD1 3.91Å; V417-I421 VanDerWaalsContact O-CG1 3.3Å; V417-I421 WeakPolarHBondContact O-CG1 3.35Å; V417-I421 PolarHBondContact O-N 3.3Å
418D70.6Confident70.7Confident96 Ų96105.4 Ų105.451%0.51354%0.54SS..Hα-helixtrans-64.4-39.8177.8-83-18.4000112.9Y414 K415 K420 I421 R422Y414-D418 PolarHBondContact O-N 2.55Å; K415-D418 PolarHBondContact O-N 2.89Å; D418-K420 VanDerWaalsContact C-N 3.33Å; D418-I421 PolarHBondContact O-N 3.43Å; D418-R422 WeakPolarHBondContact O-CB 3.32Å; D418-R422 PolarHBondContact O-N 2.81Å
419E73.6Confident70.6Confident140 Ų140107.1 Ų107.165%0.65454%0.542SS*.Hα-helixtrans-65.9-37.5174.1-77.4-178.5178.900111.4K415 R422 G423K415-E419 WeakPolarHBondContact O-CB 3.4Å; K415-E419 WeakPolarHBondContact O-CG 3.47Å; K415-E419 PolarHBondContact O-N 2.64Å; E419-R422 PolarHBondContact O-N 2.74Å; E419-G423 PolarHBondContact O-N 3.28Å
420K72.4Confident70.3Confident153 Ų153108.4 Ų108.467%0.66554%0.543SS*.Hα-helixtrans-64.9-40173.6-165.7173.3-175.3179.20111.6A416 V417 D418 N424A416-K420 VanDerWaalsContact O-CB 3.31Å; A416-K420 WeakPolarHBondContact O-CB 3.33Å; A416-K420 PolarHBondContact O-N 3.04Å; A416-K420 VanDerWaalsContact O-N 3.12Å; V417-K420 WeakPolarHBondContact O-CB 3.49Å; V417-K420 PolarHBondContact O-N 3.03Å; D418-K420 VanDerWaalsContact C-N 3.33Å; K420-N424 VanDerWaalsContact O-CG 3.31Å; K420-N424 PolarHBondContact O-N 3.48Å; K420-N424 VanDerWaalsContact O-N 3.09Å
421I73.6Confident69.7Low101 Ų101111.5 Ų111.552%0.51856%0.555SS.*Hα-helixtrans-65.4-45.3173.9-67.4166.1000110.6V417 D418 N424 L425V417-I421 HydrophobicContact CG1-CD1 3.91Å; V417-I421 VanDerWaalsContact O-CG1 3.3Å; V417-I421 WeakPolarHBondContact O-CG1 3.35Å; V417-I421 PolarHBondContact O-N 3.3Å; D418-I421 PolarHBondContact O-N 3.43Å; I421-N424 PolarHBondContact O-N 3.2Å; I421-L425 WeakPolarHBondContact O-CB 3.34Å; I421-L425 PolarHBondContact O-N 3.06Å
422R72.1Confident69.3Low188 Ų188112.6 Ų112.671%0.70956%0.56SS**Hα-helixtrans-66.3-38.4179.5-165.8-176.6-61.3-164.80.8112.2D418 E419 L425 S426D418-R422 WeakPolarHBondContact O-CB 3.32Å; D418-R422 PolarHBondContact O-N 2.81Å; E419-R422 PolarHBondContact O-N 2.74Å; R422-L425 PolarHBondContact O-N 3.39Å; R422-S426 WeakPolarHBondContact O-CB 3.47Å; R422-S426 PolarHBondContact O-N 3.22Å; R422-S426 PolarHBondContact O-OG 3.27Å
423G74.3Confident68.8Low30 Ų30118.4 Ų118.431%0.30958%0.577SS.*Hα-helixtrans-59.5-49.717300000111.4E419 L425 S426 L427E419-G423 PolarHBondContact O-N 3.28Å; G423-L425 VanDerWaalsContact C-N 3.34Å; G423-L425 PolarHBondContact O-N 3.34Å; G423-S426 PolarHBondContact O-N 2.96Å; G423-S426 PolarHBondContact O-OG 3.05Å; G423-L427 PolarHBondContact O-N 3.12Å
424N73.4Confident68.3Low94 Ų94121.2 Ų121.250%0.50359%0.585SS.*Hα-helixtrans-60-42.1174.8-73-7.2000112.1K420 I421 S426 L427 M428K420-N424 VanDerWaalsContact O-CG 3.31Å; K420-N424 PolarHBondContact O-N 3.48Å; K420-N424 VanDerWaalsContact O-N 3.09Å; I421-N424 PolarHBondContact O-N 3.2Å; N424-S426 VanDerWaalsContact C-N 3.34Å; N424-S426 PolarHBondContact O-N 3.42Å; N424-L427 WeakPolarHBondContact O-CB 3.43Å; N424-L427 PolarHBondContact O-N 2.78Å; N424-M428 WeakPolarHBondContact O-CG 3.35Å; N424-M428 PolarHBondContact O-N 2.92Å
