A0A3Q0KMI6_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A3Q0KMI6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 233 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
1M51.1Low62.4Low208 Ų20891.1 Ų91.1100%1.02552%0.518SS*.  0-43.50-100.9174.1-179.800113.5A3 I4M1-A3 VanDerWaalsContact C-N 3.3Å; M1-A3 PolarHBondContact O-N 3.15Å; M1-I4 PolarHBondContact O-N 3.31Å
2V56.9Low63.4Low102 Ų10289.4 Ų89.462%0.61852%0.516SS*.Hα-helixtrans-58.7-32.7-176-176.60000115I4 T5 M6V2-I4 PolarHBondContact O-N 3.32Å; V2-T5 PolarHBondContact O-OG1 3.48Å; V2-M6 HydrophobicContact CG1-CE 3.92Å; V2-M6 HydrophobicContact CG1-SD 4.36Å; V2-M6 WeakPolarHBondContact O-CG 3.35Å; V2-M6 PolarHBondContact O-N 3.27Å
3A54.5Low64Low68 Ų6891 Ų9156%0.56252%0.518SS*.Hα-helixtrans-69.8-31.7-179.600000113.4M1 I7M1-A3 VanDerWaalsContact C-N 3.3Å; M1-A3 PolarHBondContact O-N 3.15Å; A3-I7 WeakPolarHBondContact O-CD1 3.27Å; A3-I7 WeakPolarHBondContact O-CG1 3.4Å; A3-I7 PolarHBondContact O-N 2.94Å
4I54.9Low64.4Low111 Ų11184.6 Ų84.657%0.56948%0.482SS*.Hα-helixtrans-73-44.5-178.2-59.5173.8000109.4M1 V2 M6 I7 D8M1-I4 PolarHBondContact O-N 3.31Å; V2-I4 PolarHBondContact O-N 3.32Å; I4-M6 VanDerWaalsContact C-N 3.26Å; I4-M6 PolarHBondContact O-N 3Å; I4-I7 PolarHBondContact O-N 3.07Å; I4-I7 VanDerWaalsContact O-N 3.1Å; I4-D8 PolarHBondContact O-N 2.93Å; I4-D8 VanDerWaalsContact O-N 3.14Å
5T60.7Low64.8Low92 Ų9283.1 Ų83.156%0.56448%0.484SS*.Hα-helixtrans-62.4-30.6176.8470000113.5V2 G9V2-T5 PolarHBondContact O-OG1 3.48Å; T5-G9 PolarHBondContact O-N 3.27Å
6M63.8Low65.2Low98 Ų9886.6 Ų86.648%0.48349%0.494SS..Hα-helixtrans-71.9-34.7175.9-74.2-177.5170.800112.2V2 I4 V10V2-M6 HydrophobicContact CG1-CE 3.92Å; V2-M6 HydrophobicContact CG1-SD 4.36Å; V2-M6 WeakPolarHBondContact O-CG 3.35Å; V2-M6 PolarHBondContact O-N 3.27Å; I4-M6 VanDerWaalsContact C-N 3.26Å; I4-M6 PolarHBondContact O-N 3Å; M6-V10 WeakPolarHBondContact O-CG2 3.14Å; M6-V10 PolarHBondContact O-N 3.47Å
7I65.4Low65.4Low95 Ų9584.3 Ų84.349%0.48748%0.48SS..Hα-helixtrans-71.3-39.9178.9-66.6165.6000110.5A3 I4 G9 V10 N11A3-I7 WeakPolarHBondContact O-CD1 3.27Å; A3-I7 WeakPolarHBondContact O-CG1 3.4Å; A3-I7 PolarHBondContact O-N 2.94Å; I4-I7 PolarHBondContact O-N 3.07Å; I4-I7 VanDerWaalsContact O-N 3.1Å; I7-G9 VanDerWaalsContact C-N 3.35Å; I7-G9 PolarHBondContact O-N 2.96Å; I7-V10 PolarHBondContact O-N 2.84Å; I7-N11 PolarHBondContact O-N 3.33Å; I7-N11 PolarHBondContact O-ND2 3.5Å
8D66.6Low65.7Low97 Ų9785.6 Ų85.652%0.51948%0.477SS..Hα-helixtrans-63.8-39.9177.1-69.5-25.4000112.1I4 V10 N11 S12I4-D8 PolarHBondContact O-N 2.93Å; I4-D8 VanDerWaalsContact O-N 3.14Å; D8-V10 PolarHBondContact O-N 2.77Å; D8-N11 PolarHBondContact O-N 2.98Å; D8-S12 PolarHBondContact O-N 3.41Å
9G70.9Confident66.1Low32 Ų3286.4 Ų86.433%0.3349%0.489SS..Hα-helixtrans-63.1-39.3174.100000113.1T5 I7 S12 M13T5-G9 PolarHBondContact O-N 3.27Å; I7-G9 VanDerWaalsContact C-N 3.35Å; I7-G9 PolarHBondContact O-N 2.96Å; G9-S12 PolarHBondContact O-N 3.35Å; G9-M13 WeakPolarHBondContact O-CE 3.26Å; G9-M13 PolarHBondContact O-N 3.45Å
10V69.9Low66.4Low18 Ų1891.5 Ų91.511%0.10950%0.501CS..Hα-helixtrans-65.7-41.2174.9172.50000111.1M6 I7 D8 S12 M13 V14 I33 L37M6-V10 WeakPolarHBondContact O-CG2 3.14Å; M6-V10 PolarHBondContact O-N 3.47Å; I7-V10 PolarHBondContact O-N 2.84Å; D8-V10 PolarHBondContact O-N 2.77Å; V10-S12 VanDerWaalsContact C-N 3.31Å; V10-S12 PolarHBondContact O-N 3.06Å; V10-M13 PolarHBondContact O-N 2.93Å; V10-V14 HydrophobicContact CG1-CG2 4.12Å; V10-V14 WeakPolarHBondContact O-CB 3.47Å; V10-V14 WeakPolarHBondContact O-CG2 3.5Å; V10-V14 PolarHBondContact O-N 3.1Å; V10-I33 HydrophobicContact CB-CG2 4.32Å; V10-I33 HydrophobicContact CG1-CB 4.34Å; V10-I33 HydrophobicContact CG1-CD1 4.22Å; V10-I33 HydrophobicContact CG1-CG2 3.66Å; V10-I33 HydrophobicContact CG2-CG2 3.59Å; V10-L37 HydrophobicContact CG2-CD1 3.95Å
11N71.8Confident66.9Low81 Ų8191.1 Ų91.143%0.43350%0.495SS..Hα-helixtrans-63.8-37.6177.5-72.3-29.4000112.2I7 D8 V14 A15I7-N11 PolarHBondContact O-N 3.33Å; I7-N11 PolarHBondContact O-ND2 3.5Å; D8-N11 PolarHBondContact O-N 2.98Å; N11-V14 PolarHBondContact O-N 2.92Å; N11-A15 WeakPolarHBondContact O-CB 3.33Å; N11-A15 PolarHBondContact O-N 3.25Å
