A0A087X670_POEFO Loading...

General transcription factor IIA, 1

AlphaFold DB , UniProt , Accession A0A087X670, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 393 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
1M41.3Very low56.7Low251 Ų25196.7 Ų96.7100%1.23660%0.597SS**  0104.70-80.8176.5165.400108
2A34.6Very low59.4Low96 Ų9698.8 Ų98.879%0.79359%0.591SS**  trans-178.7134.6173.500000105.9
3S37.4Very low61.8Low111 Ų11197.8 Ų97.878%0.77658%0.58SS**  cis-145.893.5-9.5-71.80000109.3A5S3-A5 PolarHBondContact O-N 3.23Å; S3-A5 VanDerWaalsContact O-N 3.16Å
4S44.1Very low64.1Low134 Ų13494.1 Ų94.194%0.93755%0.551SS**THydrogen-bonded Turntrans-84.580.2179.4-54.40000111.2
5A40Very low65.9Low96 Ų9696.9 Ų96.979%0.79355%0.549SS*.THydrogen-bonded Turntrans-171-116700000116.6S3 S7S3-A5 PolarHBondContact O-N 3.23Å; S3-A5 VanDerWaalsContact O-N 3.16Å; A5-S7 VanDerWaalsContact C-N 3.33Å; A5-S7 PolarHBondContact O-N 3.38Å
6N47.8Very low67.7Low138 Ų13892.6 Ų92.674%0.73853%0.533SS*.  trans-81.584.3177.4-141.3-6.3000109.1N8N6-N8 PolarHBondContact O-N 3Å
7S58.8Low69.4Low46 Ų4690.8 Ų90.832%0.32252%0.523SS..  trans-52.8122.6171.767.50000107.6A5 Q9 K12A5-S7 VanDerWaalsContact C-N 3.33Å; A5-S7 PolarHBondContact O-N 3.38Å; S7-Q9 WeakPolarHBondContact O-CG 3.47Å; S7-Q9 PolarHBondContact O-N 3.22Å; S7-K12 PolarHBondContact OG-NZ 3.08Å
8N65.6Low70.8Confident49 Ų4985.9 Ų85.926%0.26250%0.495SS..  trans-58122-170.6-167.4-36.2000109.6N6 V10 P11 F59N6-N8 PolarHBondContact O-N 3Å; N8-V10 VanDerWaalsContact OD1-CB 3.26Å; N8-V10 WeakPolarHBondContact OD1-CB 3.13Å; N8-V10 WeakPolarHBondContact OD1-CG2 3.39Å; N8-V10 PolarHBondContact OD1-N 2.85Å; N8-P11 WeakPolarHBondContact O-CD 3.48Å; N8-P11 WeakPolarHBondContact OD1-CD 3.32Å; N8-F59 HydrophobicContact CB-CB 4.27Å; N8-F59 HydrophobicContact CB-CD1 3.82Å; N8-F59 HydrophobicContact CB-CE1 4.37Å; N8-F59 HydrophobicContact CB-CG 3.95Å; N8-F59 WeakPolarHBondContact ND2-CD1 3.41Å; N8-F59 WeakPolarHBondContact ND2-CE1 3.42Å; N8-F59 WeakPolarHBondContact ND2-CE2 3.27Å; N8-F59 WeakPolarHBondContact ND2-CZ 3.47Å
9Q80.1Confident72.2Confident122 Ų12285.3 Ų85.357%0.5749%0.488SS*.SBendtrans-86.5-17.5-175-56.9-168.929.400112S7 K12 L13S7-Q9 WeakPolarHBondContact O-CG 3.47Å; S7-Q9 PolarHBondContact O-N 3.22Å; Q9-K12 CarbonylContact O-C 3.57Å; Q9-K12 WeakPolarHBondContact O-CA 3.42Å; Q9-K12 WeakPolarHBondContact O-CB 3.38Å; Q9-K12 PolarHBondContact O-N 3.48Å; Q9-L13 WeakPolarHBondContact O-CB 3.49Å; Q9-L13 PolarHBondContact O-N 3.26Å
10V86.9Confident73.5Confident4 Ų486.1 Ų86.12%0.02449%0.49CS..Hα-helixtrans-57.8-46.6-179.6179.80000112.8N8 K12 L13 Y14 D381 V383N8-V10 VanDerWaalsContact OD1-CB 3.26Å; N8-V10 WeakPolarHBondContact OD1-CB 3.13Å; N8-V10 WeakPolarHBondContact OD1-CG2 3.39Å; N8-V10 PolarHBondContact OD1-N 2.85Å; V10-K12 PolarHBondContact O-N 3.13Å; V10-L13 PolarHBondContact O-N 3.47Å; V10-Y14 HydrophobicContact CG1-CD2 3.72Å; V10-Y14 HydrophobicContact CG1-CE2 3.22Å; V10-Y14 WeakPolarHBondContact O-CD2 3.35Å; V10-Y14 PolarHBondContact O-N 3.26Å; V10-D381 HydrophobicContact CG1-CB 3.85Å; V10-V383 HydrophobicContact CG2-CG1 4.17Å; V10-V383 HydrophobicContact CG2-CG2 3.94Å
11P87.5Confident74.6Confident17 Ų1784.7 Ų84.711%0.1148%0.483CS..Hα-helixtrans-57.9-33.8171.9-17.623.8000114N8 R15 V56 F59N8-P11 WeakPolarHBondContact O-CD 3.48Å; N8-P11 WeakPolarHBondContact OD1-CD 3.32Å; P11-R15 WeakPolarHBondContact O-CG 3.45Å; P11-R15 PolarHBondContact O-N 3Å; P11-V56 HydrophobicContact CB-CG1 3.65Å; P11-V56 HydrophobicContact CG-CG1 3.65Å; P11-F59 HydrophobicContact CG-CB 3.92Å; P11-F59 HydrophobicContact CG-CD2 4.15Å; P11-F59 HydrophobicContact CG-CG 4.36Å
12K88.3Confident77.2Confident122 Ų12273 Ų7353%0.5343%0.426SS..Hα-helixtrans-78.3-38.8179.8-64.7174.8-178.3168.70111.2S7 Q9 V10 R15 G16S7-K12 PolarHBondContact OG-NZ 3.08Å; Q9-K12 CarbonylContact O-C 3.57Å; Q9-K12 WeakPolarHBondContact O-CA 3.42Å; Q9-K12 WeakPolarHBondContact O-CB 3.38Å; Q9-K12 PolarHBondContact O-N 3.48Å; V10-K12 PolarHBondContact O-N 3.13Å; K12-R15 PolarHBondContact O-N 3.35Å; K12-G16 PolarHBondContact O-N 3.36Å
13L91.2Very high80.2Confident86 Ų8672.3 Ų72.345%0.4541%0.409SS..Hα-helixtrans-61.9-49.5174.6179.563.6000110.5Q9 V10 R15 G16 V17 V383Q9-L13 WeakPolarHBondContact O-CB 3.49Å; Q9-L13 PolarHBondContact O-N 3.26Å; V10-L13 PolarHBondContact O-N 3.47Å; L13-R15 VanDerWaalsContact C-N 3.33Å; L13-R15 PolarHBondContact O-N 3.39Å; L13-G16 WeakPolarHBondContact O-CA 3.39Å; L13-G16 PolarHBondContact O-N 2.82Å; L13-G16 VanDerWaalsContact O-N 3.09Å; L13-V17 HydrophobicContact CD1-CG2 4.46Å; L13-V17 WeakPolarHBondContact O-CG2 3.47Å; L13-V17 PolarHBondContact O-N 2.98Å; L13-V383 HydrophobicContact CD2-CG1 4.12Å; L13-V383 HydrophobicContact CD2-CG2 4.36Å
14Y93.4Very high83Confident45 Ų4574.3 Ų74.318%0.17641%0.406CS..Hα-helixtrans-60.3-41.7175.8-70.3-42.4000112.3V10 G16 V17 I18 L50 V56 D381V10-Y14 HydrophobicContact CG1-CD2 3.72Å; V10-Y14 HydrophobicContact CG1-CE2 3.22Å; V10-Y14 WeakPolarHBondContact O-CD2 3.35Å; V10-Y14 PolarHBondContact O-N 3.26Å; Y14-G16 VanDerWaalsContact C-N 3.35Å; Y14-G16 PolarHBondContact O-N 2.89Å; Y14-V17 PolarHBondContact O-N 3.49Å; Y14-I18 WeakPolarHBondContact O-CB 3.11Å; Y14-I18 VanDerWaalsContact O-CD1 3.31Å; Y14-I18 WeakPolarHBondContact O-CD1 3.09Å; Y14-I18 WeakPolarHBondContact O-CG1 3.46Å; Y14-I18 PolarHBondContact O-N 3.47Å; Y14-L50 HydrophobicContact CD2-CD1 4.17Å; Y14-L50 HydrophobicContact CD2-CD2 4.07Å; Y14-L50 HydrophobicContact CE2-CD1 4.39Å; Y14-L50 HydrophobicContact CG-CD1 4.47Å; Y14-L50 HydrophobicContact CG-CD2 3.98Å; Y14-V56 HydrophobicContact CD2-CG2 4.25Å; Y14-D381 HydrophobicContact CE2-CB 4.21Å; Y14-D381 WeakPolarHBondContact CE2-OD2 3.49Å; Y14-D381 PolarHBondContact OH-OD2 3.46Å
15R91.5Very high85.6Confident136 Ų13669.8 Ų69.851%0.51337%0.372SS..Hα-helixtrans-59.7-42.5172.1-76.7177.3179.9-85.3-0.5112.7P11 K12 L13 I18 E19P11-R15 WeakPolarHBondContact O-CG 3.45Å; P11-R15 PolarHBondContact O-N 3Å; K12-R15 PolarHBondContact O-N 3.35Å; L13-R15 VanDerWaalsContact C-N 3.33Å; L13-R15 PolarHBondContact O-N 3.39Å; R15-I18 PolarHBondContact O-N 3.09Å; R15-E19 WeakPolarHBondContact O-CG 3.24Å; R15-E19 PolarHBondContact O-N 3.27Å
16G94.7Very high88.2Confident28 Ų2868.3 Ų68.329%0.28935%0.346SS..Hα-helixtrans-57.8-54.7175.200000111.8K12 L13 Y14 I18 E19 D20K12-G16 PolarHBondContact O-N 3.36Å; L13-G16 WeakPolarHBondContact O-CA 3.39Å; L13-G16 PolarHBondContact O-N 2.82Å; L13-G16 VanDerWaalsContact O-N 3.09Å; Y14-G16 VanDerWaalsContact C-N 3.35Å; Y14-G16 PolarHBondContact O-N 2.89Å; G16-I18 PolarHBondContact O-N 2.95Å; G16-E19 PolarHBondContact O-N 2.81Å; G16-D20 VanDerWaalsContact O-CG 3.3Å; G16-D20 PolarHBondContact O-N 3.11Å
17V96Very high90.4Very high62 Ų6267.2 Ų67.238%0.37634%0.337SS..Hα-helixtrans-57.7-35.3176.4177.90000111.9L13 Y14 V21 W46L13-V17 HydrophobicContact CD1-CG2 4.46Å; L13-V17 WeakPolarHBondContact O-CG2 3.47Å; L13-V17 PolarHBondContact O-N 2.98Å; Y14-V17 PolarHBondContact O-N 3.49Å; V17-V21 HydrophobicContact CG1-CG2 4.18Å; V17-V21 WeakPolarHBondContact O-CB 3.32Å; V17-V21 VanDerWaalsContact O-CG2 3.24Å; V17-V21 WeakPolarHBondContact O-CG2 3.36Å; V17-V21 PolarHBondContact O-N 2.92Å; V17-W46 HydrophobicContact CG1-CH2 4.36Å
18I95.8Very high92.2Very high3 Ų370.2 Ų70.22%0.01535%0.348CS..Hα-helixtrans-63.8-48.7174.5-69.1158.4000111.5Y14 R15 G16 I22 K43 W46 E47 L50Y14-I18 WeakPolarHBondContact O-CB 3.11Å; Y14-I18 VanDerWaalsContact O-CD1 3.31Å; Y14-I18 WeakPolarHBondContact O-CD1 3.09Å; Y14-I18 WeakPolarHBondContact O-CG1 3.46Å; Y14-I18 PolarHBondContact O-N 3.47Å; R15-I18 PolarHBondContact O-N 3.09Å; G16-I18 PolarHBondContact O-N 2.95Å; I18-I22 VanDerWaalsContact O-CB 3.29Å; I18-I22 WeakPolarHBondContact O-CB 3.29Å; I18-I22 WeakPolarHBondContact O-CG1 3.42Å; I18-I22 PolarHBondContact O-N 3.15Å; I18-I22 VanDerWaalsContact O-N 3.12Å; I18-K43 HydrophobicContact CG2-CD 4.38Å; I18-K43 HydrophobicContact CG2-CG 3.91Å; I18-W46 VanDerWaalsContact CA-CZ3 3.5Å; I18-W46 HydrophobicContact CB-CE3 4.27Å; I18-W46 HydrophobicContact CB-CH2 4.07Å; I18-W46 HydrophobicContact CB-CZ3 3.85Å; I18-W46 HydrophobicContact CG1-CD2 3.93Å; I18-W46 HydrophobicContact CG1-CE3 3.72Å; I18-W46 HydrophobicContact CG1-CH2 3.43Å; I18-W46 VanDerWaalsContact CG1-CH2 3.43Å; I18-W46 HydrophobicContact CG1-CZ2 3.63Å; I18-W46 HydrophobicContact CG1-CZ3 3.5Å; I18-W46 VanDerWaalsContact CG1-CZ3 3.5Å; I18-W46 HydrophobicContact CG2-CE3 4.08Å; I18-W46 HydrophobicContact CG2-CZ3 4.03Å; I18-E47 HydrophobicContact CD1-CG 4.03Å; I18-E47 HydrophobicContact CG2-CG 4.45Å; I18-L50 HydrophobicContact CD1-CD2 4.12Å
19E96.3Very high93.7Very high75 Ų7570.4 Ų70.435%0.3535%0.347SS..Hα-helixtrans-65.6-43177.7-58.3-59166.900111.6R15 G16 I22 N23 K43R15-E19 WeakPolarHBondContact O-CG 3.24Å; R15-E19 PolarHBondContact O-N 3.27Å; G16-E19 PolarHBondContact O-N 2.81Å; E19-I22 PolarHBondContact O-N 2.92Å; E19-N23 WeakPolarHBondContact O-CB 3.42Å; E19-N23 VanDerWaalsContact O-CG 3.26Å; E19-N23 PolarHBondContact O-N 3.35Å; E19-N23 PolarHBondContact O-ND2 3.39Å; E19-K43 IonicContact OE1-NZ 2.67Å; E19-K43 PolarHBondContact OE1-NZ 3.25Å; E19-K43 IonicContact OE2-NZ 2.7Å; E19-K43 PolarHBondContact OE2-NZ 3.29Å
20D97.8Very high94.3Very high100 Ų10069.2 Ų69.254%0.53534%0.344SS..Hα-helixtrans-62.3-51.6-177.9-67.1-23.5000110.7G16 I22 N23 E24G16-D20 VanDerWaalsContact O-CG 3.3Å; G16-D20 PolarHBondContact O-N 3.11Å; D20-I22 PolarHBondContact O-N 2.7Å; D20-N23 PolarHBondContact O-N 3.37Å; D20-N23 VanDerWaalsContact O-N 3.15Å; D20-E24 WeakPolarHBondContact O-CG 3.12Å; D20-E24 PolarHBondContact O-N 3.46Å
21V97.6Very high94.8Very high58 Ų5875.6 Ų75.635%0.35238%0.378SS..Hα-helixtrans-59-44.8176.6170.60000111.4V17 N23 E24 V25 W46V17-V21 HydrophobicContact CG1-CG2 4.18Å; V17-V21 WeakPolarHBondContact O-CB 3.32Å; V17-V21 VanDerWaalsContact O-CG2 3.24Å; V17-V21 WeakPolarHBondContact O-CG2 3.36Å; V17-V21 PolarHBondContact O-N 2.92Å; V21-N23 VanDerWaalsContact C-N 3.28Å; V21-N23 PolarHBondContact O-N 2.86Å; V21-E24 PolarHBondContact O-N 3.04Å; V21-V25 HydrophobicContact CG1-CG1 4.41Å; V21-V25 WeakPolarHBondContact O-CG1 3.44Å; V21-V25 WeakPolarHBondContact O-CG2 3.43Å; V21-V25 PolarHBondContact O-N 3.36Å; V21-W46 HydrophobicContact CB-CH2 4.49Å; V21-W46 HydrophobicContact CB-CZ3 4.3Å; V21-W46 HydrophobicContact CG1-CZ3 4.39Å
22I96.4Very high95.2Very high6 Ų682.7 Ų82.73%0.03141%0.41CS..Hα-helixtrans-65-32.3179.7-70.3-68.7000112I18 E19 D20 R26 L39 L42 K43I18-I22 VanDerWaalsContact O-CB 3.29Å; I18-I22 WeakPolarHBondContact O-CB 3.29Å; I18-I22 WeakPolarHBondContact O-CG1 3.42Å; I18-I22 PolarHBondContact O-N 3.15Å; I18-I22 VanDerWaalsContact O-N 3.12Å; E19-I22 PolarHBondContact O-N 2.92Å; D20-I22 PolarHBondContact O-N 2.7Å; I22-R26 PolarHBondContact O-N 3.42Å; I22-L39 HydrophobicContact CD1-CD1 3.57Å; I22-L39 HydrophobicContact CD1-CG 4.2Å; I22-L39 HydrophobicContact CG2-CD1 4.32Å; I22-L39 HydrophobicContact CG2-CD2 4.29Å; I22-L39 HydrophobicContact CG2-CG 4.09Å; I22-L42 HydrophobicContact CD1-CD2 4.49Å; I22-K43 HydrophobicContact CD1-CB 3.84Å; I22-K43 HydrophobicContact CG1-CB 4.06Å; I22-K43 HydrophobicContact CG1-CD 4.35Å; I22-K43 HydrophobicContact CG1-CG 4.28Å
23N96.6Very high95.4Very high80 Ų8080 Ų8043%0.42842%0.417SS..Hα-helixtrans-78.3-37.4176-71.3-45.5000112.5E19 D20 V21 R26E19-N23 WeakPolarHBondContact O-CB 3.42Å; E19-N23 VanDerWaalsContact O-CG 3.26Å; E19-N23 PolarHBondContact O-N 3.35Å; E19-N23 PolarHBondContact O-ND2 3.39Å; D20-N23 PolarHBondContact O-N 3.37Å; D20-N23 VanDerWaalsContact O-N 3.15Å; V21-N23 VanDerWaalsContact C-N 3.28Å; V21-N23 PolarHBondContact O-N 2.86Å; N23-R26 VanDerWaalsContact O-CB 3.32Å; N23-R26 WeakPolarHBondContact O-CB 3.31Å; N23-R26 PolarHBondContact O-N 3.15Å
24E97.3Very high95.6Very high154 Ų15478.5 Ų78.572%0.7241%0.411SS*.Hα-helixtrans-68-43.2176.9-73.1-173.216200112.5D20 V21 R26D20-E24 WeakPolarHBondContact O-CG 3.12Å; D20-E24 PolarHBondContact O-N 3.46Å; V21-E24 PolarHBondContact O-N 3.04Å; E24-R26 PolarHBondContact O-N 2.89Å
25V97.1Very high95.7Very high38 Ų3881.4 Ų81.423%0.2343%0.43CS..Hα-helixtrans-78.6-6.4179.6-51.60000113.7V21 E27 L28 F29 L39V21-V25 HydrophobicContact CG1-CG1 4.41Å; V21-V25 WeakPolarHBondContact O-CG1 3.44Å; V21-V25 WeakPolarHBondContact O-CG2 3.43Å; V21-V25 PolarHBondContact O-N 3.36Å; V25-E27 PolarHBondContact O-N 2.91Å; V25-L28 PolarHBondContact O-N 3.12Å; V25-F29 HydrophobicContact CB-CD2 4.2Å; V25-F29 HydrophobicContact CB-CE2 4.21Å; V25-F29 HydrophobicContact CG2-CD2 4.08Å; V25-F29 HydrophobicContact CG2-CE2 3.91Å; V25-F29 VanDerWaalsContact O-CD2 3.27Å; V25-F29 WeakPolarHBondContact O-CD2 3.4Å; V25-F29 PolarHBondContact O-N 2.87Å; V25-L39 HydrophobicContact CG2-CD1 3.58Å