425L73.1Confident67.7Low95 Ų95121.8 Ų121.850%0.49761%0.606SS.*Hα-helixtrans-66.3-34.9178-162.573.6000112.4I421 R422 G423 M428 K429I421-L425 WeakPolarHBondContact O-CB 3.34Å; I421-L425 PolarHBondContact O-N 3.06Å; R422-L425 PolarHBondContact O-N 3.39Å; G423-L425 VanDerWaalsContact C-N 3.34Å; G423-L425 PolarHBondContact O-N 3.34Å; L425-M428 PolarHBondContact O-N 3.43Å; L425-K429 WeakPolarHBondContact O-CG 3.04Å; L425-K429 PolarHBondContact O-N 3Å
426S73Confident67.6Low62 Ų62120.7 Ų120.743%0.43460%0.604SS.*Hα-helixtrans-72.5-31.5176.1720000113.1R422 G423 N424 K430R422-S426 WeakPolarHBondContact O-CB 3.47Å; R422-S426 PolarHBondContact O-N 3.22Å; R422-S426 PolarHBondContact O-OG 3.27Å; G423-S426 PolarHBondContact O-N 2.96Å; G423-S426 PolarHBondContact O-OG 3.05Å; N424-S426 VanDerWaalsContact C-N 3.34Å; N424-S426 PolarHBondContact O-N 3.42Å; S426-K430 PolarHBondContact O-N 2.96Å
427L68Low67.5Low110 Ų110123.9 Ų123.958%0.57661%0.611SS**Hα-helixtrans-65.7-43.1170.8-86.2158.8000110.9G423 N424 K430 Q431G423-L427 PolarHBondContact O-N 3.12Å; N424-L427 WeakPolarHBondContact O-CB 3.43Å; N424-L427 PolarHBondContact O-N 2.78Å; L427-K430 PolarHBondContact O-N 3.36Å; L427-Q431 PolarHBondContact O-N 3.17Å; L427-Q431 VanDerWaalsContact O-N 3.1Å
428M65.8Low67.3Low119 Ų119126.4 Ų126.459%0.58662%0.618SS**Hα-helixtrans-61.2-47.4174.4-66.7179.210700111.4N424 L425 K430 Q431 D432N424-M428 WeakPolarHBondContact O-CG 3.35Å; N424-M428 PolarHBondContact O-N 2.92Å; L425-M428 PolarHBondContact O-N 3.43Å; M428-K430 VanDerWaalsContact C-N 3.25Å; M428-K430 PolarHBondContact O-N 2.77Å; M428-Q431 PolarHBondContact O-N 3.33Å; M428-Q431 VanDerWaalsContact O-N 3.08Å; M428-D432 PolarHBondContact O-N 3.24Å
429K73.6Confident67.2Low140 Ų140128.2 Ų128.261%0.60963%0.625SS**Hα-helixtrans-62.6-27.4176.8-73.9-175.3178.2-172.20114.3L425L425-K429 WeakPolarHBondContact O-CG 3.04Å; L425-K429 PolarHBondContact O-N 3Å
430K64.2Low66.8Low142 Ų142127.5 Ų127.562%0.61762%0.623SS**Hα-helixtrans-77.5-31.1174.5-85-174.4176.7-177.20112.5S426 L427 M428 D432 Q433 Y434S426-K430 PolarHBondContact O-N 2.96Å; L427-K430 PolarHBondContact O-N 3.36Å; M428-K430 VanDerWaalsContact C-N 3.25Å; M428-K430 PolarHBondContact O-N 2.77Å; K430-D432 VanDerWaalsContact C-N 3.32Å; K430-Q433 PolarHBondContact O-N 2.96Å; K430-Y434 WeakPolarHBondContact O-CD2 2.97Å
431Q59.8Low66.4Low143 Ų143125.8 Ų125.867%0.66862%0.62SS**Hα-helixtrans-67.5-35.4174-85.4173.4-53.800111.6L427 M428 Q433 Y434L427-Q431 PolarHBondContact O-N 3.17Å; L427-Q431 VanDerWaalsContact O-N 3.1Å; M428-Q431 PolarHBondContact O-N 3.33Å; M428-Q431 VanDerWaalsContact O-N 3.08Å; Q431-Q433 PolarHBondContact O-N 2.8Å; Q431-Y434 PolarHBondContact O-N 2.81Å
432D61.8Low65.9Low114 Ų114127.6 Ų127.661%0.6163%0.627SS**THydrogen-bonded Turntrans-68.9-15.2177.3-60.4-25.7000113.9M428 K430M428-D432 PolarHBondContact O-N 3.24Å; K430-D432 VanDerWaalsContact C-N 3.32Å
433Q56.9Low65.4Low161 Ų161122.9 Ų122.975%0.75262%0.621SS**THydrogen-bonded Turntrans-88.4-3.1178.2-93.3-172.7-32.600114.5K430 Q431K430-Q433 PolarHBondContact O-N 2.96Å; Q431-Q433 PolarHBondContact O-N 2.8Å
434Y54.6Low64.6Low213 Ų213130.7 Ų130.784%0.83565%0.647SS**  trans-115.815178.2-74.7-84000113.8K430 Q431K430-Y434 WeakPolarHBondContact O-CD2 2.97Å; Q431-Y434 PolarHBondContact O-N 2.81Å
435T51.6Low63.9Low175 Ų175134 Ų134100%1.07466%0.66SS**  trans-117.60166.744.90000109.1

Retrieved 435 of 435 residues in 164.6 ms (Link to these results)

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