12S74.4Confident68.4Low71 Ų7185.1 Ų85.150%0.49747%0.47SS..Hα-helixtrans-65.5-46.1174.4-166.20000112.1D8 G9 V10 V14 A15 E16D8-S12 PolarHBondContact O-N 3.41Å; G9-S12 PolarHBondContact O-N 3.35Å; V10-S12 VanDerWaalsContact C-N 3.31Å; V10-S12 PolarHBondContact O-N 3.06Å; S12-V14 VanDerWaalsContact C-N 3.27Å; S12-V14 PolarHBondContact O-N 2.97Å; S12-A15 WeakPolarHBondContact O-CB 3.42Å; S12-A15 PolarHBondContact O-N 2.76Å; S12-E16 PolarHBondContact O-N 3.1Å
13M71.1Confident69.4Low110 Ų11085.9 Ų85.954%0.54247%0.47SS..Hα-helixtrans-62.6-36.7176-77.3-175.9-8900111.9G9 V10 E16 L17G9-M13 WeakPolarHBondContact O-CE 3.26Å; G9-M13 PolarHBondContact O-N 3.45Å; V10-M13 PolarHBondContact O-N 2.93Å; M13-E16 PolarHBondContact O-N 3.28Å; M13-L17 WeakPolarHBondContact O-CD1 3.2Å; M13-L17 WeakPolarHBondContact O-CG 3.38Å; M13-L17 PolarHBondContact O-N 3.38Å
14V69.5Low70.6Confident1 Ų188.1 Ų88.11%0.00648%0.477CS..Hα-helixtrans-73.6-31.7177.61790000111.9V10 N11 S12 E16 L17 Y18 I26 K30 I33V10-V14 HydrophobicContact CG1-CG2 4.12Å; V10-V14 WeakPolarHBondContact O-CB 3.47Å; V10-V14 WeakPolarHBondContact O-CG2 3.5Å; V10-V14 PolarHBondContact O-N 3.1Å; N11-V14 PolarHBondContact O-N 2.92Å; S12-V14 VanDerWaalsContact C-N 3.27Å; S12-V14 PolarHBondContact O-N 2.97Å; V14-E16 VanDerWaalsContact C-N 3.29Å; V14-E16 PolarHBondContact O-N 2.8Å; V14-L17 WeakPolarHBondContact O-CB 3.32Å; V14-L17 PolarHBondContact O-N 2.9Å; V14-L17 VanDerWaalsContact O-N 3.1Å; V14-Y18 HydrophobicContact CG1-CD2 4.2Å; V14-Y18 HydrophobicContact CG1-CE2 3.82Å; V14-Y18 WeakPolarHBondContact O-CD2 3.42Å; V14-Y18 PolarHBondContact O-N 3.1Å; V14-Y18 VanDerWaalsContact O-N 3.14Å; V14-I26 HydrophobicContact CG1-CG2 3.5Å; V14-I26 VanDerWaalsContact CG1-CG2 3.5Å; V14-K30 HydrophobicContact CG1-CD 4.23Å; V14-K30 HydrophobicContact CG1-CG 3.91Å; V14-K30 HydrophobicContact CG2-CG 4.09Å; V14-I33 HydrophobicContact CG2-CD1 4.3Å
15A70Confident71.8Confident62 Ų6287 Ų8751%0.51247%0.47SS..Hα-helixtrans-57.5-41172.400000112.1N11 S12 L17 Y18N11-A15 WeakPolarHBondContact O-CB 3.33Å; N11-A15 PolarHBondContact O-N 3.25Å; S12-A15 WeakPolarHBondContact O-CB 3.42Å; S12-A15 PolarHBondContact O-N 2.76Å; A15-L17 VanDerWaalsContact C-N 3.32Å; A15-L17 PolarHBondContact O-N 2.69Å; A15-Y18 PolarHBondContact O-N 3.32Å
16E71.4Confident72.6Confident139 Ų13982.7 Ų82.765%0.6544%0.443SS*.Hα-helixtrans-68.8-31.9175.7-68176.7-172.900112.4S12 M13 V14 Y18S12-E16 PolarHBondContact O-N 3.1Å; M13-E16 PolarHBondContact O-N 3.28Å; V14-E16 VanDerWaalsContact C-N 3.29Å; V14-E16 PolarHBondContact O-N 2.8Å; E16-Y18 VanDerWaalsContact C-N 3.32Å; E16-Y18 PolarHBondContact O-N 3.35Å
17L68.3Low73.3Confident48 Ų4881.6 Ų81.625%0.25145%0.445SS..Hα-helixtrans-73.6-19.6177.7-71.3158.8000113.3M13 V14 A15 S19 Y20 F21 I29M13-L17 WeakPolarHBondContact O-CD1 3.2Å; M13-L17 WeakPolarHBondContact O-CG 3.38Å; M13-L17 PolarHBondContact O-N 3.38Å; V14-L17 WeakPolarHBondContact O-CB 3.32Å; V14-L17 PolarHBondContact O-N 2.9Å; V14-L17 VanDerWaalsContact O-N 3.1Å; A15-L17 VanDerWaalsContact C-N 3.32Å; A15-L17 PolarHBondContact O-N 2.69Å; L17-S19 PolarHBondContact O-N 3.01Å; L17-Y20 PolarHBondContact O-N 2.86Å; L17-Y20 VanDerWaalsContact O-N 3.11Å; L17-F21 HydrophobicContact CB-CD2 4.17Å; L17-F21 HydrophobicContact CD2-CD2 3.61Å; L17-F21 HydrophobicContact CD2-CE2 3.35Å; L17-F21 HydrophobicContact CD2-CZ 4.47Å; L17-F21 PolarHBondContact O-N 3.29Å; L17-I29 HydrophobicContact CD1-CG2 4.21Å
18Y72Confident74.3Confident108 Ų10884.1 Ų84.142%0.42445%0.452SS..THydrogen-bonded Turntrans-60.6-24.4177.8-89.2-84000113.7V14 A15 E16 I26 K30V14-Y18 HydrophobicContact CG1-CD2 4.2Å; V14-Y18 HydrophobicContact CG1-CE2 3.82Å; V14-Y18 WeakPolarHBondContact O-CD2 3.42Å; V14-Y18 PolarHBondContact O-N 3.1Å; V14-Y18 VanDerWaalsContact O-N 3.14Å; A15-Y18 PolarHBondContact O-N 3.32Å; E16-Y18 VanDerWaalsContact C-N 3.32Å; E16-Y18 PolarHBondContact O-N 3.35Å; Y18-I26 HydrophobicContact CD1-CD1 3.3Å; Y18-I26 HydrophobicContact CD1-CG2 4.49Å; Y18-I26 HydrophobicContact CD2-CD1 4.38Å; Y18-I26 HydrophobicContact CD2-CG2 4.33Å; Y18-I26 HydrophobicContact CE1-CD1 3.67Å; Y18-I26 HydrophobicContact CE1-CG2 3.99Å; Y18-I26 HydrophobicContact CE2-CG2 3.85Å; Y18-I26 HydrophobicContact CG-CD1 3.69Å; Y18-K30 PolarHBondContact OH-NZ 3.13Å
19S72.6Confident75Confident101 Ų10181.4 Ų81.471%0.70644%0.437SS*.THydrogen-bonded Turntrans-79.2-19.1178.5-171.10000113.9L17L17-S19 PolarHBondContact O-N 3.01Å