26R95.4Very high95.8Very high65 Ų6579.3 Ų79.325%0.24543%0.426CS..Hα-helixtrans-55.8-52-178178-177.1-65-78.7-2.8112.6I22 N23 E24 L28 F29 L30 E36 L39I22-R26 PolarHBondContact O-N 3.42Å; N23-R26 VanDerWaalsContact O-CB 3.32Å; N23-R26 WeakPolarHBondContact O-CB 3.31Å; N23-R26 PolarHBondContact O-N 3.15Å; E24-R26 PolarHBondContact O-N 2.89Å; R26-L28 VanDerWaalsContact C-N 3.32Å; R26-L28 PolarHBondContact O-N 3Å; R26-F29 PolarHBondContact O-N 3.01Å; R26-L30 HydrophobicContact CG-CD1 4.26Å; R26-L30 WeakPolarHBondContact O-CG 3.5Å; R26-L30 PolarHBondContact O-N 3.04Å; R26-L30 VanDerWaalsContact O-N 3.08Å; R26-E36 IonicContact CZ-OE1 3.93Å; R26-E36 VanDerWaalsContact NH1-CD 3.3Å; R26-E36 IonicContact NH1-OE1 3.88Å; R26-E36 PolarHBondContact NH1-OE1 3.38Å; R26-E36 IonicContact NH1-OE2 2.73Å; R26-E36 IonicContact NH2-OE1 3.72Å; R26-L39 HydrophobicContact CB-CD2 4.11Å; R26-L39 HydrophobicContact CG-CD2 4.38Å
27E95.1Very high95.8Very high116 Ų11684.2 Ų84.254%0.54244%0.441SS..Hα-helixtrans-66.8-37-178.2-57.4-58.5115.600110.7V25 F29 L30 D31V25-E27 PolarHBondContact O-N 2.91Å; E27-F29 VanDerWaalsContact C-N 3.32Å; E27-F29 PolarHBondContact O-N 3.38Å; E27-L30 PolarHBondContact O-N 2.79Å; E27-L30 VanDerWaalsContact O-N 3.13Å; E27-D31 PolarHBondContact O-N 2.67Å
28L96.2Very high95.8Very high108 Ų10884.6 Ų84.657%0.56544%0.444SS*.Hα-helixtrans-62.4-37.5175.4-58177.2000112.4V25 R26 E32V25-L28 PolarHBondContact O-N 3.12Å; R26-L28 VanDerWaalsContact C-N 3.32Å; R26-L28 PolarHBondContact O-N 3Å; L28-E32 PolarHBondContact O-N 3.11Å
29F96.3Very high95.7Very high53 Ų5384.7 Ų84.723%0.23244%0.444CS..Hα-helixtrans-67.6-39.7173.9-87.8-125.8000111.3V25 R26 E27 G33 V34 V38 L39 L42V25-F29 HydrophobicContact CB-CD2 4.2Å; V25-F29 HydrophobicContact CB-CE2 4.21Å; V25-F29 HydrophobicContact CG2-CD2 4.08Å; V25-F29 HydrophobicContact CG2-CE2 3.91Å; V25-F29 VanDerWaalsContact O-CD2 3.27Å; V25-F29 WeakPolarHBondContact O-CD2 3.4Å; V25-F29 PolarHBondContact O-N 2.87Å; R26-F29 PolarHBondContact O-N 3.01Å; E27-F29 VanDerWaalsContact C-N 3.32Å; E27-F29 PolarHBondContact O-N 3.38Å; F29-G33 PolarHBondContact O-N 3.27Å; F29-V34 HydrophobicContact CB-CB 4.22Å; F29-V34 HydrophobicContact CD1-CB 3.94Å; F29-V34 HydrophobicContact CD1-CG1 3.62Å; F29-V34 HydrophobicContact CE1-CG1 4.11Å; F29-V34 HydrophobicContact CG-CB 4.35Å; F29-V34 HydrophobicContact CG-CG1 4.5Å; F29-V34 WeakPolarHBondContact O-CB 3.38Å; F29-V34 PolarHBondContact O-N 3.07Å; F29-V38 HydrophobicContact CE1-CG1 4.43Å; F29-L39 HydrophobicContact CD1-CB 4.06Å; F29-L39 HydrophobicContact CD1-CD1 4.32Å; F29-L39 HydrophobicContact CE1-CB 4.28Å; F29-L39 HydrophobicContact CE1-CD1 4.2Å; F29-L39 HydrophobicContact CE2-CD1 4.45Å; F29-L39 HydrophobicContact CZ-CD1 4.27Å; F29-L42 HydrophobicContact CZ-CD2 4.17Å
30L93.6Very high95.6Very high97 Ų9785.4 Ų85.451%0.50845%0.45SS..Hα-helixtrans-67.7-40.1177.6-68.9171.1000112.4R26 E27 G33R26-L30 HydrophobicContact CG-CD1 4.26Å; R26-L30 WeakPolarHBondContact O-CG 3.5Å; R26-L30 PolarHBondContact O-N 3.04Å; R26-L30 VanDerWaalsContact O-N 3.08Å; E27-L30 PolarHBondContact O-N 2.79Å; E27-L30 VanDerWaalsContact O-N 3.13Å; L30-G33 WeakPolarHBondContact O-CA 3.27Å; L30-G33 PolarHBondContact O-N 3.21Å
31D96.1Very high95.5Very high138 Ų13886 Ų8674%0.73845%0.45SS*.Hα-helixtrans-63.9-38.5176.9-79.7-19.8000112.2E27 G33E27-D31 PolarHBondContact O-N 2.67Å; D31-G33 PolarHBondContact O-N 2.65Å
32E95.9Very high95.5Very high166 Ų16687.1 Ų87.178%0.77645%0.453SS*.THydrogen-bonded Turntrans-76.8-2.4171.9-70.6-70140.500113.3L28 V34L28-E32 PolarHBondContact O-N 3.11Å; E32-V34 VanDerWaalsContact C-N 3.33Å; E32-V34 HydrophobicContact CB-CG2 4.06Å; E32-V34 PolarHBondContact O-N 3.24Å
33G93.3Very high95.4Very high67 Ų6788.6 Ų88.669%0.69146%0.459SS*.THydrogen-bonded Turntrans71.522.7-179.900000114.7F29 L30 D31F29-G33 PolarHBondContact O-N 3.27Å; L30-G33 WeakPolarHBondContact O-CA 3.27Å; L30-G33 PolarHBondContact O-N 3.21Å; D31-G33 PolarHBondContact O-N 2.65Å
34V96.3Very high95.3Very high54 Ų5488.5 Ų88.533%0.32746%0.461SS..  trans-81.6133.1177-174.60000110F29 E32 V38F29-V34 HydrophobicContact CB-CB 4.22Å; F29-V34 HydrophobicContact CD1-CB 3.94Å; F29-V34 HydrophobicContact CD1-CG1 3.62Å; F29-V34 HydrophobicContact CE1-CG1 4.11Å; F29-V34 HydrophobicContact CG-CB 4.35Å; F29-V34 HydrophobicContact CG-CG1 4.5Å; F29-V34 WeakPolarHBondContact O-CB 3.38Å; F29-V34 PolarHBondContact O-N 3.07Å; E32-V34 VanDerWaalsContact C-N 3.33Å; E32-V34 HydrophobicContact CB-CG2 4.06Å; E32-V34 PolarHBondContact O-N 3.24Å; V34-V38 HydrophobicContact CG1-CB 3.83Å; V34-V38 HydrophobicContact CG1-CG1 4.11Å; V34-V38 HydrophobicContact CG1-CG2 3.99Å
35D93.8Very high95.2Very high106 Ų10685.4 Ų85.457%0.56745%0.449SS*.  trans-67.9139.9-179.7-167.2-76.1000112.2Q37 V38D35-Q37 PolarHBondContact O-N 3.44Å; D35-Q37 VanDerWaalsContact O-N 3.11Å; D35-Q37 WeakPolarHBondContact OD1-CB 3.34Å; D35-Q37 PolarHBondContact OD1-N 2.82Å; D35-V38 WeakPolarHBondContact O-CB 3.22Å; D35-V38 PolarHBondContact O-N 2.93Å
36E93.4Very high95.2Very high92 Ų9287.7 Ų87.743%0.4345%0.454SS..Hα-helixtrans-57.1-26.8178.7-175.8176.5-17600112.7R26 V38 L39 L40R26-E36 IonicContact CZ-OE1 3.93Å; R26-E36 VanDerWaalsContact NH1-CD 3.3Å; R26-E36 IonicContact NH1-OE1 3.88Å; R26-E36 PolarHBondContact NH1-OE1 3.38Å; R26-E36 IonicContact NH1-OE2 2.73Å; R26-E36 IonicContact NH2-OE1 3.72Å; E36-V38 PolarHBondContact O-N 3.34Å; E36-L39 WeakPolarHBondContact O-CB 3.44Å; E36-L39 PolarHBondContact O-N 2.91Å; E36-L39 VanDerWaalsContact O-N 3.09Å; E36-L40 HydrophobicContact CG-CD1 4.37Å; E36-L40 HydrophobicContact CG-CG 4.44Å; E36-L40 WeakPolarHBondContact O-CG 3.33Å; E36-L40 PolarHBondContact O-N 3.37Å
37Q94.7Very high95Very high130 Ų13087 Ų8761%0.60745%0.454SS*.Hα-helixtrans-57.6-34.7173.2-174.7175.7-17.600112.4D35 L40 E41D35-Q37 PolarHBondContact O-N 3.44Å; D35-Q37 VanDerWaalsContact O-N 3.11Å; D35-Q37 WeakPolarHBondContact OD1-CB 3.34Å; D35-Q37 PolarHBondContact OD1-N 2.82Å; Q37-L40 PolarHBondContact O-N 3.18Å; Q37-E41 WeakPolarHBondContact O-CB 3.41Å; Q37-E41 PolarHBondContact O-N 3.44Å
38V96.3Very high94.8Very high71 Ų7185.2 Ų85.243%0.4345%0.448SS..Hα-helixtrans-68.9-38177.1-175.70000110.7F29 V34 D35 E36 E41 L42F29-V38 HydrophobicContact CE1-CG1 4.43Å; V34-V38 HydrophobicContact CG1-CB 3.83Å; V34-V38 HydrophobicContact CG1-CG1 4.11Å; V34-V38 HydrophobicContact CG1-CG2 3.99Å; D35-V38 WeakPolarHBondContact O-CB 3.22Å; D35-V38 PolarHBondContact O-N 2.93Å; E36-V38 PolarHBondContact O-N 3.34Å; V38-E41 PolarHBondContact O-N 3.26Å; V38-L42 WeakPolarHBondContact O-CB 3.48Å; V38-L42 PolarHBondContact O-N 2.88Å
39L95.4Very high94.6Very high4 Ų486.6 Ų86.62%0.02145%0.449CS..Hα-helixtrans-67.6-38.3175.8-175.962000111.7I22 V25 R26 F29 E36 L42 K43I22-L39 HydrophobicContact CD1-CD1 3.57Å; I22-L39 HydrophobicContact CD1-CG 4.2Å; I22-L39 HydrophobicContact CG2-CD1 4.32Å; I22-L39 HydrophobicContact CG2-CD2 4.29Å; I22-L39 HydrophobicContact CG2-CG 4.09Å; V25-L39 HydrophobicContact CG2-CD1 3.58Å; R26-L39 HydrophobicContact CB-CD2 4.11Å; R26-L39 HydrophobicContact CG-CD2 4.38Å; F29-L39 HydrophobicContact CD1-CB 4.06Å; F29-L39 HydrophobicContact CD1-CD1 4.32Å; F29-L39 HydrophobicContact CE1-CB 4.28Å; F29-L39 HydrophobicContact CE1-CD1 4.2Å; F29-L39 HydrophobicContact CE2-CD1 4.45Å; F29-L39 HydrophobicContact CZ-CD1 4.27Å; E36-L39 WeakPolarHBondContact O-CB 3.44Å; E36-L39 PolarHBondContact O-N 2.91Å; E36-L39 VanDerWaalsContact O-N 3.09Å; L39-L42 HydrophobicContact CD1-CD2 4.41Å; L39-L42 PolarHBondContact O-N 3.22Å; L39-K43 PolarHBondContact O-N 3.46Å
40L93.8Very high94.3Very high90 Ų9085.6 Ų85.647%0.47145%0.446SS..Hα-helixtrans-67.9-36.5172.9-70169.5000112.6E36 Q37 T44E36-L40 HydrophobicContact CG-CD1 4.37Å; E36-L40 HydrophobicContact CG-CG 4.44Å; E36-L40 WeakPolarHBondContact O-CG 3.33Å; E36-L40 PolarHBondContact O-N 3.37Å; Q37-L40 PolarHBondContact O-N 3.18Å; L40-T44 WeakPolarHBondContact O-CB 3.44Å; L40-T44 PolarHBondContact O-N 2.92Å; L40-T44 PolarHBondContact O-OG1 3.29Å
41E95.8Very high93.8Very high114 Ų11484.9 Ų84.953%0.53344%0.443SS..Hα-helixtrans-66.8-44.6173.3-175172.9-177.500111Q37 V38 K43 T44 L45Q37-E41 WeakPolarHBondContact O-CB 3.41Å; Q37-E41 PolarHBondContact O-N 3.44Å; V38-E41 PolarHBondContact O-N 3.26Å; E41-K43 PolarHBondContact O-N 2.91Å; E41-T44 PolarHBondContact O-N 3.09Å; E41-L45 HydrophobicContact CG-CD1 3.85Å; E41-L45 HydrophobicContact CG-CG 4.17Å; E41-L45 WeakPolarHBondContact O-CB 3.37Å; E41-L45 WeakPolarHBondContact O-CG 3.42Å; E41-L45 PolarHBondContact O-N 3.4Å
42L96.5Very high93Very high81 Ų8185.2 Ų85.242%0.42444%0.439SS..Hα-helixtrans-54.4-50.9174.1173.961.4000111.4I22 F29 V38 L39 T44 L45 W46I22-L42 HydrophobicContact CD1-CD2 4.49Å; F29-L42 HydrophobicContact CZ-CD2 4.17Å; V38-L42 WeakPolarHBondContact O-CB 3.48Å; V38-L42 PolarHBondContact O-N 2.88Å; L39-L42 HydrophobicContact CD1-CD2 4.41Å; L39-L42 PolarHBondContact O-N 3.22Å; L42-T44 PolarHBondContact O-N 3.42Å; L42-L45 PolarHBondContact O-N 3.46Å; L42-W46 WeakPolarHBondContact O-CB 3.44Å; L42-W46 PolarHBondContact O-N 2.9Å
43K95.4Very high92.1Very high37 Ų3780.6 Ų80.616%0.16143%0.425CS..Hα-helixtrans-54.5-51175.1-179.3175.6177.81750111.6I18 E19 I22 L39 E41 L45 W46 E47I18-K43 HydrophobicContact CG2-CD 4.38Å; I18-K43 HydrophobicContact CG2-CG 3.91Å; E19-K43 IonicContact OE1-NZ 2.67Å; E19-K43 PolarHBondContact OE1-NZ 3.25Å; E19-K43 IonicContact OE2-NZ 2.7Å; E19-K43 PolarHBondContact OE2-NZ 3.29Å; I22-K43 HydrophobicContact CD1-CB 3.84Å; I22-K43 HydrophobicContact CG1-CB 4.06Å; I22-K43 HydrophobicContact CG1-CD 4.35Å; I22-K43 HydrophobicContact CG1-CG 4.28Å; L39-K43 PolarHBondContact O-N 3.46Å; E41-K43 PolarHBondContact O-N 2.91Å; K43-L45 PolarHBondContact O-N 3.48Å; K43-W46 PolarHBondContact O-N 3.37Å; K43-E47 WeakPolarHBondContact CE-OE1 3.48Å; K43-E47 PolarHBondContact O-N 3.25Å
44T94.3Very high91Very high77 Ų7783.2 Ų83.247%0.47242%0.418SS..Hα-helixtrans-63.1-42.5-177.4-57.50000111.8L40 E41 L42 N48L40-T44 WeakPolarHBondContact O-CB 3.44Å; L40-T44 PolarHBondContact O-N 2.92Å; L40-T44 PolarHBondContact O-OG1 3.29Å; E41-T44 PolarHBondContact O-N 3.09Å; L42-T44 PolarHBondContact O-N 3.42Å; T44-N48 WeakPolarHBondContact O-CB 3.35Å; T44-N48 PolarHBondContact O-N 3.34Å; T44-N48 VanDerWaalsContact O-N 3.15Å; T44-N48 PolarHBondContact O-ND2 3.1Å
45L95.6Very high89.3Confident89 Ų8980.8 Ų80.847%0.46640%0.404SS..Hα-helixtrans-68.3-37.8177.5-71.7175.6000112E41 L42 K43 K49E41-L45 HydrophobicContact CG-CD1 3.85Å; E41-L45 HydrophobicContact CG-CG 4.17Å; E41-L45 WeakPolarHBondContact O-CB 3.37Å; E41-L45 WeakPolarHBondContact O-CG 3.42Å; E41-L45 PolarHBondContact O-N 3.4Å; L42-L45 PolarHBondContact O-N 3.46Å; K43-L45 PolarHBondContact O-N 3.48Å; L45-K49 WeakPolarHBondContact O-CB 3.3Å; L45-K49 VanDerWaalsContact O-CG 3.31Å; L45-K49 WeakPolarHBondContact O-CG 3.31Å; L45-K49 PolarHBondContact O-N 2.96Å
46W95.6Very high87.7Confident86 Ų8676.2 Ų76.233%0.32638%0.379SS..Hα-helixtrans-68.2-47.2177.3179.624.8000112.1V17 I18 V21 L42 K43 N48 K49 L50V17-W46 HydrophobicContact CG1-CH2 4.36Å; I18-W46 VanDerWaalsContact CA-CZ3 3.5Å; I18-W46 HydrophobicContact CB-CE3 4.27Å; I18-W46 HydrophobicContact CB-CH2 4.07Å; I18-W46 HydrophobicContact CB-CZ3 3.85Å; I18-W46 HydrophobicContact CG1-CD2 3.93Å; I18-W46 HydrophobicContact CG1-CE3 3.72Å; I18-W46 HydrophobicContact CG1-CH2 3.43Å; I18-W46 VanDerWaalsContact CG1-CH2 3.43Å; I18-W46 HydrophobicContact CG1-CZ2 3.63Å; I18-W46 HydrophobicContact CG1-CZ3 3.5Å; I18-W46 VanDerWaalsContact CG1-CZ3 3.5Å; I18-W46 HydrophobicContact CG2-CE3 4.08Å; I18-W46 HydrophobicContact CG2-CZ3 4.03Å; V21-W46 HydrophobicContact CB-CH2 4.49Å; V21-W46 HydrophobicContact CB-CZ3 4.3Å; V21-W46 HydrophobicContact CG1-CZ3 4.39Å; L42-W46 WeakPolarHBondContact O-CB 3.44Å; L42-W46 PolarHBondContact O-N 2.9Å; K43-W46 PolarHBondContact O-N 3.37Å; W46-N48 VanDerWaalsContact C-N 3.3Å; W46-N48 PolarHBondContact O-N 2.73Å; W46-K49 PolarHBondContact O-N 2.99Å; W46-K49 VanDerWaalsContact O-N 3.13Å; W46-L50 WeakPolarHBondContact O-CB 3.42Å; W46-L50 PolarHBondContact O-N 3.06Å
47E91.8Very high85.8Confident51 Ų5177 Ų7724%0.23838%0.383CS..Hα-helixtrans-54.3-46.3173.1-77.9-176.5-160.300111.6I18 K43 K49 L50 L51I18-E47 HydrophobicContact CD1-CG 4.03Å; I18-E47 HydrophobicContact CG2-CG 4.45Å; K43-E47 WeakPolarHBondContact CE-OE1 3.48Å; K43-E47 PolarHBondContact O-N 3.25Å; E47-K49 PolarHBondContact O-N 3.15Å; E47-L50 PolarHBondContact O-N 2.87Å; E47-L51 PolarHBondContact O-N 3.13Å
48N91.2Very high83.8Confident78 Ų7872.4 Ų72.442%0.41737%0.37SS..Hα-helixtrans-65.3-37.3178-83.1-70.4000113.1T44 W46 Q52T44-N48 WeakPolarHBondContact O-CB 3.35Å; T44-N48 PolarHBondContact O-N 3.34Å; T44-N48 VanDerWaalsContact O-N 3.15Å; T44-N48 PolarHBondContact O-ND2 3.1Å; W46-N48 VanDerWaalsContact C-N 3.3Å; W46-N48 PolarHBondContact O-N 2.73Å; N48-Q52 WeakPolarHBondContact O-CB 3.31Å; N48-Q52 VanDerWaalsContact O-CG 3.25Å; N48-Q52 WeakPolarHBondContact O-CG 3.26Å; N48-Q52 PolarHBondContact O-N 3.27Å; N48-Q52 PolarHBondContact O-NE2 3.49Å
49K92.4Very high81.8Confident137 Ų13771 Ų7160%0.59636%0.359SS*.Hα-helixtrans-68.7-40.8175.5-79.4173.9175.8-67.80112L45 W46 E47 L51 Q52 S53L45-K49 WeakPolarHBondContact O-CB 3.3Å; L45-K49 VanDerWaalsContact O-CG 3.31Å; L45-K49 WeakPolarHBondContact O-CG 3.31Å; L45-K49 PolarHBondContact O-N 2.96Å; W46-K49 PolarHBondContact O-N 2.99Å; W46-K49 VanDerWaalsContact O-N 3.13Å; E47-K49 PolarHBondContact O-N 3.15Å; K49-L51 VanDerWaalsContact C-N 3.35Å; K49-L51 PolarHBondContact O-N 3.39Å; K49-Q52 PolarHBondContact O-N 3.04Å; K49-S53 PolarHBondContact O-N 2.78Å
50L89.7Confident79.6Confident33 Ų3375 Ų7517%0.17338%0.377CS..Hα-helixtrans-60.7-44.6175.5-178.265.8000110.9Y14 I18 W46 E47 S53 A55 V56Y14-L50 HydrophobicContact CD2-CD1 4.17Å; Y14-L50 HydrophobicContact CD2-CD2 4.07Å; Y14-L50 HydrophobicContact CE2-CD1 4.39Å; Y14-L50 HydrophobicContact CG-CD1 4.47Å; Y14-L50 HydrophobicContact CG-CD2 3.98Å; I18-L50 HydrophobicContact CD1-CD2 4.12Å; W46-L50 WeakPolarHBondContact O-CB 3.42Å; W46-L50 PolarHBondContact O-N 3.06Å; E47-L50 PolarHBondContact O-N 2.87Å; L50-S53 PolarHBondContact O-N 2.77Å; L50-S53 PolarHBondContact O-OG 2.84Å; L50-A55 HydrophobicContact CD1-CB 4.37Å; L50-V56 HydrophobicContact CD1-CG2 4.23Å; L50-V56 HydrophobicContact CD2-CG2 4.28Å; L50-V56 HydrophobicContact CG-CG2 3.9Å
51L82.1Confident77.6Confident82 Ų8274.9 Ų74.943%0.42938%0.38SS..Hα-helixtrans-60.7-44.4173.2-78.7157.4000112.6E47 K49 S53 K54E47-L51 PolarHBondContact O-N 3.13Å; K49-L51 VanDerWaalsContact C-N 3.35Å; K49-L51 PolarHBondContact O-N 3.39Å; L51-S53 VanDerWaalsContact C-N 3.28Å; L51-S53 PolarHBondContact O-N 2.93Å; L51-K54 PolarHBondContact O-N 2.99Å
52Q80Confident75.3Confident144 Ų14475.3 Ų75.367%0.67339%0.386SS*.Hα-helixtrans-65.8-27.3178.6-75166.646.900113.7N48 K49 K54N48-Q52 WeakPolarHBondContact O-CB 3.31Å; N48-Q52 VanDerWaalsContact O-CG 3.25Å; N48-Q52 WeakPolarHBondContact O-CG 3.26Å; N48-Q52 PolarHBondContact O-N 3.27Å; N48-Q52 PolarHBondContact O-NE2 3.49Å; K49-Q52 PolarHBondContact O-N 3.04Å; Q52-K54 PolarHBondContact O-N 3.04Å
53S76.6Confident73Confident69 Ų6977.1 Ų77.148%0.48339%0.393SS..THydrogen-bonded Turntrans-69.4-9.5178.7760000114.3K49 L50 L51 A55K49-S53 PolarHBondContact O-N 2.78Å; L50-S53 PolarHBondContact O-N 2.77Å; L50-S53 PolarHBondContact O-OG 2.84Å; L51-S53 VanDerWaalsContact C-N 3.28Å; L51-S53 PolarHBondContact O-N 2.93Å; S53-A55 PolarHBondContact O-N 3.25Å; S53-A55 WeakPolarHBondContact OG-CB 3.07Å
54K70Confident70.7Confident122 Ų12282.6 Ų82.653%0.5342%0.419SS..SBendtrans63.9-6.5-177.6-52.5-168.2168.2-174.30117.2L51 Q52 V56 E57 G379L51-K54 PolarHBondContact O-N 2.99Å; Q52-K54 PolarHBondContact O-N 3.04Å; K54-V56 PolarHBondContact O-N 3.4Å; K54-E57 HydrophobicContact CB-CB 4.19Å; K54-E57 HydrophobicContact CB-CG 4.3Å; K54-E57 WeakPolarHBondContact CD-OE2 3.32Å; K54-E57 VanDerWaalsContact CE-OE2 3.23Å; K54-E57 WeakPolarHBondContact CE-OE2 3.25Å; K54-E57 HydrophobicContact CG-CG 4.3Å; K54-E57 VanDerWaalsContact CG-OE2 3.25Å; K54-E57 WeakPolarHBondContact CG-OE2 3.47Å; K54-E57 IonicContact NZ-OE2 2.68Å; K54-E57 PolarHBondContact O-N 2.84Å; K54-G379 CarbonylContact C-O 3.58Å
55A61.3Low68.7Low4 Ų483.1 Ų83.13%0.03342%0.422CS..THydrogen-bonded Turntrans-34.3-39164.200000114.7L50 S53 D381L50-A55 HydrophobicContact CD1-CB 4.37Å; S53-A55 PolarHBondContact O-N 3.25Å; S53-A55 WeakPolarHBondContact OG-CB 3.07Å; A55-D381 WeakPolarHBondContact CB-OD2 3.32Å; A55-D381 PolarHBondContact O-N 3.26Å
56V59.8Low66.7Low9 Ų981.6 Ų81.66%0.05542%0.422CS..THydrogen-bonded Turntrans-109.3-4.4-175-154.40000113P11 Y14 L50 K54 F59P11-V56 HydrophobicContact CB-CG1 3.65Å; P11-V56 HydrophobicContact CG-CG1 3.65Å; Y14-V56 HydrophobicContact CD2-CG2 4.25Å; L50-V56 HydrophobicContact CD1-CG2 4.23Å; L50-V56 HydrophobicContact CD2-CG2 4.28Å; L50-V56 HydrophobicContact CG-CG2 3.9Å; K54-V56 PolarHBondContact O-N 3.4Å; V56-F59 HydrophobicContact CG1-CD2 4.49Å; V56-F59 PolarHBondContact O-N 2.97Å
57E53.4Low64.7Low109 Ų10983.2 Ų83.251%0.50944%0.437SS..THydrogen-bonded Turntrans-68.4138.9176.8-81.3-161.4143.900111.1K54K54-E57 HydrophobicContact CB-CB 4.19Å; K54-E57 HydrophobicContact CB-CG 4.3Å; K54-E57 WeakPolarHBondContact CD-OE2 3.32Å; K54-E57 VanDerWaalsContact CE-OE2 3.23Å; K54-E57 WeakPolarHBondContact CE-OE2 3.25Å; K54-E57 HydrophobicContact CG-CG 4.3Å; K54-E57 VanDerWaalsContact CG-OE2 3.25Å; K54-E57 WeakPolarHBondContact CG-OE2 3.47Å; K54-E57 IonicContact NZ-OE2 2.68Å; K54-E57 PolarHBondContact O-N 2.84Å
58G53.7Low62.8Low33 Ų3387.7 Ų87.734%0.3446%0.458SS..THydrogen-bonded Turntrans97.9-25.4-17400000114.4
59F53.7Low60.9Low41 Ų4186.9 Ų86.918%0.1846%0.462CS..THydrogen-bonded Turntrans-84.3-15.2-179.5-54.3-48.8000114.6N8 P11 V56 R380N8-F59 HydrophobicContact CB-CB 4.27Å; N8-F59 HydrophobicContact CB-CD1 3.82Å; N8-F59 HydrophobicContact CB-CE1 4.37Å; N8-F59 HydrophobicContact CB-CG 3.95Å; N8-F59 WeakPolarHBondContact ND2-CD1 3.41Å; N8-F59 WeakPolarHBondContact ND2-CE1 3.42Å; N8-F59 WeakPolarHBondContact ND2-CE2 3.27Å; N8-F59 WeakPolarHBondContact ND2-CZ 3.47Å; P11-F59 HydrophobicContact CG-CB 3.92Å; P11-F59 HydrophobicContact CG-CD2 4.15Å; P11-F59 HydrophobicContact CG-CG 4.36Å; V56-F59 HydrophobicContact CG1-CD2 4.49Å; V56-F59 PolarHBondContact O-N 2.97Å; F59-R380 HydrophobicContact CZ-CB 4.27Å; F59-R380 HydrophobicContact CZ-CG 4.42Å
60H48.6Very low58.8Low90 Ų9085.6 Ų85.642%0.41747%0.466SS..THydrogen-bonded Turntrans-88.2-20.1174.9-61.6157.2000113.7
61T52.3Low56.9Low86 Ų8692 Ų9253%0.52850%0.495SS..Hα-helixtrans-78.9-38.3-170.7-36.90000112.8T65T61-T65 WeakPolarHBondContact O-CB 3.26Å; T61-T65 PolarHBondContact O-N 2.95Å; T61-T65 PolarHBondContact O-OG1 3.35Å
62D48Very low55.2Low123 Ų12395.5 Ų95.566%0.65851%0.509SS*.Hα-helixtrans-76.4-40.2-173.2-66.7-38.3000113.4T65 A66D62-T65 PolarHBondContact O-N 3.07Å; D62-A66 WeakPolarHBondContact O-CB 3.49Å; D62-A66 PolarHBondContact O-N 3.26Å
63E47Very low53.3Low120 Ų12097.1 Ų97.156%0.56152%0.516SS*.Hα-helixtrans-69.8-40.6-176.8-163.9172.591.300111.9L67E63-L67 WeakPolarHBondContact O-CG 3.37Å; E63-L67 PolarHBondContact O-N 3.16Å
64Q48Very low51.5Low151 Ų151102.5 Ų102.571%0.70653%0.534SS*.Hα-helixtrans-69.2-36.5175.1-70.7-169.41.900112.6Q68Q64-Q68 PolarHBondContact O-N 2.95Å
65T52.2Low50Low88 Ų88103 Ų10354%0.5455%0.546SS..Hα-helixtrans-67.5-40.4178.2-57.70000111.5T61 D62 Q68 A69T61-T65 WeakPolarHBondContact O-CB 3.26Å; T61-T65 PolarHBondContact O-N 2.95Å; T61-T65 PolarHBondContact O-OG1 3.35Å; D62-T65 PolarHBondContact O-N 3.07Å; T65-Q68 PolarHBondContact O-N 2.82Å; T65-A69 PolarHBondContact O-N 3.25Å; T65-A69 VanDerWaalsContact O-N 3.13Å
66A54.3Low48.8Very low58 Ų58111 Ų11148%0.47958%0.583SS.*Hα-helixtrans-63.6-44.1177.200000112.6D62 Q68 A69 T70D62-A66 WeakPolarHBondContact O-CB 3.49Å; D62-A66 PolarHBondContact O-N 3.26Å; A66-Q68 VanDerWaalsContact C-N 3.29Å; A66-Q68 PolarHBondContact O-N 2.84Å; A66-A69 PolarHBondContact O-N 3.13Å; A66-T70 PolarHBondContact O-N 2.82Å; A66-T70 PolarHBondContact O-OG1 2.83Å
67L52.8Low47.5Very low120 Ų120120.3 Ų120.363%0.62863%0.625SS**Hα-helixtrans-66.6-29.6178.4-69.3170.3000113E63E63-L67 WeakPolarHBondContact O-CG 3.37Å; E63-L67 PolarHBondContact O-N 3.16Å
68Q51.9Low46.5Very low145 Ų145119.5 Ų119.568%0.67864%0.638SS**Hα-helixtrans-78.2-30.3177.2-165.2162.192.300112.9Q64 T65 A66Q64-Q68 PolarHBondContact O-N 2.95Å; T65-Q68 PolarHBondContact O-N 2.82Å; A66-Q68 VanDerWaalsContact C-N 3.29Å; A66-Q68 PolarHBondContact O-N 2.84Å
69A51.3Low45.6Very low61 Ų61124 Ų12450%0.50466%0.66SS.*Hα-helixtrans-67.6-37.3175.900000113T65 A66 Q71 Q72T65-A69 PolarHBondContact O-N 3.25Å; T65-A69 VanDerWaalsContact O-N 3.13Å; A66-A69 PolarHBondContact O-N 3.13Å; A69-Q71 VanDerWaalsContact C-N 3.33Å; A69-Q71 PolarHBondContact O-N 2.86Å; A69-Q72 PolarHBondContact O-N 2.93Å
70T48.2Very low44.5Very low110 Ų110130.6 Ų130.668%0.67569%0.692SS**Hα-helixtrans-67.4-27-176.6-54.80000113.7A66 Q72A66-T70 PolarHBondContact O-N 2.82Å; A66-T70 PolarHBondContact O-OG1 2.83Å; T70-Q72 PolarHBondContact O-N 3.26Å
71Q49.4Very low43.7Very low168 Ų168133 Ų13379%0.78571%0.713SS**G310 helixtrans-76.8-14.9178.6-87-162.985.100114.8A69A69-Q71 VanDerWaalsContact C-N 3.33Å; A69-Q71 PolarHBondContact O-N 2.86Å
72Q46.6Very low42.9Very low154 Ų154136.7 Ų136.772%0.7272%0.724SS**G310 helixtrans-84.8-10.9-174.6-65.9-168.44.700114.9A69 T70A69-Q72 PolarHBondContact O-N 2.93Å; T70-Q72 PolarHBondContact O-N 3.26Å
73Q40Very low42Very low178 Ų178140.1 Ų140.183%0.83274%0.736SS**G310 helixtrans-88.8-1.1-173.9-76.4-171.4-34.800115.9
74H39Very low41.1Very low183 Ų183140 Ų14085%0.84774%0.743SS**SBendtrans-102.518.9-170.6-135.285.7000116.5
75V38.7Very low40.1Very low131 Ų131138.7 Ų138.779%0.79475%0.746SS**SBendtrans-123.316.9-176-151.20000114.2
76Q34.9Very low38.9Very low174 Ų174143.3 Ų143.381%0.81376%0.761SS**  trans-13577.8174.4-71.5-175.321.700112.2
77H33.2Very low38.4Very low203 Ų203145.1 Ų145.194%0.9477%0.768SS**  trans-163.898.5147.3-88.2112.8000109.5
78A31.7Very low37.1Very low93 Ų93145.2 Ų145.277%0.76977%0.774SS**  trans-116.6128.8164.500000108.3
79P36.2Very low35.9Very low126 Ų126147.6 Ų147.682%0.81879%0.785SS**  trans-74.1137.3-17528.8-33.3000111.5
80Q30.6Very low34.9Very low180 Ų180149.1 Ų149.184%0.84180%0.797SS**  trans-75.5144.5174.3-67.7-156.4-12.100111.8
81V30.6Very low33.9Very low142 Ų142153.5 Ų153.586%0.86181%0.81SS**  trans-126133.3162.8-72.20000110.4
82Q36.2Very low33.1Very low163 Ų163154.1 Ų154.176%0.76281%0.813SS**  trans-71.8143.4-175.2-136.18313.400112.6
83Q30Very low32.2Very low195 Ų195152.6 Ų152.691%0.91181%0.814SS**  trans-159.4170.4145.3-117.3166.170.100113.7
84V26.8Very low31.6Very low117 Ų117152 Ų15271%0.70982%0.815SS**  trans-128.8129-140.6165.90000113.9
85T28.1Very low31.1Very low123 Ų123150 Ų15076%0.75581%0.81SS**  trans36.7138.1155.665.20000125
86Q26.6Very low31Very low185 Ų185149.5 Ų149.586%0.86481%0.809SS**  trans91.3162.6137.9-102.6-160.760.200120.4
87P43.2Very low31Very low96 Ų96147.1 Ų147.162%0.62381%0.809SS**  -133.3-178.2-112.341.9-23.1000117.4
88T25.5Very low30.9Very low122 Ų122146.5 Ų146.575%0.74881%0.806SS**  trans82113.4159.6-17.90000118.2
89Q27.6Very low31Very low195 Ų195151.1 Ų151.191%0.91181%0.812SS**  175.4161.7110-94-173.682.100111.4
90A29.7Very low30.8Very low93 Ų93154 Ų15477%0.76982%0.815SS**  trans-103.3137-175.100000112.4
91Q27.1Very low30.9Very low203 Ų203154.3 Ų154.395%0.94982%0.816SS**  trans-162.7171.2134-119.1163.918.700113.7
92Q31.8Very low30.7Very low180 Ų180151.9 Ų151.984%0.84181%0.811SS**  trans-89.1177.8-164.5-71.9-146.934.800115
93V28.2Very low30.2Very low123 Ų123149.8 Ų149.875%0.74581%0.809SS**  trans89.1104160.3-1680000115.9
94I27.8Very low30.1Very low165 Ų165146.2 Ų146.285%0.84680%0.803SS**  -168.5154.9126.9-104.4160.6000112.4
95L29Very low29.9Very low141 Ų141149.1 Ų149.174%0.73881%0.809SS**PPolyproline II helixtrans-63.2159-176.9-84.958.1000114.1
96P36.4Very low29.8Very low120 Ų120151.7 Ų151.778%0.77981%0.812SS**PPolyproline II helixtrans-68.9133.9168.829.7-34.1000111.6
97P35.5Very low29.7Very low124 Ų124148.9 Ų148.981%0.80581%0.807SS**PPolyproline II helixtrans-72.8138.217129.2-32.7000111.3
98Q30.8Very low28.9Very low190 Ų190150.6 Ų150.689%0.88881%0.81SS**PPolyproline II helixtrans-60.8139.1171.5-71.2-174-51.500111
99Q34Very low29Very low191 Ų191150.8 Ų150.889%0.89381%0.811SS**PPolyproline II helixtrans-79.9126.4161-75.8-176.7-18.900109.7Q101Q99-Q101 PolarHBondContact O-N 2.89Å; Q99-Q101 VanDerWaalsContact O-N 3.16Å
100Q31.6Very low28.9Very low186 Ų186149.6 Ų149.687%0.86981%0.805SS**  trans-62.7110.7173.6-138.291.216.800109.3A102Q100-A102 PolarHBondContact O-N 2.85Å; Q100-A102 VanDerWaalsContact O-N 3.1Å