20Y71.2Confident75.5Confident188 Ų18883.2 Ų83.274%0.73744%0.436SS*.THydrogen-bonded Turntrans-112.7-20.5-169.7-67.2-80.1000113.4L17L17-Y20 PolarHBondContact O-N 2.86Å; L17-Y20 VanDerWaalsContact O-N 3.11Å
21F78.1Confident76.3Confident84 Ų8490.6 Ų90.637%0.36846%0.463SS..SBendtrans-123.6151.7-169.9-69.3-78.4000111.5L17 Q25 I26 I29L17-F21 HydrophobicContact CB-CD2 4.17Å; L17-F21 HydrophobicContact CD2-CD2 3.61Å; L17-F21 HydrophobicContact CD2-CE2 3.35Å; L17-F21 HydrophobicContact CD2-CZ 4.47Å; L17-F21 PolarHBondContact O-N 3.29Å; F21-Q25 HydrophobicContact CB-CB 3.93Å; F21-Q25 HydrophobicContact CD1-CB 4.05Å; F21-Q25 HydrophobicContact CD1-CG 4.44Å; F21-Q25 HydrophobicContact CG-CB 4.38Å; F21-I26 HydrophobicContact CB-CD1 4.31Å; F21-I26 HydrophobicContact CB-CG1 3.76Å; F21-I26 WeakPolarHBondContact O-CD1 3.16Å; F21-I29 HydrophobicContact CD2-CD1 4.42Å; F21-I29 HydrophobicContact CG-CD1 4.38Å
22T81.5Confident77Confident81 Ų8188.9 Ų88.950%0.49746%0.46SS..  trans-68.4154.4170.758.20000110.6V24 Q25 I26T22-V24 PolarHBondContact O-N 3.09Å; T22-Q25 WeakPolarHBondContact O-CB 3.26Å; T22-Q25 PolarHBondContact O-N 2.8Å; T22-Q25 WeakPolarHBondContact OG1-CG 3.37Å; T22-Q25 PolarHBondContact OG1-OE1 2.67Å; T22-I26 WeakPolarHBondContact O-CG1 3.34Å; T22-I26 PolarHBondContact O-N 2.65Å
23D78.8Confident77.4Confident118 Ų11887.8 Ų87.863%0.63145%0.448SS*.Hα-helixtrans-53-32.2178.4-73-37000113.5S27D23-S27 WeakPolarHBondContact O-CB 3.29Å; D23-S27 PolarHBondContact O-N 3.22Å; D23-S27 PolarHBondContact O-OG 3.22Å
24V79.1Confident77.9Confident116 Ų11686.3 Ų86.370%0.70345%0.445SS*.Hα-helixtrans-66.9-46.6176.1-178.90000111T22 I26 S27 F28T22-V24 PolarHBondContact O-N 3.09Å; V24-I26 VanDerWaalsContact C-N 3.33Å; V24-I26 PolarHBondContact O-N 2.87Å; V24-S27 PolarHBondContact O-N 3.46Å; V24-F28 PolarHBondContact O-N 3.36Å
25Q81Confident78.6Confident88 Ų8888 Ų8841%0.41146%0.459SS..Hα-helixtrans-64.6-39.4177.6-73.7166.5-36.900111.2F21 T22 S27 F28 I29F21-Q25 HydrophobicContact CB-CB 3.93Å; F21-Q25 HydrophobicContact CD1-CB 4.05Å; F21-Q25 HydrophobicContact CD1-CG 4.44Å; F21-Q25 HydrophobicContact CG-CB 4.38Å; T22-Q25 WeakPolarHBondContact O-CB 3.26Å; T22-Q25 PolarHBondContact O-N 2.8Å; T22-Q25 WeakPolarHBondContact OG1-CG 3.37Å; T22-Q25 PolarHBondContact OG1-OE1 2.67Å; Q25-S27 VanDerWaalsContact C-N 3.35Å; Q25-S27 PolarHBondContact O-N 3.41Å; Q25-F28 WeakPolarHBondContact O-CB 3.44Å; Q25-F28 PolarHBondContact O-N 2.61Å; Q25-I29 VanDerWaalsContact O-CG1 3.22Å; Q25-I29 WeakPolarHBondContact O-CG1 3.34Å; Q25-I29 PolarHBondContact O-N 3.43Å
26I76.8Confident79.3Confident1 Ų190.8 Ų90.81%0.00547%0.465CS..Hα-helixtrans-65.4-41.7177.3-63.4163.4000111V14 Y18 F21 T22 V24 F28 I29 K30V14-I26 HydrophobicContact CG1-CG2 3.5Å; V14-I26 VanDerWaalsContact CG1-CG2 3.5Å; Y18-I26 HydrophobicContact CD1-CD1 3.3Å; Y18-I26 HydrophobicContact CD1-CG2 4.49Å; Y18-I26 HydrophobicContact CD2-CD1 4.38Å; Y18-I26 HydrophobicContact CD2-CG2 4.33Å; Y18-I26 HydrophobicContact CE1-CD1 3.67Å; Y18-I26 HydrophobicContact CE1-CG2 3.99Å; Y18-I26 HydrophobicContact CE2-CG2 3.85Å; Y18-I26 HydrophobicContact CG-CD1 3.69Å; F21-I26 HydrophobicContact CB-CD1 4.31Å; F21-I26 HydrophobicContact CB-CG1 3.76Å; F21-I26 WeakPolarHBondContact O-CD1 3.16Å; T22-I26 WeakPolarHBondContact O-CG1 3.34Å; T22-I26 PolarHBondContact O-N 2.65Å; V24-I26 VanDerWaalsContact C-N 3.33Å; V24-I26 PolarHBondContact O-N 2.87Å; I26-F28 VanDerWaalsContact C-N 3.31Å; I26-F28 PolarHBondContact O-N 3.27Å; I26-I29 PolarHBondContact O-N 3.27Å; I26-K30 HydrophobicContact CG2-CD 4.49Å; I26-K30 WeakPolarHBondContact O-CG 3.19Å; I26-K30 PolarHBondContact O-N 3.13Å
27S79.8Confident79.8Confident74 Ų7486.7 Ų86.752%0.51745%0.448SS..Hα-helixtrans-62.2-41.3175.5-60.90000111.5D23 V24 Q25 K30 Y31D23-S27 WeakPolarHBondContact O-CB 3.29Å; D23-S27 PolarHBondContact O-N 3.22Å; D23-S27 PolarHBondContact O-OG 3.22Å; V24-S27 PolarHBondContact O-N 3.46Å; Q25-S27 VanDerWaalsContact C-N 3.35Å; Q25-S27 PolarHBondContact O-N 3.41Å; S27-K30 PolarHBondContact O-N 2.67Å; S27-Y31 WeakPolarHBondContact O-CB 3.05Å; S27-Y31 PolarHBondContact O-N 2.8Å
28F84.9Confident80.4Confident149 Ų14988.3 Ų88.365%0.65446%0.459SS*.Hα-helixtrans-63.2-45173.8-178.1-98.2000112.1V24 Q25 I26 Y31 A32V24-F28 PolarHBondContact O-N 3.36Å; Q25-F28 WeakPolarHBondContact O-CB 3.44Å; Q25-F28 PolarHBondContact O-N 2.61Å; I26-F28 VanDerWaalsContact C-N 3.31Å; I26-F28 PolarHBondContact O-N 3.27Å; F28-Y31 PolarHBondContact O-N 2.85Å; F28-A32 WeakPolarHBondContact O-CB 3.23Å; F28-A32 PolarHBondContact O-N 2.96Å
29I82.2Confident80.9Confident39 Ų3987 Ų8720%0.246%0.462CS..Hα-helixtrans-61.9-45.5177.6-68.8162.6000110.7L17 F21 Q25 I26 Y31 A32 I33L17-I29 HydrophobicContact CD1-CG2 4.21Å; F21-I29 HydrophobicContact CD2-CD1 4.42Å; F21-I29 HydrophobicContact CG-CD1 4.38Å; Q25-I29 VanDerWaalsContact O-CG1 3.22Å; Q25-I29 WeakPolarHBondContact O-CG1 3.34Å; Q25-I29 PolarHBondContact O-N 3.43Å; I26-I29 PolarHBondContact O-N 3.27Å; I29-Y31 VanDerWaalsContact C-N 3.31Å; I29-Y31 PolarHBondContact O-N 3.34Å; I29-A32 PolarHBondContact O-N 3.3Å; I29-I33 HydrophobicContact CG2-CD1 3.58Å; I29-I33 HydrophobicContact CG2-CG1 4.22Å; I29-I33 VanDerWaalsContact O-CG1 3.31Å; I29-I33 WeakPolarHBondContact O-CG1 3.28Å; I29-I33 PolarHBondContact O-N 2.8Å
30K81.7Confident81.1Confident70 Ų7084.9 Ų84.930%0.30445%0.448SS..Hα-helixtrans-57.4-44.9175.1-75.3-177.7-176.6-178.10111.5V14 Y18 I26 S27 T34V14-K30 HydrophobicContact CG1-CD 4.23Å; V14-K30 HydrophobicContact CG1-CG 3.91Å; V14-K30 HydrophobicContact CG2-CG 4.09Å; Y18-K30 PolarHBondContact OH-NZ 3.13Å; I26-K30 HydrophobicContact CG2-CD 4.49Å; I26-K30 WeakPolarHBondContact O-CG 3.19Å; I26-K30 PolarHBondContact O-N 3.13Å; S27-K30 PolarHBondContact O-N 2.67Å; K30-T34 VanDerWaalsContact O-CB 3.27Å; K30-T34 WeakPolarHBondContact O-CB 3.34Å; K30-T34 PolarHBondContact O-N 3.23Å; K30-T34 PolarHBondContact O-OG1 3.44Å
31Y85.4Confident81.4Confident174 Ų17479.2 Ų79.268%0.68243%0.433SS*.Hα-helixtrans-63-46.2177.2-179.1-98.8000111.8S27 F28 I29 T34 A35S27-Y31 WeakPolarHBondContact O-CB 3.05Å; S27-Y31 PolarHBondContact O-N 2.8Å; F28-Y31 PolarHBondContact O-N 2.85Å; I29-Y31 VanDerWaalsContact C-N 3.31Å; I29-Y31 PolarHBondContact O-N 3.34Å; Y31-T34 PolarHBondContact O-N 3.34Å; Y31-A35 VanDerWaalsContact O-CB 3.28Å; Y31-A35 WeakPolarHBondContact O-CB 3.16Å; Y31-A35 PolarHBondContact O-N 3Å
32A86.2Confident81.1Confident44 Ų4478.3 Ų78.336%0.36444%0.437SS..Hα-helixtrans-62.3-46.4179.400000112.4F28 I29 A35 L36F28-A32 WeakPolarHBondContact O-CB 3.23Å; F28-A32 PolarHBondContact O-N 2.96Å; I29-A32 PolarHBondContact O-N 3.3Å; A32-A35 PolarHBondContact O-N 3.15Å; A32-L36 WeakPolarHBondContact O-CB 3.38Å; A32-L36 PolarHBondContact O-N 3.33Å
33I83.2Confident80.7Confident49 Ų4979.7 Ų79.725%0.25144%0.436SS..Hα-helixtrans-63.3-44.5177.1-65.3169.3000110.4V10 V14 I29 L36 L37V10-I33 HydrophobicContact CB-CG2 4.32Å; V10-I33 HydrophobicContact CG1-CB 4.34Å; V10-I33 HydrophobicContact CG1-CD1 4.22Å; V10-I33 HydrophobicContact CG1-CG2 3.66Å; V10-I33 HydrophobicContact CG2-CG2 3.59Å; V14-I33 HydrophobicContact CG2-CD1 4.3Å; I29-I33 HydrophobicContact CG2-CD1 3.58Å; I29-I33 HydrophobicContact CG2-CG1 4.22Å; I29-I33 VanDerWaalsContact O-CG1 3.31Å; I29-I33 WeakPolarHBondContact O-CG1 3.28Å; I29-I33 PolarHBondContact O-N 2.8Å; I33-L36 PolarHBondContact O-N 3.19Å; I33-L37 HydrophobicContact CG2-CD1 4.08Å; I33-L37 HydrophobicContact CG2-CG 4.45Å; I33-L37 WeakPolarHBondContact O-CG 3.5Å; I33-L37 PolarHBondContact O-N 3.06Å
34T81.2Confident80.4Confident78 Ų7880.4 Ų80.448%0.47943%0.431SS..Hα-helixtrans-63.3-44.6178.8-55.30000111.1K30 Y31 L36 L37 V38K30-T34 VanDerWaalsContact O-CB 3.27Å; K30-T34 WeakPolarHBondContact O-CB 3.34Å; K30-T34 PolarHBondContact O-N 3.23Å; K30-T34 PolarHBondContact O-OG1 3.44Å; Y31-T34 PolarHBondContact O-N 3.34Å; T34-L36 VanDerWaalsContact C-N 3.33Å; T34-L36 PolarHBondContact O-N 3.19Å; T34-L37 PolarHBondContact O-N 3.14Å; T34-V38 HydrophobicContact CG2-CG2 4.47Å; T34-V38 VanDerWaalsContact O-CG2 3.29Å; T34-V38 WeakPolarHBondContact O-CG2 3.46Å; T34-V38 PolarHBondContact O-N 2.98Å
35A84.8Confident80.1Confident36 Ų3680.2 Ų80.230%0.29843%0.426SS..Hα-helixtrans-61.7-40.6175.900000111.6Y31 A32 V38 T39Y31-A35 VanDerWaalsContact O-CB 3.28Å; Y31-A35 WeakPolarHBondContact O-CB 3.16Å; Y31-A35 PolarHBondContact O-N 3Å; A32-A35 PolarHBondContact O-N 3.15Å; A35-V38 PolarHBondContact O-N 3.28Å; A35-T39 WeakPolarHBondContact O-CB 3.47Å; A35-T39 VanDerWaalsContact O-CG2 3.26Å; A35-T39 WeakPolarHBondContact O-CG2 3.44Å; A35-T39 PolarHBondContact O-N 3.42Å; A35-T39 PolarHBondContact O-OG1 2.66Å