101Q32.7Very low28.6Very low187 Ų187150.8 Ų150.887%0.87480%0.799SS**  trans-81.989.6175.3-163.317114.900109.2Q99 T103Q99-Q101 PolarHBondContact O-N 2.89Å; Q99-Q101 VanDerWaalsContact O-N 3.16Å; Q101-T103 PolarHBondContact O-N 2.66Å
102A26.3Very low28.8Very low90 Ų90150.2 Ų150.274%0.74480%0.796SS**  trans-67.7117.7174.200000110Q100 P104Q100-A102 PolarHBondContact O-N 2.85Å; Q100-A102 VanDerWaalsContact O-N 3.1Å; A102-P104 WeakPolarHBondContact O-CD 3.38Å
103T25Very low28.8Very low119 Ų119150 Ų15073%0.7379%0.793SS**  trans-72.1122.4174.3420000110.6Q101 Q105Q101-T103 PolarHBondContact O-N 2.66Å; T103-Q105 PolarHBondContact O-N 3.32Å
104P28.5Very low29.3Very low121 Ų121152 Ų15279%0.78680%0.797SS**  trans-69115.715728.3-29.8000107.6A102 Q106A102-P104 WeakPolarHBondContact O-CD 3.38Å; P104-Q106 PolarHBondContact O-N 2.97Å
105Q23.3Very low29.8Very low178 Ų178151.5 Ų151.583%0.83280%0.795SS**  trans-59.9123.6175.7-79.1173.8-44.300110T103 V107T103-Q105 PolarHBondContact O-N 3.32Å; Q105-V107 PolarHBondContact O-N 3.5Å
106Q25.5Very low30Very low176 Ų176153.6 Ų153.682%0.82280%0.801SS**  trans-71.7110.1161.4-68.2-172.1-7.100108.2P104 I108P104-Q106 PolarHBondContact O-N 2.97Å; Q106-I108 PolarHBondContact O-N 3.23Å; Q106-I108 VanDerWaalsContact O-N 3.11Å
107V23.2Very low29.9Very low126 Ų126155.6 Ų155.676%0.76480%0.799SS**  trans-74.798.7162.7179.10000107.2Q105 V109Q105-V107 PolarHBondContact O-N 3.5Å; V107-V109 HydrophobicContact CG1-CG2 4.16Å; V107-V109 PolarHBondContact O-N 3.03Å; V107-V109 VanDerWaalsContact O-N 3.15Å
108I27.6Very low29.7Very low133 Ų133159.1 Ų159.168%0.68281%0.807SS**  trans-68.7104.4167.4-70164.8000107.3Q106 Q110Q106-I108 PolarHBondContact O-N 3.23Å; Q106-I108 VanDerWaalsContact O-N 3.11Å; I108-Q110 HydrophobicContact CG2-CB 4.07Å
109V26.5Very low29.7Very low126 Ų126154.9 Ų154.976%0.76480%0.799SS**  trans-98.2100.1152.1-178.30000106.6V107 D111V107-V109 HydrophobicContact CG1-CG2 4.16Å; V107-V109 PolarHBondContact O-N 3.03Å; V107-V109 VanDerWaalsContact O-N 3.15Å; V109-D111 PolarHBondContact O-N 3.24Å
110Q27.1Very low30Very low169 Ų169150.1 Ų150.179%0.7979%0.792SS**  trans-79.9102.4173173.4-17788.200108.3I108I108-Q110 HydrophobicContact CG2-CB 4.07Å
111D23.5Very low30.3Very low118 Ų118148 Ų14863%0.63179%0.792SS**  trans-134.7108.9154.5-163.8-89.3000110.3V109 K113V109-D111 PolarHBondContact O-N 3.24Å; D111-K113 PolarHBondContact O-N 3.19Å
112Q31.1Very low30.4Very low192 Ų192142.7 Ų142.790%0.89779%0.788SS**  trans-92.874.3178.2-76.4-156.5-5.900110.9
113K30.7Very low30.8Very low176 Ų176146.3 Ų146.377%0.76579%0.791SS**  trans-138.95.1171.2-115.6-177.9179.9-170.10117.6D111D111-K113 PolarHBondContact O-N 3.19Å
114I39Very low31.2Very low163 Ų163145.3 Ų145.384%0.83679%0.789SS**SBendtrans-97.4-3.2-174.9-75169.3000114.4
115I39.3Very low31.7Very low156 Ų156143.7 Ų143.780%0.879%0.786SS**SBendtrans-12667.6175.4-47.5-174.9000111.2
116Q33.5Very low32.3Very low185 Ų185139.1 Ų139.186%0.86478%0.778SS**  trans-170.180.1159.5-112.9162.8101.600112.4
117H34.4Very low32.8Very low161 Ų161134.4 Ų134.475%0.74577%0.77SS**  trans-171.574.8140.156.7-87.1000112.2
118M29.8Very low33.5Very low199 Ų199133.3 Ų133.398%0.9876%0.764SS**  trans-120.465.4146.8-84.6-166.2170.100108.3A120M118-A120 PolarHBondContact O-N 3.1Å
119S32.3Very low33.7Very low101 Ų101130.7 Ų130.771%0.70676%0.761SS**  trans-70.4112.6165.945.60000108.7T121S119-T121 PolarHBondContact O-N 2.88Å
120A38.5Very low34.1Very low91 Ų91129.5 Ų129.575%0.75277%0.765SS**  trans-70.988.3-176.500000112.5M118M118-A120 PolarHBondContact O-N 3.1Å
121T38.3Very low34.7Very low140 Ų140126.9 Ų126.986%0.85976%0.761SS**  trans-145.699.7167-51.10000109.1S119S119-T121 PolarHBondContact O-N 2.88Å
122G36.2Very low35.2Very low77 Ų77128.7 Ų128.779%0.79477%0.769SS**  trans146.40.2174.800000118.1S124G122-S124 PolarHBondContact O-N 2.92Å
123M32.8Very low35.4Very low165 Ų165123.9 Ų123.981%0.81376%0.763SS**  trans-72.2113.4178.7-69.4-169.7-6800111.8
124S34Very low35.4Very low98 Ų98123 Ų12369%0.68577%0.765SS**  trans-72.3147.7169.8-173.80000111.3G122 A126 A127G122-S124 PolarHBondContact O-N 2.92Å; S124-A126 PolarHBondContact O-N 2.85Å; S124-A127 PolarHBondContact O-N 3.47Å
125A39.7Very low34.9Very low88 Ų88120.7 Ų120.773%0.72776%0.761SS**THydrogen-bonded Turntrans-65.7-7.6-161.400000116.6
126A36.2Very low34.8Very low81 Ų81120.4 Ų120.467%0.66977%0.767SS**THydrogen-bonded Turntrans-74.7-31.4-178.800000113.8S124 T128 A129S124-A126 PolarHBondContact O-N 2.85Å; A126-T128 VanDerWaalsContact C-N 3.25Å; A126-T128 PolarHBondContact O-N 2.82Å; A126-A129 PolarHBondContact O-N 2.87Å
127A35.1Very low35Very low77 Ų77115.3 Ų115.364%0.63676%0.764SS**THydrogen-bonded Turntrans-69.9-18.9-174.700000114S124S124-A127 PolarHBondContact O-N 3.47Å
128T38.5Very low35Very low104 Ų104113.8 Ų113.864%0.63877%0.766SS**THydrogen-bonded Turntrans-79.7-18.8-179.4-43.70000112.8A126A126-T128 VanDerWaalsContact C-N 3.25Å; A126-T128 PolarHBondContact O-N 2.82Å
129A31.8Very low35.9Very low77 Ų77107.8 Ų107.864%0.63674%0.74SS**G310 helixtrans-82.3-28.9-171.500000114.3A126 T131A126-A129 PolarHBondContact O-N 2.87Å; A129-T131 VanDerWaalsContact C-N 3.33Å; A129-T131 PolarHBondContact O-N 3.18Å
130A34.8Very low36.3Very low102 Ų102107.6 Ų107.684%0.84374%0.737SS**G310 helixtrans-843.2-173.300000115.2
131T38.5Very low36.8Very low113 Ų113109.3 Ų109.369%0.69373%0.725SS**G310 helixtrans-11115.1177.1-170.80000113.7A129A129-T131 VanDerWaalsContact C-N 3.33Å; A129-T131 PolarHBondContact O-N 3.18Å
132L35.7Very low37.2Very low156 Ų156109.4 Ų109.482%0.81772%0.715SS**SBendtrans-125.632.7-172.8-142.878000115.1
133A34.2Very low37.6Very low91 Ų91111.4 Ų111.475%0.75270%0.704SS**  trans-152.663169.800000112.7
134L30.6Very low38.2Very low158 Ų158108 Ų10883%0.82769%0.688SS**  trans-129.4132165.5-71.5172.6000109.6
135P28Very low38.6Very low114 Ų114109.1 Ų109.174%0.7469%0.685SS**  trans-68.3153.2-179.128.3-34.2000111.6G137P135-G137 PolarHBondContact O-N 2.97Å; P135-G137 VanDerWaalsContact O-N 3.13Å
136T37.2Very low39Very low151 Ų151107.5 Ų107.593%0.92667%0.666SS**THydrogen-bonded Turntrans-54.9113.3176.948.70000111.7
137G38.5Very low39Very low77 Ų77109.6 Ų109.679%0.79468%0.676SS**THydrogen-bonded Turntrans174.6-27.1174.200000117.9P135P135-G137 PolarHBondContact O-N 2.97Å; P135-G137 VanDerWaalsContact O-N 3.13Å
138V34.8Very low39.1Very low130 Ų130113.9 Ų113.979%0.78868%0.683SS**  trans-129.4125.7-175.4-67.70000112.5
139T47.3Very low39.2Very low73 Ų73111.5 Ų111.545%0.44868%0.68SS.*  trans-89.1131.7165.145.20000108.2Y141T139-Y141 PolarHBondContact O-N 3.16Å; T139-Y141 VanDerWaalsContact O-N 3.11Å
140P40.8Very low39.9Very low97 Ų97112.3 Ų112.363%0.6367%0.67SS**  trans-69.1111.5173.127.9-32.1000108.8
141Y49.6Very low40.6Very low127 Ų127111 Ų11150%0.49865%0.648SS.*EExtended strand (participates in β ladder)trans-82.5124.8166.1-100.7-92.7000108.7T139 Q153 V155T139-Y141 PolarHBondContact O-N 3.16Å; T139-Y141 VanDerWaalsContact O-N 3.11Å; Y141-Q153 HydrophobicContact CD1-CB 4.03Å; Y141-Q153 HydrophobicContact CD1-CG 4.06Å; Y141-Q153 HydrophobicContact CE1-CB 3.88Å; Y141-Q153 HydrophobicContact CE1-CG 4.06Å; Y141-Q153 VanDerWaalsContact CE1-NE2 3.33Å; Y141-V155 HydrophobicContact CD1-CG2 4.03Å; Y141-V155 HydrophobicContact CE1-CG2 3.43Å; Y141-V155 VanDerWaalsContact CE1-CG2 3.43Å; Y141-V155 HydrophobicContact CE2-CG2 4.07Å; Y141-V155 VanDerWaalsContact CZ-CG2 3.46Å
142Q46.7Very low41.1Very low141 Ų141107.2 Ų107.266%0.65962%0.624SS**EExtended strand (participates in β ladder)trans-115.9128.2167.9-167.8147.56800109.3L144 V154Q142-L144 HydrophobicContact CG-CD1 4.16Å; Q142-V154 PolarHBondContact N-O 3.25Å; Q142-V154 PolarHBondContact O-N 3.4Å
143Q44Very low41.9Very low119 Ų119101.8 Ų101.856%0.55659%0.594SS**EExtended strand (participates in β ladder)trans-105.8119.3-176.9-170.7168.365.700108.5I151 L152Q143-I151 VanDerWaalsContact CD-CG2 3.46Å; Q143-I151 HydrophobicContact CG-CG2 3.42Å; Q143-I151 VanDerWaalsContact CG-CG2 3.42Å; Q143-I151 VanDerWaalsContact NE2-CG2 3.28Å; Q143-L152 WeakPolarHBondContact CA-O 3.42Å
144L46.3Very low42.8Very low93 Ų9398.7 Ų98.749%0.48757%0.566SS.*EExtended strand (participates in β ladder)trans-106.8135176.3-74.587.8000109.5Q142 L152 V154Q142-L144 HydrophobicContact CG-CD1 4.16Å; L144-L152 PolarHBondContact N-O 3.19Å; L144-L152 PolarHBondContact O-N 3.36Å; L144-V154 HydrophobicContact CD1-CB 4.43Å; L144-V154 HydrophobicContact CD1-CG2 3.64Å
145I42Very low43.8Very low122 Ų12292.2 Ų92.263%0.62653%0.533SS*.EExtended strand (participates in β ladder)trans-102.3120.4170.5-65.3173.4000106.9Q150 I151I145-Q150 WeakPolarHBondContact CA-O 3.06Å; I145-I151 HydrophobicContact CG1-CG1 4.36Å
146T49.3Very low44.7Very low54 Ų5493.4 Ų93.433%0.33152%0.522SS..  trans-76.4161.7172.2-179.10000110.6Q148 G149 Q150 L152T146-Q148 HydrophobicContact CG2-CB 4.16Å; T146-Q148 PolarHBondContact O-N 3.43Å; T146-G149 PolarHBondContact O-N 3.34Å; T146-Q150 HydrophobicContact CG2-CB 3.55Å; T146-Q150 PolarHBondContact N-O 3.33Å; T146-L152 HydrophobicContact CG2-CD1 4.06Å
147S34.6Very low45.3Very low125 Ų12587.2 Ų87.287%0.87449%0.486SS*.THydrogen-bonded Turntrans-57.5-15.5177.953.40000114.5
148Q38.7Very low45.4Very low167 Ų16790.1 Ų90.178%0.7849%0.492SS*.THydrogen-bonded Turntrans-90.98.1173-64-77.310.400113.9T146 Q150T146-Q148 HydrophobicContact CG2-CB 4.16Å; T146-Q148 PolarHBondContact O-N 3.43Å; Q148-Q150 VanDerWaalsContact C-N 3.26Å; Q148-Q150 PolarHBondContact O-N 3.35Å
149G40.4Very low46.1Very low55 Ų5589.2 Ų89.257%0.56748%0.482SS*.SBendtrans74.63.4179.100000115.9T146T146-G149 PolarHBondContact O-N 3.34Å
150Q46.6Very low46.1Very low94 Ų9488.1 Ų88.144%0.43949%0.485SS..  trans-72.4136.9172.6-88.4179.8-2400111.2I145 T146 Q148 L152I145-Q150 WeakPolarHBondContact CA-O 3.06Å; T146-Q150 HydrophobicContact CG2-CB 3.55Å; T146-Q150 PolarHBondContact N-O 3.33Å; Q148-Q150 VanDerWaalsContact C-N 3.26Å; Q148-Q150 PolarHBondContact O-N 3.35Å; Q150-L152 HydrophobicContact CB-CD1 4.42Å
151I48.4Very low46.3Very low73 Ų7386.3 Ų86.337%0.37447%0.472SS..EExtended strand (participates in β ladder)trans-94.5121.7176.8-56.4178.3000108.9Q143 I145Q143-I151 VanDerWaalsContact CD-CG2 3.46Å; Q143-I151 HydrophobicContact CG-CG2 3.42Å; Q143-I151 VanDerWaalsContact CG-CG2 3.42Å; Q143-I151 VanDerWaalsContact NE2-CG2 3.28Å; I145-I151 HydrophobicContact CG1-CG1 4.36Å
152L49.8Very low46Very low35 Ų3584.4 Ų84.418%0.18347%0.468CS..EExtended strand (participates in β ladder)trans-115.4128.7174.9-59.296.1000109.5Q143 L144 T146 Q150 I164 I165Q143-L152 WeakPolarHBondContact CA-O 3.42Å; L144-L152 PolarHBondContact N-O 3.19Å; L144-L152 PolarHBondContact O-N 3.36Å; T146-L152 HydrophobicContact CG2-CD1 4.06Å; Q150-L152 HydrophobicContact CB-CD1 4.42Å; L152-I164 HydrophobicContact CB-CG2 4.13Å; L152-I164 HydrophobicContact CD2-CG2 3.55Å; L152-I164 HydrophobicContact CG-CG2 4.45Å; L152-I165 WeakPolarHBondContact CA-O 3.34Å
153Q51.3Low46.2Very low42 Ų4283 Ų8320%0.19646%0.457CS..EExtended strand (participates in β ladder)trans-94.5127.9171.8-75.4177.8-58.300109.8Y141 I165Y141-Q153 HydrophobicContact CD1-CB 4.03Å; Y141-Q153 HydrophobicContact CD1-CG 4.06Å; Y141-Q153 HydrophobicContact CE1-CB 3.88Å; Y141-Q153 HydrophobicContact CE1-CG 4.06Å; Y141-Q153 VanDerWaalsContact CE1-NE2 3.33Å; Q153-I165 HydrophobicContact CB-CB 4.34Å; Q153-I165 PolarHBondContact N-O 3.48Å; Q153-I165 PolarHBondContact O-N 2.71Å
154V53.3Low46.3Very low26 Ų2683.1 Ų83.116%0.15846%0.461CS..EExtended strand (participates in β ladder)trans-104.1122173.2-176.40000108.9Q142 L144 Q162 Y163 I164Q142-V154 PolarHBondContact N-O 3.25Å; Q142-V154 PolarHBondContact O-N 3.4Å; L144-V154 HydrophobicContact CD1-CB 4.43Å; L144-V154 HydrophobicContact CD1-CG2 3.64Å; V154-Q162 HydrophobicContact CG1-CB 4.37Å; V154-Y163 WeakPolarHBondContact CA-O 3.47Å; V154-I164 HydrophobicContact CG2-CG1 4.36Å
155V51.4Low46.6Very low22 Ų2281.5 Ų81.513%0.13345%0.452CS..EExtended strand (participates in β ladder)trans-115.7119.4179.8-176.70000109.2Y141 Y163 I165Y141-V155 HydrophobicContact CD1-CG2 4.03Å; Y141-V155 HydrophobicContact CE1-CG2 3.43Å; Y141-V155 VanDerWaalsContact CE1-CG2 3.43Å; Y141-V155 HydrophobicContact CE2-CG2 4.07Å; Y141-V155 VanDerWaalsContact CZ-CG2 3.46Å; V155-Y163 PolarHBondContact N-O 3.37Å; V155-Y163 PolarHBondContact O-N 2.83Å; V155-I165 HydrophobicContact CG2-CD1 3.95Å
156R47.2Very low46.7Very low138 Ų13880.1 Ų80.152%0.52144%0.443SS..EExtended strand (participates in β ladder)trans-86.9116.9171.5-169.9174.2-75-167.1-2.4109.9
157A50.5Low46.6Very low21 Ų2182.2 Ų82.217%0.17445%0.449CS..  trans-77.8159.4171.900000111.6N159 G160 T161 Y163A157-N159 WeakPolarHBondContact CB-OD1 2.97Å; A157-N159 PolarHBondContact O-N 2.81Å; A157-G160 PolarHBondContact O-N 2.88Å; A157-T161 PolarHBondContact N-O 2.89Å; A157-Y163 HydrophobicContact CB-CD2 4.28Å; A157-Y163 HydrophobicContact CB-CE2 3.72Å
158P40.9Very low47Very low139 Ų13980.8 Ų80.890%0.90344%0.439SS*.THydrogen-bonded Turntrans-61.2-14.7-177-25.135.3000115.4G160P158-G160 VanDerWaalsContact C-N 3.33Å
159N48.1Very low47Very low111 Ų11180.9 Ų80.959%0.59444%0.44SS*.THydrogen-bonded Turntrans-87.84.6174.665.6-10.1000113.5A157 T161A157-N159 WeakPolarHBondContact CB-OD1 2.97Å; A157-N159 PolarHBondContact O-N 2.81Å; N159-T161 VanDerWaalsContact C-N 3.3Å; N159-T161 PolarHBondContact ND2-OG1 2.83Å; N159-T161 VanDerWaalsContact ND2-OG1 3.1Å; N159-T161 PolarHBondContact O-N 3.11Å; N159-T161 WeakPolarHBondContact OD1-CB 3.25Å; N159-T161 PolarHBondContact OD1-N 2.93Å; N159-T161 PolarHBondContact OD1-OG1 2.9Å
160G47.2Very low46.7Very low49 Ų4985.5 Ų85.551%0.50545%0.446SS..SBendtrans82.7-5-177.200000115A157 P158A157-G160 PolarHBondContact O-N 2.88Å; P158-G160 VanDerWaalsContact C-N 3.33Å
161T46.5Very low45.9Very low59 Ų5986.3 Ų86.336%0.36246%0.46SS..  trans-70.9132.8177.2-51.40000110.8A157 N159 Y163A157-T161 PolarHBondContact N-O 2.89Å; N159-T161 VanDerWaalsContact C-N 3.3Å; N159-T161 PolarHBondContact ND2-OG1 2.83Å; N159-T161 VanDerWaalsContact ND2-OG1 3.1Å; N159-T161 PolarHBondContact O-N 3.11Å; N159-T161 WeakPolarHBondContact OD1-CB 3.25Å; N159-T161 PolarHBondContact OD1-N 2.93Å; N159-T161 PolarHBondContact OD1-OG1 2.9Å; T161-Y163 HydrophobicContact CG2-CE1 4.35Å; T161-Y163 HydrophobicContact CG2-CE2 3.87Å
162Q42.4Very low45.3Very low88 Ų8889.8 Ų89.841%0.41148%0.477SS..EExtended strand (participates in β ladder)trans-95.8132.2174.8-64.6-76.437.700110.3V154V154-Q162 HydrophobicContact CG1-CB 4.37Å
163Y50.7Low44.5Very low110 Ų11093.7 Ų93.743%0.43150%0.503SS..EExtended strand (participates in β ladder)trans-114.5134.1173.2-62.4-87.3000110.1V154 V155 A157 T161V154-Y163 WeakPolarHBondContact CA-O 3.47Å; V155-Y163 PolarHBondContact N-O 3.37Å; V155-Y163 PolarHBondContact O-N 2.83Å; A157-Y163 HydrophobicContact CB-CD2 4.28Å; A157-Y163 HydrophobicContact CB-CE2 3.72Å; T161-Y163 HydrophobicContact CG2-CE1 4.35Å; T161-Y163 HydrophobicContact CG2-CE2 3.87Å
164I47.8Very low43.7Very low122 Ų12298.5 Ų98.563%0.62653%0.529SS*.EExtended strand (participates in β ladder)trans-105.4118.4177.1-57.1174.9000108.3L152 V154L152-I164 HydrophobicContact CB-CG2 4.13Å; L152-I164 HydrophobicContact CD2-CG2 3.55Å; L152-I164 HydrophobicContact CG-CG2 4.45Å; V154-I164 HydrophobicContact CG2-CG1 4.36Å
165I50.6Low42.8Very low60 Ų60106 Ų10631%0.30856%0.563SS.*EExtended strand (participates in β ladder)trans-110.1116.7179.6-54.7171.4000108.1L152 Q153 V155L152-I165 WeakPolarHBondContact CA-O 3.34Å; Q153-I165 HydrophobicContact CB-CB 4.34Å; Q153-I165 PolarHBondContact N-O 3.48Å; Q153-I165 PolarHBondContact O-N 2.71Å; V155-I165 HydrophobicContact CG2-CD1 3.95Å
166Q45.6Very low42.2Very low92 Ų92112.4 Ų112.443%0.4359%0.591SS.*EExtended strand (participates in β ladder)trans-95.6118.6172.9-178.2160.697.900109.5S168Q166-S168 PolarHBondContact O-N 3.24Å
167Q46.9Very low41.6Very low99 Ų99111.4 Ų111.446%0.46360%0.602SS.*  trans-78105.6173.9-74.9-168.89.400110.4Q169Q167-Q169 PolarHBondContact O-N 3.33Å
168S42.8Very low40.8Very low95 Ų95119.5 Ų119.566%0.66464%0.639SS**  trans-78.397.5166.842.50000110.5Q166 Q170Q166-S168 PolarHBondContact O-N 3.24Å; S168-Q170 PolarHBondContact O-N 3.01Å
169Q39.1Very low40.8Very low169 Ų169121.6 Ų121.679%0.7964%0.637SS**  trans-72.564.8171.4-74.5-84.164.800111.3Q167Q167-Q169 PolarHBondContact O-N 3.33Å
170Q33.8Very low40.2Very low151 Ų151122.8 Ų122.871%0.70665%0.65SS**  trans-130.2108.1175.7-75.3-70.7-13.100109.2S168 I172S168-Q170 PolarHBondContact O-N 3.01Å; Q170-I172 PolarHBondContact O-N 3.37Å
171P30.6Very low40.1Very low112 Ų112124.5 Ų124.573%0.72767%0.668SS**  trans-72.796.2175.729.4-32.8000110V173P171-V173 WeakPolarHBondContact O-CG2 3.46Å; P171-V173 PolarHBondContact O-N 2.92Å
172I35.1Very low39.7Very low145 Ų145125.1 Ų125.174%0.74469%0.686SS**  trans-71.395.4168.7-74.3172.4000108.6Q170 L174Q170-I172 PolarHBondContact O-N 3.37Å; I172-L174 HydrophobicContact CG2-CD1 4.06Å; I172-L174 HydrophobicContact CG2-CG 4.31Å; I172-L174 PolarHBondContact O-N 3Å
173V33.8Very low39.3Very low118 Ų118128.5 Ų128.572%0.71571%0.713SS**  trans-81.389.4170.7-1310000108.7P171 Q175P171-V173 WeakPolarHBondContact O-CG2 3.46Å; P171-V173 PolarHBondContact O-N 2.92Å; V173-Q175 VanDerWaalsContact C-N 3.34Å; V173-Q175 PolarHBondContact O-N 3.44Å
174L34Very low38.4Very low143 Ų143131.8 Ų131.875%0.74973%0.732SS**  trans-7092167.7-101.4144.6000109.1I172 Q176I172-L174 HydrophobicContact CG2-CD1 4.06Å; I172-L174 HydrophobicContact CG2-CG 4.31Å; I172-L174 PolarHBondContact O-N 3Å; L174-Q176 VanDerWaalsContact C-N 3.33Å; L174-Q176 PolarHBondContact O-N 3.06Å
175Q34.1Very low37.6Very low184 Ų184129.9 Ų129.986%0.8673%0.734SS**  trans-68.191.7168.9-79.6172.868.500109.5V173V173-Q175 VanDerWaalsContact C-N 3.34Å; V173-Q175 PolarHBondContact O-N 3.44Å
176Q39.3Very low36.8Very low155 Ų155133 Ų13372%0.72476%0.758SS**PPolyproline II helixtrans-83.4131170.8-161.7153.490.200108.8L174L174-Q176 VanDerWaalsContact C-N 3.33Å; L174-Q176 PolarHBondContact O-N 3.06Å
177P34.7Very low36.2Very low118 Ų118133.7 Ų133.777%0.76677%0.769SS**PPolyproline II helixtrans-63.8139.1-174.923.8-33.4000111.9Q179P177-Q179 PolarHBondContact O-N 3.24Å
178M32.8Very low35.7Very low191 Ų191136.2 Ų136.294%0.94178%0.783SS**PPolyproline II helixtrans-50.6134.1-177.3-75.6179.517000113.2
179Q42Very low35.1Very low183 Ų183138.6 Ų138.686%0.85578%0.784SS**  trans-104.9139.3147.4-70-145-13.800110P177 G181P177-Q179 PolarHBondContact O-N 3.24Å; Q179-G181 PolarHBondContact O-N 2.84Å
180P34.2Very low34.6Very low136 Ų136137.3 Ų137.388%0.88378%0.778SS**SBendtrans-79109.9-179.630.9-32.5000110.8
181G46.4Very low34.5Very low84 Ų84136 Ų13687%0.86678%0.78SS**SBendtrans117.174167.400000115.2Q179Q179-G181 PolarHBondContact O-N 2.84Å
182G36.4Very low34.6Very low73 Ų73137.4 Ų137.475%0.75378%0.781SS**  trans176.3130.1168.600000111.4
183V33.7Very low34.3Very low159 Ų159134.4 Ų134.496%0.96478%0.778SS**  trans-79.8121.9169.1-73.60000108.7
184Q32.3Very low34.1Very low179 Ų179134.7 Ų134.784%0.83678%0.782SS**  trans-128.2124.4-179.1-154.4175.317.200109.6
185A31.2Very low34.3Very low81 Ų81136.2 Ų136.267%0.66979%0.79SS**PPolyproline II helixtrans-79.4150.3174.600000110.6V187A185-V187 PolarHBondContact O-N 3.24Å
186P34.5Very low34.1Very low125 Ų125137.1 Ų137.181%0.81279%0.794SS**PPolyproline II helixtrans-67.4122.5178.327.3-34000111.4
187V33.1Very low33.7Very low108 Ų108133.1 Ų133.166%0.65580%0.795SS**PPolyproline II helixtrans-91.1117167.51660000108.9A185 Q189A185-V187 PolarHBondContact O-N 3.24Å; V187-Q189 PolarHBondContact O-N 2.9Å
188I35.8Very low33.4Very low151 Ų151131.3 Ų131.377%0.77480%0.797SS**  trans-85.3104.1168.8-59177.7000107.8Q190I188-Q190 PolarHBondContact O-N 2.93Å
189Q30.4Very low33.1Very low146 Ų146130.3 Ų130.368%0.68280%0.795SS**  trans-90.193176.8-162.586.689.200110.1V187 V191V187-Q189 PolarHBondContact O-N 2.9Å; Q189-V191 PolarHBondContact O-N 2.83Å
190Q29Very low32.6Very low142 Ų142126.5 Ų126.566%0.66479%0.788SS**  trans-81.4103.5176.5-160.3172.43600110.2I188I188-Q190 PolarHBondContact O-N 2.93Å
191V31.3Very low32.6Very low122 Ų122128.2 Ų128.274%0.73979%0.785SS**  trans-86.5114.9175.8169.40000109.7Q189Q189-V191 PolarHBondContact O-N 2.83Å
192L31.9Very low31.8Very low143 Ų143133.3 Ų133.375%0.74979%0.786SS**PPolyproline II helixtrans-81.6118.7165.6-102.565.6000109.4
193A29.1Very low31.5Very low82 Ų82136 Ų13668%0.67879%0.787SS**PPolyproline II helixtrans-89.6129.1167.800000109.8
194P30.4Very low31.2Very low124 Ų124131.4 Ų131.481%0.80577%0.773SS**PPolyproline II helixtrans-77.2125.8178.430.1-33.1000111.2
195L36.7Very low31Very low175 Ų175129 Ų12992%0.91677%0.77SS**PPolyproline II helixtrans-88.2124.6167.2-66.1174.9000109.2
196Q31.8Very low31Very low203 Ų203132.1 Ų132.195%0.94977%0.774SS**PPolyproline II helixtrans-85.3128.9175.7-84.2-154.723.600112.4
197G30.2Very low30.7Very low71 Ų71133 Ų13373%0.73277%0.77SS**  trans-146.7135.6155.300000107.6
198G27.8Very low30.4Very low79 Ų79135.4 Ų135.481%0.81478%0.775SS**SBendtrans-59.7155.6-170.400000114.1
199L26.7Very low30Very low170 Ų170133.9 Ų133.989%0.8977%0.774SS**  cis-138.3141.331.6-71.1148.6000113.9
200S31.1Very low30Very low104 Ų104134.1 Ų134.173%0.72778%0.776SS**  trans29.5113.8158.559.60000122.6
201Q34Very low30Very low172 Ų172135.9 Ų135.980%0.80478%0.784SS**  trans6897.9134-57.9-6494.500121
202Q31.1Very low30.1Very low191 Ų191136.3 Ų136.389%0.89378%0.78SS**  -168.2126116.8-98.3-77.89.700108.8
203T29.6Very low29.9Very low128 Ų128135.6 Ų135.679%0.78578%0.782SS**  trans-89.7118.8-170.3-52.10000111.1
204G26.3Very low30.1Very low64 Ų64138.6 Ų138.666%0.6679%0.786SS**  trans-139.6117.2172.900000111.6I206G204-I206 PolarHBondContact O-N 3.03Å
205V28.9Very low30.4Very low127 Ų127137 Ų13777%0.7778%0.782SS**  trans-82.7110.4171.7-178.50000108.3I207V205-I207 HydrophobicContact CG1-CG1 3.96Å; V205-I207 PolarHBondContact O-N 2.88Å
206I31.5Very low30.3Very low147 Ų147134.3 Ų134.375%0.75478%0.778SS**  trans-87.4103.8171.1-55.9178.9000108.1G204G204-I206 PolarHBondContact O-N 3.03Å
207I28.8Very low30.7Very low144 Ų144128.2 Ų128.274%0.73877%0.771SS**  trans-86.2113.6166.2-58.5-176.2000107.4V205V205-I207 HydrophobicContact CG1-CG1 3.96Å; V205-I207 PolarHBondContact O-N 2.88Å
208Q26.3Very low30.8Very low159 Ų159132.8 Ų132.874%0.74378%0.778SS**  trans-66.6139.6165.7-84.4-164.384.900109.9Q210Q208-Q210 PolarHBondContact O-N 3.43Å
209P27.2Very low31.4Very low118 Ų118138.8 Ų138.877%0.76678%0.782SS**  trans-64.8121.4168.328-32.6000109.4Q211P209-Q211 PolarHBondContact O-N 3.33Å; P209-Q211 VanDerWaalsContact O-N 3.16Å
210Q30.2Very low31.5Very low152 Ų152138 Ų13871%0.7178%0.783SS**  trans-67.1112.8173.8-70.5-177.4-18.500109.5Q208 I212Q208-Q210 PolarHBondContact O-N 3.43Å; Q210-I212 PolarHBondContact O-N 2.72Å
211Q29.1Very low31.5Very low179 Ų179142.3 Ų142.384%0.83679%0.792SS**  trans-79.1107.3174.7-166-179.794.200109.2P209 V213P209-Q211 PolarHBondContact O-N 3.33Å; P209-Q211 VanDerWaalsContact O-N 3.16Å; Q211-V213 PolarHBondContact O-N 3.26Å
212I32.8Very low31.5Very low130 Ų130137.6 Ų137.667%0.66779%0.79SS**  trans-80.6110177.8-57.1173.8000108.8Q210 L214Q210-I212 PolarHBondContact O-N 2.72Å; I212-L214 HydrophobicContact CG2-CD1 3.62Å; I212-L214 HydrophobicContact CG2-CG 3.87Å; I212-L214 PolarHBondContact O-N 3.25Å
213V29.4Very low31.4Very low128 Ų128136.8 Ų136.878%0.77679%0.792SS**  trans-85.6100.7168.9-1780000108.8Q211Q211-V213 PolarHBondContact O-N 3.26Å
214L32.4Very low31.4Very low146 Ų146136.7 Ų136.776%0.76479%0.791SS**  trans-93.2120.7167.4-76.6133.4000109.1I212I212-L214 HydrophobicContact CG2-CD1 3.62Å; I212-L214 HydrophobicContact CG2-CG 3.87Å; I212-L214 PolarHBondContact O-N 3.25Å
215A35.8Very low31.4Very low89 Ų89142.8 Ų142.874%0.73680%0.802SS**SBendtrans-71.7145.6168.200000110.5
216S34.4Very low31.3Very low119 Ų119142.7 Ų142.783%0.83280%0.802SS**SBendtrans82121.6-175.4-37.80000114.2
217G41.5Very low31.2Very low76 Ų76141.7 Ų141.778%0.78480%0.802SS**  trans-76.4132.9-169.800000114.7
218N32.4Very low31.1Very low167 Ų167143.8 Ų143.889%0.89381%0.809SS**  trans-162148.2135.9-108.63000110.1
219K39.4Very low31.2Very low204 Ų204142.8 Ų142.889%0.88781%0.814SS**  trans-84.3142.1-178.6-61.2-179.6179.5-178.40111.5
220V29.8Very low31.3Very low153 Ų153141.7 Ų141.793%0.92782%0.815SS**  trans-151.7154.9154.4-112.40000112.4
221Q31.4Very low31.2Very low196 Ų196141.5 Ų141.592%0.91682%0.824SS**  trans-77.6154.1-171.3-92.6157.9-8200114.4
222G34.2Very low31.2Very low73 Ų73142.1 Ų142.175%0.75383%0.829SS**  trans-85.5175.3178.700000114.7
223N28Very low31Very low173 Ų173142.4 Ų142.493%0.92584%0.837SS**  trans-151126.5164.5-124.5-1.6000109.3
224T30.4Very low30.9Very low126 Ų126145.7 Ų145.777%0.77384%0.844SS**  trans-101.4125.6180-56.50000109.3V226T224-V226 HydrophobicContact CG2-CG1 4.31Å
225Q25.9Very low30.6Very low192 Ų192147.2 Ų147.290%0.89785%0.847SS**  trans-110.8125.1160.9-78.9-165.72.300110.1
226V27.4Very low30.9Very low125 Ų125148.6 Ų148.676%0.75885%0.849SS**  trans-96.4134.7172.4-73.30000109.4T224T224-V226 HydrophobicContact CG2-CG1 4.31Å
227V28Very low30.6Very low127 Ų127146.7 Ų146.777%0.7785%0.848SS**  trans-127.1104.6163.6179.90000107.2