36L85.8Confident79.6Confident121 Ų12180 Ų8063%0.63443%0.427SS*.Hα-helixtrans-65.4-40.2175.8-171.268.5000111.9A32 I33 T34 T39 S40A32-L36 WeakPolarHBondContact O-CB 3.38Å; A32-L36 PolarHBondContact O-N 3.33Å; I33-L36 PolarHBondContact O-N 3.19Å; T34-L36 VanDerWaalsContact C-N 3.33Å; T34-L36 PolarHBondContact O-N 3.19Å; L36-T39 WeakPolarHBondContact CA-OG1 3.37Å; L36-T39 PolarHBondContact O-OG1 3.43Å; L36-T39 VanDerWaalsContact O-OG1 3.08Å; L36-S40 WeakPolarHBondContact O-CB 3.42Å; L36-S40 PolarHBondContact O-N 2.82Å; L36-S40 PolarHBondContact O-OG 3.05Å
37L81.7Confident79Confident54 Ų5488.1 Ų88.128%0.28346%0.457SS..Hα-helixtrans-65.8-43175.3-74.9173.2000111.8V10 I33 T34 S40 T41V10-L37 HydrophobicContact CG2-CD1 3.95Å; I33-L37 HydrophobicContact CG2-CD1 4.08Å; I33-L37 HydrophobicContact CG2-CG 4.45Å; I33-L37 WeakPolarHBondContact O-CG 3.5Å; I33-L37 PolarHBondContact O-N 3.06Å; T34-L37 PolarHBondContact O-N 3.14Å; L37-S40 WeakPolarHBondContact CA-OG 3.35Å; L37-S40 PolarHBondContact O-OG 2.92Å; L37-S40 VanDerWaalsContact O-OG 3.04Å; L37-T41 WeakPolarHBondContact O-CB 3.31Å; L37-T41 WeakPolarHBondContact O-CG2 3.34Å; L37-T41 PolarHBondContact O-N 3.07Å; L37-T41 PolarHBondContact O-OG1 3.38Å
38V81Confident78.4Confident81 Ų8189.9 Ų89.949%0.49146%0.456SS..Hα-helixtrans-66.3-43.7177.5172.20000111.2T34 A35 T41 S42T34-V38 HydrophobicContact CG2-CG2 4.47Å; T34-V38 VanDerWaalsContact O-CG2 3.29Å; T34-V38 WeakPolarHBondContact O-CG2 3.46Å; T34-V38 PolarHBondContact O-N 2.98Å; A35-V38 PolarHBondContact O-N 3.28Å; V38-T41 WeakPolarHBondContact CA-OG1 3.27Å; V38-T41 PolarHBondContact O-OG1 2.94Å; V38-T41 VanDerWaalsContact O-OG1 3.05Å; V38-S42 WeakPolarHBondContact O-CB 3.36Å; V38-S42 PolarHBondContact O-N 2.86Å; V38-S42 PolarHBondContact O-OG 3.31Å
39T81.3Confident77.2Confident81 Ų8186.3 Ų86.350%0.49745%0.449SS..Hα-helixtrans-69.7-41.417951.20000111.8A35 L36 S42 F43A35-T39 WeakPolarHBondContact O-CB 3.47Å; A35-T39 VanDerWaalsContact O-CG2 3.26Å; A35-T39 WeakPolarHBondContact O-CG2 3.44Å; A35-T39 PolarHBondContact O-N 3.42Å; A35-T39 PolarHBondContact O-OG1 2.66Å; L36-T39 WeakPolarHBondContact CA-OG1 3.37Å; L36-T39 PolarHBondContact O-OG1 3.43Å; L36-T39 VanDerWaalsContact O-OG1 3.08Å; T39-S42 PolarHBondContact O-N 2.83Å; T39-F43 WeakPolarHBondContact O-CB 3.34Å; T39-F43 PolarHBondContact O-N 2.86Å
40S78.3Confident76.1Confident57 Ų5790.8 Ų90.840%0.39947%0.473SS..Hα-helixtrans-67.2-40.9176.861.40000112.5L36 L37 F43 Y44L36-S40 WeakPolarHBondContact O-CB 3.42Å; L36-S40 PolarHBondContact O-N 2.82Å; L36-S40 PolarHBondContact O-OG 3.05Å; L37-S40 WeakPolarHBondContact CA-OG 3.35Å; L37-S40 PolarHBondContact O-OG 2.92Å; L37-S40 VanDerWaalsContact O-OG 3.04Å; S40-F43 PolarHBondContact O-N 3.44Å; S40-Y44 WeakPolarHBondContact O-CB 3.41Å; S40-Y44 PolarHBondContact O-N 3.2Å
41T75.9Confident75.1Confident69 Ų6990.7 Ų90.742%0.42349%0.492SS..Hα-helixtrans-66.7-41.3173.847.50000111.7L37 V38 Y44 L45L37-T41 WeakPolarHBondContact O-CB 3.31Å; L37-T41 WeakPolarHBondContact O-CG2 3.34Å; L37-T41 PolarHBondContact O-N 3.07Å; L37-T41 PolarHBondContact O-OG1 3.38Å; V38-T41 WeakPolarHBondContact CA-OG1 3.27Å; V38-T41 PolarHBondContact O-OG1 2.94Å; V38-T41 VanDerWaalsContact O-OG1 3.05Å; T41-Y44 PolarHBondContact O-N 3.32Å; T41-L45 WeakPolarHBondContact O-CB 3.44Å; T41-L45 VanDerWaalsContact O-CG 3.23Å; T41-L45 WeakPolarHBondContact O-CG 3.39Å; T41-L45 PolarHBondContact O-N 3.05Å
42S73.3Confident73.6Confident65 Ų6590.1 Ų90.146%0.45549%0.493SS..Hα-helixtrans-62-44.3174.3-61.30000111.5V38 T39 L45 L46V38-S42 WeakPolarHBondContact O-CB 3.36Å; V38-S42 PolarHBondContact O-N 2.86Å; V38-S42 PolarHBondContact O-OG 3.31Å; T39-S42 PolarHBondContact O-N 2.83Å; S42-L45 PolarHBondContact O-N 3.33Å; S42-L46 WeakPolarHBondContact O-CB 3.22Å; S42-L46 PolarHBondContact O-N 3.05Å
43F72.8Confident71.7Confident109 Ų10995.6 Ų95.648%0.47851%0.511SS..Hα-helixtrans-69.4-36178-169.3-103.9000112.3T39 S40 L46 R47T39-F43 WeakPolarHBondContact O-CB 3.34Å; T39-F43 PolarHBondContact O-N 2.86Å; S40-F43 PolarHBondContact O-N 3.44Å; F43-L46 PolarHBondContact O-N 2.69Å; F43-R47 HydrophobicContact CD1-CG 4.4Å; F43-R47 HydrophobicContact CE1-CG 4.12Å; F43-R47 VanDerWaalsContact CE1-CZ 3.45Å; F43-R47 HydrophobicContact CZ-CG 4.43Å; F43-R47 WeakPolarHBondContact O-CB 3.41Å; F43-R47 PolarHBondContact O-N 3.37Å