228Q27.6Very low30Very low188 Ų188152.6 Ų152.688%0.87986%0.855SS**  trans-85.5135.7168.3-73.8177.6-24.100109.1
229T28.2Very low29.9Very low138 Ų138149.8 Ų149.885%0.84785%0.854SS**  trans-122.1113.1163.2-29.70000107.7
230A28.6Very low29.4Very low95 Ų95144.7 Ų144.779%0.78585%0.851SS**  trans-103.4144.5-18000000110.8
231T29.5Very low29.3Very low147 Ų147146.2 Ų146.290%0.90285%0.85SS**  trans-130.4144.7160.733.60000110.5
232M28.3Very low29.1Very low192 Ų192140.8 Ų140.895%0.94684%0.838SS**  trans-77.4160.5-156.4-68.9-79-161.400115.6
233V28.9Very low28.8Very low136 Ų136141.9 Ų141.982%0.82484%0.84SS**  trans-80.9147.7173.81770000111.7
234Q25.9Very low28.8Very low197 Ų197138.1 Ų138.192%0.92183%0.834SS**  trans-151.7130.1149.6-125.3175.1-0.600114.7
235Q27.2Very low28.7Very low179 Ų179136.8 Ų136.884%0.83684%0.835SS**  trans-151.9172.8168.7-126.3-163.7-10.600105
236P42Very low28.8Very low118 Ų118132.2 Ų132.277%0.76683%0.831SS**  cis-132.6-168.9-5.639.9-21.2000113.3
237G27.9Very low28.8Very low79 Ų79131.4 Ų131.481%0.81484%0.837SS**  trans177.4124.6166.500000114.6
238Q29.5Very low28.6Very low200 Ų200129.2 Ų129.294%0.93584%0.84SS**  trans-91.1154.7179-59.4154-5700111.9
239A29.2Very low28.6Very low107 Ų107124.1 Ų124.188%0.88484%0.838SS**  trans-168.9154.2139.800000111.6
240A28.8Very low28.6Very low98 Ų98122.3 Ų122.381%0.8184%0.837SS**  trans-119.3177.6172.900000110.7
241M28.1Very low28.6Very low184 Ų184122.3 Ų122.391%0.90684%0.837SS**  trans96.4119.7154.6-156.9165.7-167.100119.9
242A28.2Very low28.6Very low82 Ų82120.1 Ų120.168%0.67883%0.834SS**  trans60.9119.8141.300000123.7
243A27.1Very low28.7Very low96 Ų96115.5 Ų115.579%0.79383%0.826SS**  78132.5118.900000123.2
244A28.6Very low28.9Very low95 Ų95113.6 Ų113.679%0.78583%0.825SS**  trans81.8113.2140.100000121.5
245A27.9Very low29Very low97 Ų97108.4 Ų108.480%0.80282%0.815SS**  81.3112.5126.900000121.8
246A27.7Very low29.3Very low97 Ų97108.9 Ų108.980%0.80282%0.817SS**  93131.6122.800000121.9
247A27.1Very low28.8Very low107 Ų107108.8 Ų108.888%0.88482%0.815SS**  trans75.9118.4145.800000121
248G25.3Very low28.9Very low81 Ų81112.9 Ų112.984%0.83581%0.812SS**  132.293119.400000118.6
249G27.6Very low29.2Very low82 Ų82110 Ų11085%0.84580%0.799SS**  trans69.5161.3155.400000118.3
250A27.5Very low29.2Very low99 Ų99111.2 Ų111.282%0.81880%0.795SS**  cis178.6154.8-1900000107.3
251A28.9Very low29.4Very low95 Ų95114.5 Ų114.579%0.78579%0.794SS**  trans78.4114.3160.500000121.3
252A29.2Very low29.6Very low102 Ų102113.7 Ų113.784%0.84379%0.788SS**  69.4141.2128.200000120.4
253A30.7Very low29.8Very low94 Ų94114.8 Ų114.878%0.77780%0.797SS**  cis-162.2170-2.700000112.4
254A32.1Very low30Very low97 Ų97119.6 Ų119.680%0.80280%0.803SS**  trans64.5123.1164.900000117.9
255A28.2Very low30.1Very low87 Ų87119 Ų11972%0.71981%0.806SS**  cis104.1106.421.200000115
256Q33.8Very low30.4Very low189 Ų189119.3 Ų119.388%0.88381%0.809SS**  trans164.5111.9153.5-94.3169.222.600105.1
257V30.8Very low30.5Very low117 Ų117119.6 Ų119.671%0.70981%0.811SS**  cis58.7130.537.6-155.70000110.8
258Q31.1Very low31Very low164 Ų164119 Ų11977%0.76681%0.806SS**  cis-124.3-1778.7-141.8115.85.400108.5
259Q34.4Very low32Very low141 Ų141121.2 Ų121.266%0.65981%0.806SS**  cis-154.21713.4-167.6157.7-33.700109.7
260V29.7Very low32.4Very low132 Ų132126.5 Ų126.580%0.881%0.808SS**  trans-133.8145.2164.7-162.90000107.7
261Q32.8Very low32.7Very low167 Ų167126 Ų12678%0.7881%0.805SS**  trans-128113.1172.3-165.989.342.200110.4
262Q33.4Very low33Very low167 Ų167131 Ų13178%0.7881%0.811SS**  trans-90.4154.1165.8-68.3171.7-24.800110
263A32.4Very low33.5Very low105 Ų105134.6 Ų134.687%0.86881%0.811SS**  trans-148.9126.5148.400000109.7
264Q31.2Very low34Very low196 Ų196139.5 Ų139.592%0.91682%0.818SS**  trans-89.9157.4171.5-63.6162.6-63.500109.7
265G30.6Very low34.1Very low82 Ų82139.9 Ų139.985%0.84581%0.814SS**  trans-174.7101.6169.900000112
266A33Very low34.8Very low105 Ų105144.9 Ų144.987%0.86882%0.823SS**  trans-102.1143.4176.300000110.9
267A31.1Very low35.6Very low103 Ų103141 Ų14185%0.85181%0.814SS**  trans176.7133.3140.600000111.8
268A37.3Very low36Very low94 Ų94142.9 Ų142.978%0.77782%0.815SS**  trans-113.8153.6148.100000107.2
269P46.5Very low36.8Very low127 Ų127140.2 Ų140.283%0.82581%0.812SS**  -145.6-172.5107.235.9-17.9000115
270Q35.2Very low37Very low194 Ų194140.5 Ų140.591%0.90781%0.813SS**  trans-85.5176.2-158.8-57.1159.3-69.400116.7
271A33.6Very low37.5Very low89 Ų89139.1 Ų139.174%0.73682%0.816SS**  trans118.3143.6160.900000112.4
272Q36.8Very low37.9Very low199 Ų199137.9 Ų137.993%0.9381%0.81SS**  cis-152.5-179.610.8-144.3163.8-18.900112.1
273Q39Very low38.2Very low178 Ų178136.5 Ų136.583%0.83280%0.804SS**  trans-110.6140.6-166.3169.8-172.467.700111.4
274Q40.1Very low38.9Very low197 Ų197136.9 Ų136.992%0.92180%0.798SS**  trans-158.3156156.1-126.3171.910.800114.3
275S35.9Very low40.2Very low104 Ų104132.5 Ų132.573%0.72779%0.786SS**  trans-150.9153.7-168.747.90000110.4
276Q40.9Very low40.9Very low192 Ų192136.9 Ų136.990%0.89779%0.786SS**  trans179.5163138.8-99.9-171.1-10.400113.3
277P51Low41.4Very low109 Ų109139.6 Ų139.671%0.70878%0.783SS**  trans-133.3-154.7-160.645.3-27.7000115.9
278Q39Very low42.1Very low155 Ų155142 Ų14272%0.72478%0.781SS**  trans85.1160.1165.9-86.8-175.6-60.200119.8
279P49.3Very low42.6Very low109 Ų109146.8 Ų146.871%0.70879%0.787SS**  cis-123.7146.9-13.624.5-2.7000113.8
280Q37.6Very low42.6Very low146 Ų146146.4 Ų146.468%0.68278%0.782SS**  66.3111.880.4-119.9179.2-1100117.2
281A41.6Very low42.6Very low104 Ų104145.2 Ų145.286%0.8678%0.782SS**  trans-141.1142150.500000107.9
282Q40.4Very low42.9Very low140 Ų140144.5 Ų144.565%0.65478%0.784SS**  trans-154155.3-160.5-154.5-172.560.800112.2
283Q38.9Very low43.4Very low139 Ų139140 Ų14065%0.6578%0.78SS**  trans82.3153.7164.5-52.7-62.3-16.500118.4
284P47Very low43.5Very low113 Ų113134.8 Ų134.873%0.73478%0.775SS**  cis-126.4165.3-11.637.5-22.5000115
285P59.2Low43.7Very low104 Ų104132.8 Ų132.868%0.67577%0.77SS**  trans-86.1-169158.538-34.1000111.4
286M45.2Very low43.8Very low173 Ų173133.7 Ų133.785%0.85277%0.771SS**  trans95.4132.6-173.5-55.1-81.6-80.300111.7
287M43.4Very low44.1Very low163 Ų163129.5 Ų129.580%0.80376%0.764SS**  cis-143.2160.316.9-64.5177-76.400112.3
288L46.8Very low43.8Very low153 Ų153130.2 Ų130.280%0.80177%0.771SS**  trans-67.1131.8169-174.974.4000111V290L288-V290 HydrophobicContact CD1-CG1 4.39Å; L288-V290 HydrophobicContact CD2-CG1 4.32Å; L288-V290 HydrophobicContact CG-CG1 4.22Å
289Q47.6Very low44Very low195 Ų195131 Ų13191%0.91178%0.775SS**  trans-128.5140.1154.6-82.8-174.877.100108.9
290V46Very low43.6Very low118 Ų118134.6 Ų134.672%0.71578%0.782SS**  trans-119157-176.6-740000109.2L288L288-V290 HydrophobicContact CD1-CG1 4.39Å; L288-V290 HydrophobicContact CD2-CG1 4.32Å; L288-V290 HydrophobicContact CG-CG1 4.22Å
291D36.2Very low43.9Very low170 Ų170135.2 Ų135.291%0.90979%0.79SS**  trans81.2146.6159.5-151.18.7000118.1
292G39.9Very low44.2Very low74 Ų74139.6 Ų139.676%0.76379%0.793SS**  trans139.978.6-174.400000113.6
293A47.3Very low44.4Very low103 Ų103140.5 Ų140.585%0.85180%0.802SS**  trans-87.3164171.100000112.8
294G41.1Very low44.8Very low70 Ų70143.3 Ų143.372%0.72282%0.815SS**  trans108.2107.5-176.900000110.2
295D42.8Very low44.6Very low154 Ų154146.8 Ų146.882%0.82482%0.821SS**  69.6143.852.9-160.320.7000113.6
296T39.6Very low43.7Very low123 Ų123151.3 Ų151.376%0.75583%0.834SS**  trans69109.7-179.576.10000116.9
297S45.6Very low43.6Very low105 Ų105149.5 Ų149.573%0.73482%0.823SS**  -166137.390.6-1580000110.8
298S46Very low43.4Very low123 Ų123150.4 Ų150.486%0.8682%0.819SS**  trans-135.1126.8175.5-179.10000107.1
299E42.3Very low43.3Very low172 Ų172150 Ų15080%0.80482%0.818SS**  trans-142.4138.2174.8-60176.611700104
300E40.9Very low43.2Very low184 Ų184149.9 Ų149.986%0.8682%0.817SS**  cis-139142.116.6-59.8159.7132.900108.8
301D44.5Very low43.5Very low160 Ų160152 Ų15286%0.85682%0.824SS**  trans-131.3138.2160.3-104.5-39.4000106.9
302E47.4Very low44.2Very low196 Ų196152.5 Ų152.592%0.91682%0.821SS**  trans-97.1104.6-176.6-67.4-179.7144.300109.8
303D45Very low44.7Very low159 Ų159158.4 Ų158.485%0.8583%0.829SS**  trans-77.9127.6174.8-67.9-45.8000111.1
304E46.3Very low44.8Very low198 Ų198161.7 Ų161.793%0.92583%0.827SS**  trans-103.6111.3177.8-160.6165-144.200109.3
305E43.2Very low45.2Very low185 Ų185166.6 Ų166.686%0.86483%0.831SS**  trans-78122.2-174.4-62.2175.316600112.2
306E41.4Very low45.6Very low199 Ų199168.7 Ų168.793%0.9383%0.832SS**  trans-122.3127.1158-73.3-163.1171.700109.8
307E41.6Very low46.2Very low136 Ų136170 Ų17064%0.63684%0.835SS**  trans-135.7147.6-171.2-156.9-177.6-166.200110.9
308Y40.5Very low46.5Very low181 Ų181174.5 Ų174.571%0.7184%0.841SS**  trans71.7151.5175.3-43.4-72000116.5
309D43.9Very low46.3Very low146 Ų146176.5 Ų176.578%0.78184%0.842SS**  cis-124.7152.615.3-79.6-62.5000114
310E45.8Very low46.3Very low192 Ų192171.7 Ų171.790%0.89784%0.839SS**  trans-113.289.4174.4-175.9172.1-135.600109
311D51.8Low46.3Very low161 Ų161166.3 Ų166.386%0.86183%0.833SS**  trans-92102.1178-85.7-31000111.4
312E50.5Low46.1Very low181 Ų181167.2 Ų167.285%0.84683%0.832SS**  trans-95.8110.8172.9-178179.5-134.400110.1
313E50.9Low46Very low199 Ų199165.2 Ų165.293%0.9383%0.828SS**  trans-135.4144.9163.7-81.7-158.4168.200112.8
314E48.6Very low45.9Very low172 Ų172161.1 Ų161.180%0.80482%0.823SS**  trans-89.4160.9-157.4-66.2179.813800116.6
315E50.1Low45.6Very low172 Ų172160.3 Ų160.380%0.80482%0.82SS**  trans48.3125.2147.6-73.6-166.6-179.200122
316K51.4Low45.7Very low198 Ų198157.3 Ų157.386%0.86181%0.814SS**  trans-151.898.9137.2-159.9175.1-172.8173.90114.2
317D51.6Low46.4Very low151 Ų151157 Ų15781%0.80781%0.812SS**  trans-60.5135.8163.9-88.8-32.3000111.9
318K51.7Low47.1Very low200 Ų200159.5 Ų159.587%0.8782%0.824SS**  trans-153.9124.4149-132.6-174.4178.8-163.90114.1
319D42.4Very low47.7Very low164 Ų164159 Ų15988%0.87783%0.828SS**  trans-77.7145.9-175175.539.8000115
320G42Very low48.4Very low71 Ų71156.7 Ų156.773%0.73282%0.821SS**  trans88.1121136.400000121.7
321G41.6Very low48.7Very low72 Ų72156.4 Ų156.474%0.74282%0.824SS**  trans139124.8140.400000119.1
322E40.7Very low49Very low178 Ų178153.8 Ų153.883%0.83281%0.81SS**  trans50.9101.4147.1-78.2172.9137.100118.9
323D44.3Very low48.9Very low155 Ų155150.3 Ų150.383%0.82981%0.806SS**  87.1133.47395.3-40.4000115.7
324G43Very low49.3Very low73 Ų73148.3 Ų148.375%0.75380%0.797SS**  trans154.776.8-173.500000116.7
325Q40Very low49.9Very low181 Ų181145.7 Ų145.785%0.84679%0.788SS**  trans17.9105.1143.9-89.4179.9-12.200119.9
326V46.7Very low50.5Low122 Ų122145.2 Ų145.274%0.73979%0.791SS**  76.7123.797.5-56.60000118.4
327E54.5Low50.9Low191 Ų191141 Ų14189%0.89378%0.782SS**  trans59.564.4146.4-63.8-174.6-176.100120.2
328E56.7Low51.3Low190 Ų190138.7 Ų138.789%0.88878%0.777SS**  trans-135.7119.4151-62.5-177.5175.800106.4
329E54.5Low51.8Low170 Ų170138 Ų13879%0.79478%0.778SS**  cis-135.4153.76.2-62.4177.8128.200110.1
330P57Low52.4Low97 Ų97136.7 Ų136.763%0.6377%0.77SS**  trans-67.2137.6178.728-34.7000111.7N332P330-N332 HydrophobicContact CB-CB 4.5Å; P330-N332 PolarHBondContact O-N 3.3Å
331L53.3Low53.2Low186 Ų186141.2 Ų141.297%0.97477%0.772SS**THydrogen-bonded Turntrans-70.341172.1-64.1170.7000112.6
332N56.7Low53.9Low106 Ų106142.8 Ų142.857%0.56776%0.764SS**THydrogen-bonded Turntrans-144.519.6-171.5-145.594.8000112.9P330 D335P330-N332 HydrophobicContact CB-CB 4.5Å; P330-N332 PolarHBondContact O-N 3.3Å; N332-D335 PolarHBondContact ND2-OD2 3.13Å; N332-D335 PolarHBondContact OD1-OD2 2.84Å
333S50Low54.5Low108 Ų108142 Ų14276%0.75576%0.76SS**SBendtrans-94-2.8170.751.70000113.4
334E59.6Low55.1Low158 Ų158142.6 Ų142.674%0.73876%0.758SS**SBendtrans-12316.6178.4-150.8159.699.500111.3D336 V337E334-D336 PolarHBondContact O-N 3.35Å; E334-D336 VanDerWaalsContact O-N 3.1Å; E334-V337 HydrophobicContact CG-CG1 4.12Å
335D60.2Low55.7Low116 Ų116145.1 Ų145.162%0.6275%0.753SS**THydrogen-bonded Turntrans-85.255.2178.9-172.536.5000111.2N332N332-D335 PolarHBondContact ND2-OD2 3.13Å; N332-D335 PolarHBondContact OD1-OD2 2.84Å
336D62.4Low56.2Low162 Ų162145 Ų14587%0.86675%0.751SS**THydrogen-bonded Turntrans-158.725.5177.4-117.7-15.6000111.5E334E334-D336 PolarHBondContact O-N 3.35Å; E334-D336 VanDerWaalsContact O-N 3.1Å
337V59.2Low56.7Low110 Ų110146.9 Ų146.967%0.66776%0.757SS**  trans-108.29.3-174.4-58.90000115E334 E339E334-V337 HydrophobicContact CG-CG1 4.12Å; V337-E339 VanDerWaalsContact C-N 3.34Å; V337-E339 PolarHBondContact O-N 2.98Å; V337-E339 VanDerWaalsContact O-N 3.12Å