44Y72.5Confident70Confident133 Ų13398.4 Ų98.452%0.52253%0.532SS..Hα-helixtrans-65-42.9172.9178.4-101.1000111.6S40 T41 R47 K48S40-Y44 WeakPolarHBondContact O-CB 3.41Å; S40-Y44 PolarHBondContact O-N 3.2Å; T41-Y44 PolarHBondContact O-N 3.32Å; Y44-R47 PolarHBondContact O-N 3.42Å; Y44-K48 HydrophobicContact CD1-CD 4.17Å; Y44-K48 HydrophobicContact CE1-CD 3.51Å; Y44-K48 HydrophobicContact CE1-CG 4.28Å; Y44-K48 VanDerWaalsContact CZ-CE 3.44Å; Y44-K48 WeakPolarHBondContact O-CB 3.37Å; Y44-K48 PolarHBondContact O-N 3.25Å; Y44-K48 WeakPolarHBondContact OH-CE 3.39Å; Y44-K48 PolarHBondContact OH-NZ 2.84Å
45L72.2Confident68.3Low113 Ų113100.7 Ų100.759%0.59255%0.546SS*.Hα-helixtrans-64.7-40.9173.8-72.3170.7000111.3T41 S42 K48 S49T41-L45 WeakPolarHBondContact O-CB 3.44Å; T41-L45 VanDerWaalsContact O-CG 3.23Å; T41-L45 WeakPolarHBondContact O-CG 3.39Å; T41-L45 PolarHBondContact O-N 3.05Å; S42-L45 PolarHBondContact O-N 3.33Å; L45-K48 PolarHBondContact O-N 3.35Å; L45-S49 WeakPolarHBondContact O-CB 3.17Å; L45-S49 PolarHBondContact O-N 2.87Å
46L70.9Confident66.3Low84 Ų84103.8 Ų103.844%0.4456%0.561SS.*Hα-helixtrans-63-48.9175.9-163.774.2000110.9S42 F43 K48 S49 L50S42-L46 WeakPolarHBondContact O-CB 3.22Å; S42-L46 PolarHBondContact O-N 3.05Å; F43-L46 PolarHBondContact O-N 2.69Å; L46-K48 VanDerWaalsContact C-N 3.34Å; L46-K48 PolarHBondContact O-N 2.91Å; L46-S49 PolarHBondContact O-N 2.8Å; L46-S49 PolarHBondContact O-OG 2.79Å; L46-L50 HydrophobicContact CD2-CD1 4.49Å; L46-L50 HydrophobicContact CG-CD1 3.99Å; L46-L50 WeakPolarHBondContact O-CD1 3.38Å; L46-L50 WeakPolarHBondContact O-CG 3.43Å; L46-L50 PolarHBondContact O-N 3.43Å
47R64.8Low64.4Low170 Ų170103.4 Ų103.464%0.64256%0.563SS**Hα-helixtrans-60.5-40.9174-85.7-167.9176.2171.53112.4F43 Y44 S49 L50 G51F43-R47 HydrophobicContact CD1-CG 4.4Å; F43-R47 HydrophobicContact CE1-CG 4.12Å; F43-R47 VanDerWaalsContact CE1-CZ 3.45Å; F43-R47 HydrophobicContact CZ-CG 4.43Å; F43-R47 WeakPolarHBondContact O-CB 3.41Å; F43-R47 PolarHBondContact O-N 3.37Å; Y44-R47 PolarHBondContact O-N 3.42Å; R47-S49 VanDerWaalsContact C-N 3.27Å; R47-S49 PolarHBondContact O-N 3.49Å; R47-L50 PolarHBondContact O-N 2.81Å; R47-G51 PolarHBondContact O-N 3.37Å
48K65.4Low62.6Low111 Ų111106.9 Ų106.948%0.48358%0.583SS.*Hα-helixtrans-63.7-32.7173.8-92.1-171.5159.5170.60112.6Y44 L45 L46 K52Y44-K48 HydrophobicContact CD1-CD 4.17Å; Y44-K48 HydrophobicContact CE1-CD 3.51Å; Y44-K48 HydrophobicContact CE1-CG 4.28Å; Y44-K48 VanDerWaalsContact CZ-CE 3.44Å; Y44-K48 WeakPolarHBondContact O-CB 3.37Å; Y44-K48 PolarHBondContact O-N 3.25Å; Y44-K48 WeakPolarHBondContact OH-CE 3.39Å; Y44-K48 PolarHBondContact OH-NZ 2.84Å; L45-K48 PolarHBondContact O-N 3.35Å; L46-K48 VanDerWaalsContact C-N 3.34Å; L46-K48 PolarHBondContact O-N 2.91Å; K48-K52 PolarHBondContact O-N 2.86Å
49S60.8Low61Low74 Ų74108.2 Ų108.252%0.51759%0.591SS.*Hα-helixtrans-75.6-31.8176.575.70000112.9L45 L46 R47L45-S49 WeakPolarHBondContact O-CB 3.17Å; L45-S49 PolarHBondContact O-N 2.87Å; L46-S49 PolarHBondContact O-N 2.8Å; L46-S49 PolarHBondContact O-OG 2.79Å; R47-S49 VanDerWaalsContact C-N 3.27Å; R47-S49 PolarHBondContact O-N 3.49Å
50L59.8Low59.4Low133 Ų133113.1 Ų113.170%0.69661%0.605SS**Hα-helixtrans-81.3-27.1176.4-75.3154000113L46 R47L46-L50 HydrophobicContact CD2-CD1 4.49Å; L46-L50 HydrophobicContact CG-CD1 3.99Å; L46-L50 WeakPolarHBondContact O-CD1 3.38Å; L46-L50 WeakPolarHBondContact O-CG 3.43Å; L46-L50 PolarHBondContact O-N 3.43Å; R47-L50 PolarHBondContact O-N 2.81Å
51G60.2Low58.4Low68 Ų68119.6 Ų119.670%0.70163%0.626SS**SBendtrans-88.3-5.8179.400000114.9R47R47-G51 PolarHBondContact O-N 3.37Å
52K52.9Low57.3Low162 Ų162121 Ų12170%0.70464%0.639SS**SBendtrans-81.8123.1159.8-72.5-179.7-179.8-173.20105.6K48K48-K52 PolarHBondContact O-N 2.86Å
53E47.8Very low56.7Low160 Ų160128 Ų12875%0.74866%0.661SS**  trans-31.4136.8174.4-91.5-168.5151.300110.1V55E53-V55 PolarHBondContact O-N 2.82Å
54P47Very low55.8Low108 Ų108127.8 Ų127.870%0.70167%0.669SS**  trans-49.4117.1166.924-31.1000104.2T56P54-T56 PolarHBondContact O-N 2.64Å
55V44.9Very low54.8Low125 Ų125131.7 Ų131.776%0.75868%0.683SS**  trans-42.9109.5169168.10000102.1E53 V57E53-V55 PolarHBondContact O-N 2.82Å; V55-V57 WeakPolarHBondContact O-CG2 3.41Å; V55-V57 PolarHBondContact O-N 3.17Å
56T43.7Very low54Low101 Ų101132 Ų13262%0.6269%0.69SS**  trans-63.295.6178.326.90000100.3P54 N58P54-T56 PolarHBondContact O-N 2.64Å; T56-N58 PolarHBondContact O-N 3.32Å