338S61.6Low57.1Low102 Ų102141.7 Ų141.771%0.71374%0.738SS**  trans-80.580.9166.958.70000109.9D340S338-D340 PolarHBondContact O-N 2.99Å
339E60.8Low57.9Low187 Ų187138.6 Ų138.687%0.87472%0.723SS**  trans-64.7102.2170.1-69.1-170.4152.900109.9V337 E341V337-E339 VanDerWaalsContact C-N 3.34Å; V337-E339 PolarHBondContact O-N 2.98Å; V337-E339 VanDerWaalsContact O-N 3.12Å; E339-E341 PolarHBondContact O-N 2.78Å
340D55.2Low59.6Low135 Ų135133.5 Ų133.572%0.72270%0.702SS**  trans37.675167.7-75.9-75.3000116.5S338 D342S338-D340 PolarHBondContact O-N 2.99Å; D340-D342 PolarHBondContact O-N 2.94Å
341E58.5Low61.3Low166 Ų166132.2 Ų132.278%0.77669%0.692SS**THydrogen-bonded Turntrans-57.2129.8168.1-148170.6-170.500110.6E339 Q343E339-E341 PolarHBondContact O-N 2.78Å; E341-Q343 PolarHBondContact O-N 2.93Å
342D58.1Low63.2Low106 Ų106126.9 Ų126.957%0.56767%0.667SS**THydrogen-bonded Turntrans74.9-0.8166.8-56.4-35.9000121.5D340 E344D340-D342 PolarHBondContact O-N 2.94Å; D342-E344 PolarHBondContact O-N 3.25Å
343Q53Low65.1Low160 Ų160126.7 Ų126.775%0.74867%0.669SS**THydrogen-bonded Turntrans-69-22.1-169.5-158.568.385.100116E341E341-Q343 PolarHBondContact O-N 2.93Å
344E55.2Low67.3Low168 Ų168123.8 Ų123.879%0.78565%0.649SS**THydrogen-bonded Turntrans-116.70.1-175.3-65.6-164.2160.600115.9D342 F346D342-E344 PolarHBondContact O-N 3.25Å; E344-F346 PolarHBondContact O-N 2.68Å
345L56.1Low69.2Low126 Ų126121 Ų12166%0.6664%0.635SS**THydrogen-bonded Turntrans-65.1-17.4-170.9-138.898.2000114.7
346F52Low70.9Confident179 Ų179123.6 Ų123.679%0.78564%0.638SS**THydrogen-bonded Turntrans-107.3-9.5-167-63-74.9000115.6E344E344-F346 PolarHBondContact O-N 2.68Å
347D56.3Low72.6Confident162 Ų162119.4 Ų119.487%0.86662%0.615SS**  trans-125.228.1179.6-97.9-36.6000112.5E349D347-E349 PolarHBondContact O-N 2.87Å
348T62.9Low74.4Confident82 Ų82120.6 Ų120.650%0.50361%0.612SS.*  trans-68.9102175.6-62.70000111N350 V351T348-N350 VanDerWaalsContact CG2-O 3.3Å; T348-N350 WeakPolarHBondContact CG2-O 3.47Å; T348-N350 PolarHBondContact O-N 2.86Å; T348-V351 HydrophobicContact CG2-CG2 3.98Å
349E74.2Confident76.1Confident124 Ų124119.4 Ų119.458%0.57960%0.597SS**SBendtrans-61.8-25.7179.1-178.1-177.5-165.700113.9D347D347-E349 PolarHBondContact O-N 2.87Å
350N89.4Confident77.9Confident64 Ų64115.3 Ų115.334%0.34258%0.577SS.*  trans-123.8106.4-171.8-64.1-84.7000110.5T348 N376 L377 N378T348-N350 VanDerWaalsContact CG2-O 3.3Å; T348-N350 WeakPolarHBondContact CG2-O 3.47Å; T348-N350 PolarHBondContact O-N 2.86Å; N350-N376 CarbonylContact C-O 3.55Å; N350-N376 WeakPolarHBondContact CA-O 3.26Å; N350-L377 HydrophobicContact CB-CD2 3.95Å; N350-L377 VanDerWaalsContact OD1-CA 3.26Å; N350-L377 WeakPolarHBondContact OD1-CA 3.35Å; N350-N378 PolarHBondContact OD1-N 3.29Å; N350-N378 PolarHBondContact OD1-ND2 2.87Å
351V92Very high79.9Confident70 Ų70116.3 Ų116.342%0.42457%0.571SS.*EExtended strand (participates in β ladder)trans-121136.7-173.8-179.60000110.8T348 V353 M375 N376T348-V351 HydrophobicContact CG2-CG2 3.98Å; V351-V353 HydrophobicContact CG1-CG2 4.16Å; V351-M375 CarbonylContact O-C 3.57Å; V351-M375 WeakPolarHBondContact O-CA 3.42Å; V351-N376 PolarHBondContact N-O 3.27Å; V351-N376 PolarHBondContact O-N 3.34Å
352V94.3Very high81.7Confident74 Ų74111.8 Ų111.845%0.44856%0.558SS.*EExtended strand (participates in β ladder)trans-120.9120.4175.3176.10000109.2M375 F384V352-M375 HydrophobicContact CB-CG 4.32Å; V352-M375 HydrophobicContact CG1-CG 3.98Å; V352-M375 HydrophobicContact CG1-SD 4.38Å; V352-M375 HydrophobicContact CG2-CB 4.08Å; V352-M375 HydrophobicContact CG2-CG 3.82Å; V352-M375 HydrophobicContact CG2-SD 3.99Å; V352-F384 HydrophobicContact CG1-CE1 4.33Å
353V95.6Very high83.5Confident102 Ų102115.8 Ų115.862%0.61857%0.57SS**EExtended strand (participates in β ladder)trans-114.8120.5173.5-176.60000107.8V351 G373 I374V351-V353 HydrophobicContact CG1-CG2 4.16Å; V353-G373 CarbonylContact O-C 3.56Å; V353-G373 VanDerWaalsContact O-CA 3.3Å; V353-G373 WeakPolarHBondContact O-CA 3.38Å; V353-I374 PolarHBondContact N-O 3.1Å; V353-I374 PolarHBondContact O-N 3.31Å; V353-I374 VanDerWaalsContact O-O 3.11Å
354C97.3Very high85.6Confident47 Ų47111 Ų11132%0.31855%0.551SS.*EExtended strand (participates in β ladder)trans-156.9171-177.665.50000111.5G373 F384C354-G373 VanDerWaalsContact CB-CA 3.48Å; C354-F384 HydrophobicContact CB-CE1 4.43Å; C354-F384 HydrophobicContact CB-CE2 4.15Å; C354-F384 HydrophobicContact CB-CZ 3.59Å
355Q98.3Very high87.6Confident99 Ų99109 Ų10946%0.46354%0.54SS..EExtended strand (participates in β ladder)trans-96.6157.8168-63.9170.761.300110.1L370 K371 D372Q355-L370 CarbonylContact O-C 3.54Å; Q355-L370 WeakPolarHBondContact O-CA 3.49Å; Q355-K371 HydrophobicContact CB-CD 4.46Å; Q355-K371 HydrophobicContact CB-CG 3.74Å; Q355-K371 PolarHBondContact N-O 3.11Å; Q355-K371 PolarHBondContact O-N 3.45Å; Q355-K371 VanDerWaalsContact O-O 3.14Å; Q355-D372 VanDerWaalsContact NE2-CB 3.33Å; Q355-D372 PolarHBondContact NE2-OD2 3.44Å
356Y97.3Very high89.6Confident170 Ų170106.6 Ų106.667%0.66752%0.522SS*.EExtended strand (participates in β ladder)trans-99.1145.116965.4-89.7000111.5I359Y356-I359 HydrophobicContact CD2-CG1 4.22Å; Y356-I359 HydrophobicContact CG-CD1 4.38Å; Y356-I359 HydrophobicContact CG-CG1 4.24Å
357D97.6Very high91.8Very high74 Ų74102.4 Ų102.440%0.39650%0.504SS..EExtended strand (participates in β ladder)trans-98.2-43.6166.5-99.6-15.3000110.3H369 K371 K386D357-H369 HydrophobicContact CB-CB 4.32Å; D357-H369 PolarHBondContact N-O 3.03Å; D357-K371 VanDerWaalsContact OD1-CD 3.27Å; D357-K371 WeakPolarHBondContact OD1-CD 3.25Å; D357-K371 WeakPolarHBondContact OD1-CE 3.34Å; D357-K371 IonicContact OD1-NZ 3.65Å; D357-K371 PolarHBondContact OD1-NZ 3.39Å; D357-K386 IonicContact OD2-NZ 3.88Å
358K97.1Very high93.7Very high136 Ų13697.5 Ų97.559%0.59148%0.475SS*.EExtended strand (participates in β ladder)trans-158.1124.6-179.2-178.2174.7-64.5-172.50111.2H369K358-H369 HydrophobicContact CB-CB 4.16Å; K358-H369 PolarHBondContact N-O 3.13Å; K358-H369 VanDerWaalsContact N-O 3.13Å; K358-H369 WeakPolarHBondContact O-CB 3.4Å; K358-H369 PolarHBondContact O-N 3.43Å
359I97.7Very high95.4Very high77 Ų7796.9 Ų96.940%0.39547%0.466SS..EExtended strand (participates in β ladder)trans-106.4135.4170.2-50.5-49.2000108.3Y356 W366 F368 L370Y356-I359 HydrophobicContact CD2-CG1 4.22Å; Y356-I359 HydrophobicContact CG-CD1 4.38Å; Y356-I359 HydrophobicContact CG-CG1 4.24Å; I359-W366 HydrophobicContact CG2-CE3 4.07Å; I359-W366 HydrophobicContact CG2-CZ3 4.11Å; I359-F368 HydrophobicContact CD1-CB 4.09Å; I359-F368 HydrophobicContact CD1-CD1 4.06Å; I359-F368 HydrophobicContact CG2-CD1 4.25Å; I359-L370 HydrophobicContact CD1-CD2 4.15Å
360H97Very high96.5Very high101 Ų10193 Ų9347%0.46845%0.449SS..EExtended strand (participates in β ladder)trans-137.5140179.6173.880.1000110.5W366 K367H360-W366 CarbonylContact O-C 3.41Å; H360-W366 WeakPolarHBondContact O-CA 3.22Å; H360-K367 HydrophobicContact CB-CB 4.39Å; H360-K367 PolarHBondContact N-O 3.2Å; H360-K367 PolarHBondContact O-N 2.98Å
361R96.9Very high96.9Very high155 Ų15592.4 Ų92.459%0.58544%0.443SS*.EExtended strand (participates in β ladder)trans-130.2137.7177.2-172.1-177.472.5169-1.3110.9K363 K365 W366R361-K363 WeakPolarHBondContact CD-O 3.29Å; R361-K363 WeakPolarHBondContact CG-O 3.31Å; R361-K365 CarbonylContact C-O 3.59Å; R361-K365 WeakPolarHBondContact CA-O 3.33Å; R361-W366 HydrophobicContact CB-CD2 4.1Å; R361-W366 HydrophobicContact CB-CE3 3.89Å; R361-W366 HydrophobicContact CB-CZ3 4.13Å; R361-W366 VanDerWaalsContact CD-CE2 3.47Å; R361-W366 VanDerWaalsContact CD-CZ2 3.4Å; R361-W366 HydrophobicContact CG-CD2 3.88Å; R361-W366 HydrophobicContact CG-CE3 4.17Å; R361-W366 HydrophobicContact CG-CG 4.33Å; R361-W366 HydrophobicContact CG-CZ2 4.27Å; R361-W366 HydrophobicContact CG-CZ3 4.48Å
362S96.8Very high97.2Very high72 Ų7293.3 Ų93.350%0.50345%0.446SS..EExtended strand (participates in β ladder)trans-134.7106.9168.7-168.70000109.4T364 K365S362-T364 PolarHBondContact O-N 3.41Å; S362-K365 PolarHBondContact N-O 2.82Å; S362-K365 WeakPolarHBondContact O-CB 3.44Å; S362-K365 PolarHBondContact O-N 3.23Å
363K96.5Very high97.3Very high190 Ų19089.9 Ų89.983%0.82643%0.426SS*.THydrogen-bonded Turntrans55-124.9-169.1-55-179.5-179.7-1780110.7R361 K365R361-K363 WeakPolarHBondContact CD-O 3.29Å; R361-K363 WeakPolarHBondContact CG-O 3.31Å; K363-K365 VanDerWaalsContact C-N 3.29Å
364T96.6Very high97.3Very high58 Ų5889.2 Ų89.236%0.35642%0.418SS..THydrogen-bonded Turntrans-72.5-17.7175.552.50000113.2S362 W366 E392 W393S362-T364 PolarHBondContact O-N 3.41Å; T364-W366 VanDerWaalsContact O-CD1 3.29Å; T364-E392 WeakPolarHBondContact O-CA 3.25Å; T364-E392 PolarHBondContact OG1-OE1 3.3Å; T364-W393 VanDerWaalsContact CB-O 3.28Å; T364-W393 WeakPolarHBondContact CB-O 3.28Å; T364-W393 WeakPolarHBondContact CG2-O 3.18Å; T364-W393 PolarHBondContact O-N 3.04Å
365K97.3Very high97.1Very high127 Ų12789 Ų8955%0.55241%0.412SS*.EExtended strand (participates in β ladder)trans-89.9126.4-171-59.1-167.8176.6-167.60112R361 S362 K363 A391R361-K365 CarbonylContact C-O 3.59Å; R361-K365 WeakPolarHBondContact CA-O 3.33Å; S362-K365 PolarHBondContact N-O 2.82Å; S362-K365 WeakPolarHBondContact O-CB 3.44Å; S362-K365 PolarHBondContact O-N 3.23Å; K363-K365 VanDerWaalsContact C-N 3.29Å; K365-A391 WeakPolarHBondContact CA-O 3.23Å
366W98.2Very high96.7Very high75 Ų7586.8 Ų86.828%0.28440%0.404SS..EExtended strand (participates in β ladder)trans-109.9145.1177-65.686000110.9I359 H360 R361 T364 F368 D390 A391I359-W366 HydrophobicContact CG2-CE3 4.07Å; I359-W366 HydrophobicContact CG2-CZ3 4.11Å; H360-W366 CarbonylContact O-C 3.41Å; H360-W366 WeakPolarHBondContact O-CA 3.22Å; R361-W366 HydrophobicContact CB-CD2 4.1Å; R361-W366 HydrophobicContact CB-CE3 3.89Å; R361-W366 HydrophobicContact CB-CZ3 4.13Å; R361-W366 VanDerWaalsContact CD-CE2 3.47Å; R361-W366 VanDerWaalsContact CD-CZ2 3.4Å; R361-W366 HydrophobicContact CG-CD2 3.88Å; R361-W366 HydrophobicContact CG-CE3 4.17Å; R361-W366 HydrophobicContact CG-CG 4.33Å; R361-W366 HydrophobicContact CG-CZ2 4.27Å; R361-W366 HydrophobicContact CG-CZ3 4.48Å; T364-W366 VanDerWaalsContact O-CD1 3.29Å; W366-F368 HydrophobicContact CB-CE1 3.97Å; W366-F368 HydrophobicContact CB-CE2 3.92Å; W366-F368 HydrophobicContact CB-CZ 3.43Å; W366-F368 VanDerWaalsContact CB-CZ 3.43Å; W366-F368 HydrophobicContact CE3-CE1 4.31Å; W366-F368 HydrophobicContact CG-CZ 4.15Å; W366-D390 CarbonylContact O-C 3.55Å; W366-D390 WeakPolarHBondContact O-CA 3.37Å; W366-A391 PolarHBondContact N-O 3.4Å; W366-A391 PolarHBondContact O-N 3Å
367K97.7Very high96.4Very high92 Ų9281 Ų8140%0.439%0.385SS..EExtended strand (participates in β ladder)trans-128.7132.6169-61.6-172.2175-94.40109.1H360 G389 D390H360-K367 HydrophobicContact CB-CB 4.39Å; H360-K367 PolarHBondContact N-O 3.2Å; H360-K367 PolarHBondContact O-N 2.98Å; K367-G389 WeakPolarHBondContact CA-O 3.44Å; K367-D390 WeakPolarHBondContact CE-OD1 3.46Å; K367-D390 WeakPolarHBondContact CG-OD1 3.34Å; K367-D390 IonicContact NZ-OD1 2.65Å; K367-D390 PolarHBondContact NZ-OD1 2.83Å
368F97.9Very high95.9Very high59 Ų5982.8 Ų82.826%0.25939%0.394SS..EExtended strand (participates in β ladder)trans-120.9124.6-179.6-37.8-90000108.6I359 W366 L370 T388 G389 A391I359-F368 HydrophobicContact CD1-CB 4.09Å; I359-F368 HydrophobicContact CD1-CD1 4.06Å; I359-F368 HydrophobicContact CG2-CD1 4.25Å; W366-F368 HydrophobicContact CB-CE1 3.97Å; W366-F368 HydrophobicContact CB-CE2 3.92Å; W366-F368 HydrophobicContact CB-CZ 3.43Å; W366-F368 VanDerWaalsContact CB-CZ 3.43Å; W366-F368 HydrophobicContact CE3-CE1 4.31Å; W366-F368 HydrophobicContact CG-CZ 4.15Å; F368-L370 HydrophobicContact CB-CD1 4.34Å; F368-L370 HydrophobicContact CB-CD2 4.19Å; F368-L370 HydrophobicContact CB-CG 4.08Å; F368-T388 CarbonylContact O-C 3.54Å; F368-T388 VanDerWaalsContact O-CA 3.25Å; F368-T388 WeakPolarHBondContact O-CA 3.4Å; F368-G389 PolarHBondContact N-O 3.04Å; F368-G389 PolarHBondContact O-N 2.93Å; F368-A391 HydrophobicContact CE2-CB 3.61Å; F368-A391 HydrophobicContact CZ-CB 4Å
369H97.6Very high95.2Very high69 Ų6977.7 Ų77.732%0.31938%0.38SS..EExtended strand (participates in β ladder)trans-106.9117.2163.2-59.1-81.3000107.3D357 K358 T388D357-H369 HydrophobicContact CB-CB 4.32Å; D357-H369 PolarHBondContact N-O 3.03Å; K358-H369 HydrophobicContact CB-CB 4.16Å; K358-H369 PolarHBondContact N-O 3.13Å; K358-H369 VanDerWaalsContact N-O 3.13Å; K358-H369 WeakPolarHBondContact O-CB 3.4Å; K358-H369 PolarHBondContact O-N 3.43Å; H369-T388 PolarHBondContact ND1-OG1 3.25Å; H369-T388 VanDerWaalsContact ND1-OG1 3.11Å
370L98.3Very high94.7Very high41 Ų4179.5 Ų79.522%0.21538%0.382CS..EExtended strand (participates in β ladder)trans-121.9156-171.3-54.4173.8000109.9Q355 I359 F368 F384 K386 A387Q355-L370 CarbonylContact O-C 3.54Å; Q355-L370 WeakPolarHBondContact O-CA 3.49Å; I359-L370 HydrophobicContact CD1-CD2 4.15Å; F368-L370 HydrophobicContact CB-CD1 4.34Å; F368-L370 HydrophobicContact CB-CD2 4.19Å; F368-L370 HydrophobicContact CB-CG 4.08Å; L370-F384 HydrophobicContact CB-CE2 4.02Å; L370-F384 HydrophobicContact CB-CZ 4.22Å; L370-K386 CarbonylContact O-C 3.55Å; L370-K386 VanDerWaalsContact O-CA 3.31Å; L370-K386 WeakPolarHBondContact O-CA 3.32Å; L370-A387 HydrophobicContact CB-CB 4.34Å; L370-A387 PolarHBondContact N-O 3.31Å; L370-A387 PolarHBondContact O-N 2.94Å
371K97.8Very high94.3Very high52 Ų5275.5 Ų75.523%0.22636%0.364CS..EExtended strand (participates in β ladder)trans-141.2166.4177.969.2178.3164.4-150.90111.8Q355 D357 G373 S385Q355-K371 HydrophobicContact CB-CD 4.46Å; Q355-K371 HydrophobicContact CB-CG 3.74Å; Q355-K371 PolarHBondContact N-O 3.11Å; Q355-K371 PolarHBondContact O-N 3.45Å; Q355-K371 VanDerWaalsContact O-O 3.14Å; D357-K371 VanDerWaalsContact OD1-CD 3.27Å; D357-K371 WeakPolarHBondContact OD1-CD 3.25Å; D357-K371 WeakPolarHBondContact OD1-CE 3.34Å; D357-K371 IonicContact OD1-NZ 3.65Å; D357-K371 PolarHBondContact OD1-NZ 3.39Å; K371-G373 VanDerWaalsContact C-N 3.34Å; K371-G373 PolarHBondContact O-N 3.48Å; K371-S385 WeakPolarHBondContact CA-O 3.38Å; K371-S385 WeakPolarHBondContact CB-O 3.35Å
372D97.2Very high94.1Very high90 Ų9071.3 Ų71.348%0.48135%0.35SS..EExtended strand (participates in β ladder)trans47.953.6169.2-53-31.3000113Q355 S385Q355-D372 VanDerWaalsContact NE2-CB 3.33Å; Q355-D372 PolarHBondContact NE2-OD2 3.44Å; D372-S385 PolarHBondContact N-O 3.12Å
373G96.1Very high93.9Very high2 Ų270.8 Ų70.82%0.02134%0.344CS..EExtended strand (participates in β ladder)trans-104.1142-172.200000114.4V353 C354 K371 V383 F384V353-G373 CarbonylContact O-C 3.56Å; V353-G373 VanDerWaalsContact O-CA 3.3Å; V353-G373 WeakPolarHBondContact O-CA 3.38Å; C354-G373 VanDerWaalsContact CB-CA 3.48Å; K371-G373 VanDerWaalsContact C-N 3.34Å; K371-G373 PolarHBondContact O-N 3.48Å; G373-V383 CarbonylContact O-C 3.54Å; G373-V383 VanDerWaalsContact O-CA 3.26Å; G373-V383 WeakPolarHBondContact O-CA 3.3Å; G373-F384 PolarHBondContact N-O 3.1Å; G373-F384 PolarHBondContact O-N 3.5Å
374I95.1Very high93.8Very high88 Ų8863.3 Ų63.345%0.45131%0.311SS..EExtended strand (participates in β ladder)trans-118.7132.9169.5-53.3177000107.1V353 V383V353-I374 PolarHBondContact N-O 3.1Å; V353-I374 PolarHBondContact O-N 3.31Å; V353-I374 VanDerWaalsContact O-O 3.11Å; I374-V383 HydrophobicContact CG1-CG1 4.26Å; I374-V383 HydrophobicContact CG2-CG1 4.47Å
375M93.8Very high93.8Very high41 Ų4165 Ų6520%0.20233%0.325CS..EExtended strand (participates in β ladder)trans-130.4125.7-178.1-45.6-174.6-68.600109.5V351 V352 L377 D381 F382 F384V351-M375 CarbonylContact O-C 3.57Å; V351-M375 WeakPolarHBondContact O-CA 3.42Å; V352-M375 HydrophobicContact CB-CG 4.32Å; V352-M375 HydrophobicContact CG1-CG 3.98Å; V352-M375 HydrophobicContact CG1-SD 4.38Å; V352-M375 HydrophobicContact CG2-CB 4.08Å; V352-M375 HydrophobicContact CG2-CG 3.82Å; V352-M375 HydrophobicContact CG2-SD 3.99Å; M375-L377 HydrophobicContact CB-CD1 4.22Å; M375-L377 HydrophobicContact CB-CG 4.03Å; M375-L377 HydrophobicContact CE-CD1 4.17Å; M375-L377 HydrophobicContact SD-CD1 4.39Å; M375-D381 CarbonylContact O-C 3.57Å; M375-D381 WeakPolarHBondContact O-CA 3.42Å; M375-F382 HydrophobicContact CB-CB 4.33Å; M375-F382 HydrophobicContact CE-CB 3.73Å; M375-F382 PolarHBondContact N-O 3.41Å; M375-F382 PolarHBondContact O-N 3.38Å; M375-F384 HydrophobicContact CE-CD1 4.03Å; M375-F384 HydrophobicContact CG-CD1 4.05Å; M375-F384 HydrophobicContact CG-CE1 3.86Å; M375-F384 HydrophobicContact SD-CD1 3.78Å; M375-F384 HydrophobicContact SD-CE1 3.67Å
376N90.5Very high93.8Very high53 Ų5366.3 Ų66.328%0.28333%0.331SS..EExtended strand (participates in β ladder)trans-96.4116.4162.6-173.9-87.9000107.4N350 V351 D381N350-N376 CarbonylContact C-O 3.55Å; N350-N376 WeakPolarHBondContact CA-O 3.26Å; V351-N376 PolarHBondContact N-O 3.27Å; V351-N376 PolarHBondContact O-N 3.34Å; N376-D381 PolarHBondContact ND2-OD1 2.77Å
377L90.2Very high93.7Very high50 Ų5064.3 Ų64.326%0.26233%0.33SS..EExtended strand (participates in β ladder)trans-130.1119.4-178.5-57.2174.1000109.6N350 M375 G379 R380 F382N350-L377 HydrophobicContact CB-CD2 3.95Å; N350-L377 VanDerWaalsContact OD1-CA 3.26Å; N350-L377 WeakPolarHBondContact OD1-CA 3.35Å; M375-L377 HydrophobicContact CB-CD1 4.22Å; M375-L377 HydrophobicContact CB-CG 4.03Å; M375-L377 HydrophobicContact CE-CD1 4.17Å; M375-L377 HydrophobicContact SD-CD1 4.39Å; L377-G379 PolarHBondContact O-N 3.36Å; L377-R380 PolarHBondContact N-O 2.77Å; L377-R380 PolarHBondContact O-N 3.16Å; L377-R380 VanDerWaalsContact O-N 3.1Å; L377-F382 HydrophobicContact CB-CD2 4.1Å; L377-F382 HydrophobicContact CB-CE2 3.93Å; L377-F382 HydrophobicContact CD1-CD2 4.11Å; L377-F382 HydrophobicContact CD1-CE2 4.42Å; L377-F382 HydrophobicContact CG-CD2 4.25Å
378N87.1Confident93.7Very high111 Ų11164.4 Ų64.459%0.59434%0.339SS*.THydrogen-bonded Turntrans51.943.9-177.3-53-111.1000111.4N350 R380N350-N378 PolarHBondContact OD1-N 3.29Å; N350-N378 PolarHBondContact OD1-ND2 2.87Å; N378-R380 VanDerWaalsContact C-N 3.29Å; N378-R380 PolarHBondContact O-N 3.5Å
379G83.4Confident93.6Very high28 Ų2863 Ų6329%0.28934%0.34SS..THydrogen-bonded Turntrans7110.7-178.800000116.3K54 L377K54-G379 CarbonylContact C-O 3.58Å; L377-G379 PolarHBondContact O-N 3.36Å
380R85.8Confident93.6Very high116 Ų11664.9 Ų64.944%0.43835%0.353SS..EExtended strand (participates in β ladder)trans-118.9142.8175.7-71-175.1-64174.1-0.6111.9F59 L377 N378 F382F59-R380 HydrophobicContact CZ-CB 4.27Å; F59-R380 HydrophobicContact CZ-CG 4.42Å; L377-R380 PolarHBondContact N-O 2.77Å; L377-R380 PolarHBondContact O-N 3.16Å; L377-R380 VanDerWaalsContact O-N 3.1Å; N378-R380 VanDerWaalsContact C-N 3.29Å; N378-R380 PolarHBondContact O-N 3.5Å; R380-F382 HydrophobicContact CB-CE2 3.86Å; R380-F382 HydrophobicContact CB-CZ 4.21Å; R380-F382 VanDerWaalsContact O-CD2 3.29Å; R380-F382 WeakPolarHBondContact O-CD2 3.49Å; R380-F382 VanDerWaalsContact O-CE2 3.31Å; R380-F382 WeakPolarHBondContact O-CE2 3.5Å
381D90.1Very high93.5Very high17 Ų1765.1 Ų65.19%0.09136%0.361CS..EExtended strand (participates in β ladder)trans-92.1138.8-178.7-69.6-8.7000113V10 Y14 A55 M375 N376V10-D381 HydrophobicContact CG1-CB 3.85Å; Y14-D381 HydrophobicContact CE2-CB 4.21Å; Y14-D381 WeakPolarHBondContact CE2-OD2 3.49Å; Y14-D381 PolarHBondContact OH-OD2 3.46Å; A55-D381 WeakPolarHBondContact CB-OD2 3.32Å; A55-D381 PolarHBondContact O-N 3.26Å; M375-D381 CarbonylContact O-C 3.57Å; M375-D381 WeakPolarHBondContact O-CA 3.42Å; N376-D381 PolarHBondContact ND2-OD1 2.77Å
382F91.5Very high93.4Very high66 Ų6668.7 Ų68.729%0.28938%0.379SS..EExtended strand (participates in β ladder)trans-133.5151.1176.8-57.2-92.4000109.4M375 L377 R380M375-F382 HydrophobicContact CB-CB 4.33Å; M375-F382 HydrophobicContact CE-CB 3.73Å; M375-F382 PolarHBondContact N-O 3.41Å; M375-F382 PolarHBondContact O-N 3.38Å; L377-F382 HydrophobicContact CB-CD2 4.1Å; L377-F382 HydrophobicContact CB-CE2 3.93Å; L377-F382 HydrophobicContact CD1-CD2 4.11Å; L377-F382 HydrophobicContact CD1-CE2 4.42Å; L377-F382 HydrophobicContact CG-CD2 4.25Å; R380-F382 HydrophobicContact CB-CE2 3.86Å; R380-F382 HydrophobicContact CB-CZ 4.21Å; R380-F382 VanDerWaalsContact O-CD2 3.29Å; R380-F382 WeakPolarHBondContact O-CD2 3.49Å; R380-F382 VanDerWaalsContact O-CE2 3.31Å; R380-F382 WeakPolarHBondContact O-CE2 3.5Å
383V93.8Very high93.1Very high62 Ų6276.2 Ų76.238%0.37640%0.4SS..EExtended strand (participates in β ladder)trans-131.9148.1175.5-61.40000110.7V10 L13 G373 I374V10-V383 HydrophobicContact CG2-CG1 4.17Å; V10-V383 HydrophobicContact CG2-CG2 3.94Å; L13-V383 HydrophobicContact CD2-CG1 4.12Å; L13-V383 HydrophobicContact CD2-CG2 4.36Å; G373-V383 CarbonylContact O-C 3.54Å; G373-V383 VanDerWaalsContact O-CA 3.26Å; G373-V383 WeakPolarHBondContact O-CA 3.3Å; I374-V383 HydrophobicContact CG1-CG1 4.26Å; I374-V383 HydrophobicContact CG2-CG1 4.47Å
384F94.3Very high92.9Very high33 Ų3379.9 Ų79.915%0.14542%0.419CS..EExtended strand (participates in β ladder)trans-138.6138173.866.3-101.2000111.4V352 C354 L370 G373 M375 A387V352-F384 HydrophobicContact CG1-CE1 4.33Å; C354-F384 HydrophobicContact CB-CE1 4.43Å; C354-F384 HydrophobicContact CB-CE2 4.15Å; C354-F384 HydrophobicContact CB-CZ 3.59Å; L370-F384 HydrophobicContact CB-CE2 4.02Å; L370-F384 HydrophobicContact CB-CZ 4.22Å; G373-F384 PolarHBondContact N-O 3.1Å; G373-F384 PolarHBondContact O-N 3.5Å; M375-F384 HydrophobicContact CE-CD1 4.03Å; M375-F384 HydrophobicContact CG-CD1 4.05Å; M375-F384 HydrophobicContact CG-CE1 3.86Å; M375-F384 HydrophobicContact SD-CD1 3.78Å; M375-F384 HydrophobicContact SD-CE1 3.67Å; F384-A387 HydrophobicContact CD1-CB 4.45Å; F384-A387 HydrophobicContact CD2-CB 3.67Å; F384-A387 HydrophobicContact CE1-CB 4.33Å; F384-A387 HydrophobicContact CE2-CB 3.55Å; F384-A387 HydrophobicContact CG-CB 4.13Å; F384-A387 HydrophobicContact CZ-CB 3.88Å
385S96.1Very high92.8Very high94 Ų9479.5 Ų79.566%0.65742%0.417SS*.EExtended strand (participates in β ladder)trans-78.2-34.3170.5-48.10000111.7K371 D372K371-S385 WeakPolarHBondContact CA-O 3.38Å; K371-S385 WeakPolarHBondContact CB-O 3.35Å; D372-S385 PolarHBondContact N-O 3.12Å
386K96.4Very high92.8Very high154 Ų15481.6 Ų81.667%0.6743%0.429SS*.EExtended strand (participates in β ladder)trans-144.9143.7174.4-63-165178.5-146.80111D357 L370D357-K386 IonicContact OD2-NZ 3.88Å; L370-K386 CarbonylContact O-C 3.55Å; L370-K386 VanDerWaalsContact O-CA 3.31Å; L370-K386 WeakPolarHBondContact O-CA 3.32Å
387A97.2Very high92.9Very high32 Ų3283.3 Ų83.326%0.26444%0.438SS..EExtended strand (participates in β ladder)trans-135.3155.9170.700000110.1L370 F384L370-A387 HydrophobicContact CB-CB 4.34Å; L370-A387 PolarHBondContact N-O 3.31Å; L370-A387 PolarHBondContact O-N 2.94Å; F384-A387 HydrophobicContact CD1-CB 4.45Å; F384-A387 HydrophobicContact CD2-CB 3.67Å; F384-A387 HydrophobicContact CE1-CB 4.33Å; F384-A387 HydrophobicContact CE2-CB 3.55Å; F384-A387 HydrophobicContact CG-CB 4.13Å; F384-A387 HydrophobicContact CZ-CB 3.88Å
388T97.1Very high93.1Very high95 Ų9585.4 Ų85.458%0.58345%0.449SS*.EExtended strand (participates in β ladder)trans-138.7133.6170.7-64.90000108.2F368 H369F368-T388 CarbonylContact O-C 3.54Å; F368-T388 VanDerWaalsContact O-CA 3.25Å; F368-T388 WeakPolarHBondContact O-CA 3.4Å; H369-T388 PolarHBondContact ND1-OG1 3.25Å; H369-T388 VanDerWaalsContact ND1-OG1 3.11Å
389G96.4Very high93.5Very high28 Ų2883.7 Ų83.729%0.28944%0.439SS..EExtended strand (participates in β ladder)trans-139157.4-179.200000111.9K367 F368K367-G389 WeakPolarHBondContact CA-O 3.44Å; F368-G389 PolarHBondContact N-O 3.04Å; F368-G389 PolarHBondContact O-N 2.93Å
390D96.9Very high94.2Very high109 Ų10987.6 Ų87.658%0.58345%0.45SS*.EExtended strand (participates in β ladder)trans-124.5138.8174.4-62.9-104.4000107.7W366 K367W366-D390 CarbonylContact O-C 3.55Å; W366-D390 WeakPolarHBondContact O-CA 3.37Å; K367-D390 WeakPolarHBondContact CE-OD1 3.46Å; K367-D390 WeakPolarHBondContact CG-OD1 3.34Å; K367-D390 IonicContact NZ-OD1 2.65Å; K367-D390 PolarHBondContact NZ-OD1 2.83Å
391A96.4Very high94.8Very high47 Ų4785.5 Ų85.539%0.38845%0.451SS..EExtended strand (participates in β ladder)trans-140.6169.1173.500000111.5K365 W366 F368K365-A391 WeakPolarHBondContact CA-O 3.23Å; W366-A391 PolarHBondContact N-O 3.4Å; W366-A391 PolarHBondContact O-N 3Å; F368-A391 HydrophobicContact CE2-CB 3.61Å; F368-A391 HydrophobicContact CZ-CB 4Å
392E96.4Very high95.2Very high127 Ų12791.2 Ų91.259%0.59348%0.481SS*.EExtended strand (participates in β ladder)trans-127.1134.3172.5-170.7146.9-145.900108.1T364T364-E392 WeakPolarHBondContact O-CA 3.25Å; T364-E392 PolarHBondContact OG1-OE1 3.3Å
393W90.3Very high95.6Very high247 Ų24793.5 Ų93.594%0.93650%0.499SS*.  trans-106.70175.9-179.789.3000109.2T364T364-W393 VanDerWaalsContact CB-O 3.28Å; T364-W393 WeakPolarHBondContact CB-O 3.28Å; T364-W393 WeakPolarHBondContact CG2-O 3.18Å; T364-W393 PolarHBondContact O-N 3.04Å

Retrieved 393 of 393 residues in 1406.3 ms (Link to these results)