57V44.7Very low53.6Low113 Ų113136.2 Ų136.269%0.68570%0.704SS**  trans-66.885.3166-167.2000099.4V55 T59V55-V57 WeakPolarHBondContact O-CG2 3.41Å; V55-V57 PolarHBondContact O-N 3.17Å; V57-T59 HydrophobicContact CB-CG2 4.39Å; V57-T59 HydrophobicContact CG1-CG2 3.79Å; V57-T59 PolarHBondContact O-N 3.08Å
58N44.6Very low53.4Low128 Ų128137.8 Ų137.868%0.68472%0.716SS**  trans-66.181.2170.6-123.8-22.8000101.2T56 K60T56-N58 PolarHBondContact O-N 3.32Å; N58-K60 PolarHBondContact O-N 2.76Å
59T46.6Very low53Low109 Ų109137.7 Ų137.767%0.66973%0.729SS**  trans-69.764.8161.258.90000104.5V57 K61V57-T59 HydrophobicContact CB-CG2 4.39Å; V57-T59 HydrophobicContact CG1-CG2 3.79Å; V57-T59 PolarHBondContact O-N 3.08Å; T59-K61 PolarHBondContact O-N 2.88Å
60K49.6Very low52.8Low183 Ų183143.9 Ų143.980%0.79675%0.747SS**  trans-54.797.7145.4-84.1-173.9175.9178.40102.6N58 S62N58-K60 PolarHBondContact O-N 2.76Å; K60-S62 PolarHBondContact O-N 2.74Å; K60-S62 VanDerWaalsContact O-N 3.1Å
61K56.5Low52.6Low193 Ų193142.8 Ų142.884%0.83975%0.75SS**  trans-42.1125.2167.1-68-176.3176.6-177.70105.1T59 K63T59-K61 PolarHBondContact O-N 2.88Å; K61-K63 PolarHBondContact O-N 3.25Å
62S53.6Low52.5Low100 Ų100149.3 Ų149.370%0.69976%0.759SS**  trans-52.9117.4170.544.30000105.9K60 T64K60-S62 PolarHBondContact O-N 2.74Å; K60-S62 VanDerWaalsContact O-N 3.1Å; S62-T64 PolarHBondContact O-N 2.86Å; S62-T64 PolarHBondContact O-OG1 3.26Å; S62-T64 PolarHBondContact OG-OG1 3.44Å
63K59.5Low52.5Low210 Ų210146.8 Ų146.891%0.91376%0.762SS**  trans-73.273.3171.9-161.4172.4-173.9176.40105.3K61 R65K61-K63 PolarHBondContact O-N 3.25Å; K63-R65 PolarHBondContact O-N 2.9Å
64T53.6Low52.9Low106 Ų106144.6 Ų144.665%0.6576%0.764SS**  trans-65.2102.6174.2-440000105.4S62 V66S62-T64 PolarHBondContact O-N 2.86Å; S62-T64 PolarHBondContact O-OG1 3.26Å; S62-T64 PolarHBondContact OG-OG1 3.44Å; T64-V66 PolarHBondContact O-N 3.42Å
65R51.3Low53Low215 Ų215147.3 Ų147.381%0.81177%0.773SS**  trans-63.592.2170.8178.9179.7171.4-173.7-1.1106.6K63 K67K63-R65 PolarHBondContact O-N 2.9Å; R65-K67 PolarHBondContact O-N 2.92Å
66V55.9Low53.2Low120 Ų120144.2 Ų144.273%0.72777%0.766SS**  trans-61.9104.4166.3-179.60000105.8T64 K68T64-V66 PolarHBondContact O-N 3.42Å; V66-K68 PolarHBondContact O-N 3.04Å
67K62Low53.5Low171 Ų171150.6 Ų150.674%0.74378%0.779SS**  trans-62.7109.2164.5-79.7-176.7175.7178.70105.4R65 S69R65-K67 PolarHBondContact O-N 2.92Å; K67-S69 PolarHBondContact O-N 2.83Å
68K60.8Low53.8Low204 Ų204150.7 Ų150.789%0.88778%0.78SS**  trans-59.9102168.1-68.2-176.5177-177.60107V66V66-K68 PolarHBondContact O-N 3.04Å
69S56.5Low53.9Low109 Ų109149.6 Ų149.676%0.76278%0.782SS**  trans-66.5130.2163.634.10000107.5K67 S71K67-S69 PolarHBondContact O-N 2.83Å; S69-S71 PolarHBondContact O-N 2.68Å
70K57.5Low53.8Low204 Ų204150 Ų15089%0.88779%0.789SS**  trans-72.689.2179.8-158.1175.9-172.5177.10107.2K72K70-K72 PolarHBondContact O-N 3.34Å
71S56.7Low53.9Low110 Ų110147 Ų14777%0.76979%0.791SS**  trans-71.2112.116942.70000108.1S69 S73S69-S71 PolarHBondContact O-N 2.68Å; S71-S73 PolarHBondContact O-N 2.89Å; S71-S73 VanDerWaalsContact O-N 3.15Å
72K57Low53.2Low205 Ų205145.6 Ų145.689%0.89179%0.793SS**  trans-65.3104.1163.1-81.2178.6170.1176.70106.7K70K70-K72 PolarHBondContact O-N 3.34Å
73S52.4Low52.8Low108 Ų108144.3 Ų144.376%0.75580%0.795SS**  trans-79.5115.4160.156.90000107.2S71 D75S71-S73 PolarHBondContact O-N 2.89Å; S71-S73 VanDerWaalsContact O-N 3.15Å; S73-D75 PolarHBondContact O-N 3.21Å
74S57Low52.1Low114 Ų114141.7 Ų141.780%0.79779%0.791SS**  trans-76.5113.6162.948.90000107.3G76S74-G76 PolarHBondContact O-N 3.19Å
75D49.8Very low51.7Low165 Ų165145.5 Ų145.588%0.88280%0.801SS**  trans-56.3121.9166.7-89.5-37.5000109.5S73S73-D75 PolarHBondContact O-N 3.21Å
76G47.8Very low51.5Low60 Ų60139.4 Ų139.462%0.61980%0.797SS**  trans-126.3103168.500000108.3S74S74-G76 PolarHBondContact O-N 3.19Å
77R50.7Low50.9Low235 Ų235142.7 Ų142.789%0.88780%0.804SS**  trans64.7133.1145.6-67.8177.6159.6130.4-4.3114.6
78T50.5Low50.2Low116 Ų116142.5 Ų142.571%0.71281%0.81SS**  cis174.9148.631.213.40000106.8
79S47.6Very low49.8Very low104 Ų104142.2 Ų142.273%0.72781%0.809SS**  trans71108.5143.9-45.70000120.8
80S44.6Very low49.5Very low117 Ų117146.3 Ų146.382%0.81881%0.813SS**  trans-0.6130.2141.9580000119.7
81S49.9Very low49Very low120 Ų120141.7 Ų141.784%0.83981%0.806SS**  trans-156124.9133.9-175.80000108.8
82D43.4Very low48.6Very low165 Ų165142.6 Ų142.688%0.88281%0.807SS**  trans-55.9147.2167.4-89.8-41.2000111.2
83G44.5Very low48.2Very low72 Ų72138.6 Ų138.674%0.74280%0.799SS**  trans-17971.2179.100000110.3H85G83-H85 PolarHBondContact O-N 3.46Å
84D44.2Very low48.4Very low155 Ų155138.2 Ų138.283%0.82979%0.794SS**  trans-52.7121.5160.7-83.6-36.6000109.4
85H44.9Very low48.2Very low186 Ų186138.4 Ų138.486%0.86179%0.793SS**  trans-167.1114.8142.9-99.9-60.8000111.9G83G83-H85 PolarHBondContact O-N 3.46Å
86A48.6Very low48.2Very low87 Ų87142.3 Ų142.372%0.71980%0.795SS**  trans54.2110.3136.200000119.9I88A86-I88 PolarHBondContact O-N 3.18Å
87E42.2Very low48.1Very low189 Ų189146.6 Ų146.688%0.88380%0.804SS**  trans-31.1121.5153.8-59.6177.3150.800115.1
88I47Very low47.7Very low168 Ų168141.3 Ų141.386%0.86280%0.798SS**  trans-129117.1153.4-60.9179.7000109A86A86-I88 PolarHBondContact O-N 3.18Å
89K53.8Low47.3Very low198 Ų198142 Ų14286%0.86180%0.802SS**  trans-57.6134.4-178.6-68.7172.2176.5174.10112
90K48.7Very low47.3Very low194 Ų194144.3 Ų144.384%0.84381%0.805SS**  trans-61.3140.4167.8-68.6171.9178.5171.20111.1
91S46.6Very low47.3Very low108 Ų108145.8 Ų145.876%0.75580%0.8SS**  trans-87.3109.7154.866.10000109.7V93S91-V93 PolarHBondContact O-N 3.16Å
92V49.1Very low46.8Very low129 Ų129147.9 Ų147.978%0.78280%0.803SS**  trans-74.6107.7166.3173.50000107.6
93V49.6Very low47.2Very low120 Ų120144.9 Ų144.973%0.72779%0.79SS**PPolyproline II helixtrans-91.1121.2169.71790000108.1S91S91-V93 PolarHBondContact O-N 3.16Å
94P55.7Low47Very low100 Ų100150.2 Ų150.265%0.64980%0.796SS**PPolyproline II helixtrans-72.7145.8176.328.2-31.8000111R96P94-R96 PolarHBondContact O-N 3.07Å
95P53.7Low46.8Very low119 Ų119152.9 Ų152.977%0.77380%0.8SS**PPolyproline II helixtrans-69.2121.5177.627.8-31.2000110N97P95-N97 PolarHBondContact O-N 2.85Å
96R49.9Very low46.7Very low247 Ų247148.9 Ų148.993%0.93279%0.793SS**  trans-68.4101.2177.5-152.9172.9-171.4144.7-0.2108.9P94P94-R96 PolarHBondContact O-N 3.07Å
97N45.5Very low46.4Very low149 Ų149156.3 Ų156.380%0.79780%0.802SS**  trans-63.9136171.9-88.8-32.3000110.5P95P95-N97 PolarHBondContact O-N 2.85Å
98T42.4Very low46.6Very low124 Ų124154.1 Ų154.176%0.76180%0.795SS**  trans-73.2124179.248.90000111.3
99T41.6Very low46.4Very low131 Ų131151.4 Ų151.480%0.80479%0.788SS**  trans-102.7103.5163.1-50.90000107.8
100I47.7Very low45.7Very low153 Ų153148.1 Ų148.179%0.78579%0.785SS**  trans-91.6105.9167.5-60.2175.1000105.9N102I100-N102 PolarHBondContact O-N 3.27Å
101M45.2Very low45.1Very low147 Ų147142.8 Ų142.872%0.72478%0.777SS**  trans-64.6123.4171.9-78.4-17365.600109.6T103M101-T103 HydrophobicContact CE-CG2 4Å
102N38.6Very low44.9Very low165 Ų165143.3 Ų143.388%0.88278%0.776SS**  trans-95.898.4172.9-161.713.4000106.6I100I100-N102 PolarHBondContact O-N 3.27Å
103T51Low44.5Very low101 Ų101143 Ų14362%0.6277%0.774SS**  trans-129.3115.2178.537.50000112.2M101M101-T103 HydrophobicContact CE-CG2 4Å
104Q41.3Very low44.2Very low185 Ų185142.9 Ų142.986%0.86477%0.773SS**  trans63.5100.5150-87177.5-28.700119.8S106Q104-S106 PolarHBondContact O-N 2.87Å
105K40.5Very low43.3Very low211 Ų211146.5 Ų146.592%0.91778%0.782SS**  trans-55.296.9147.5-66.8171.9176.2178.60109.9R107K105-R107 PolarHBondContact O-N 3.24Å
106S43Very low42.8Very low102 Ų102146.7 Ų146.771%0.71378%0.78SS**  trans-84.297160.160.90000108.6Q104 I108Q104-S106 PolarHBondContact O-N 2.87Å; S106-I108 PolarHBondContact O-N 2.89Å
107R42.4Very low42.1Very low242 Ų242138.5 Ų138.591%0.91376%0.761SS**  trans-71.9102.6171.9-162.7-177.8-167.4-172.82.6107.4K105 P109K105-R107 PolarHBondContact O-N 3.24Å; R107-P109 WeakPolarHBondContact O-CD 3.41Å
108I46.3Very low42.1Very low144 Ų144136 Ų13674%0.73875%0.753SS**  trans-82.9116.1169.9-59.1170.8000106.9S106 V110S106-I108 PolarHBondContact O-N 2.89Å; I108-V110 PolarHBondContact O-N 3.4Å
109P41.8Very low42Very low110 Ų110137.8 Ų137.871%0.71476%0.755SS**  trans-73.6115.5172.628.7-29.1000109R107 A111R107-P109 WeakPolarHBondContact O-CD 3.41Å; P109-A111 VanDerWaalsContact C-N 3.29Å; P109-A111 PolarHBondContact O-N 3.24Å
110V38.9Very low42.2Very low129 Ų129140.9 Ų140.978%0.78276%0.757SS**  trans-76.688.1166178.50000107I108I108-V110 PolarHBondContact O-N 3.4Å
111A37.3Very low42Very low82 Ų82141.5 Ų141.568%0.67876%0.757SS**  trans-109.175.1162.700000107.4P109 T113P109-A111 VanDerWaalsContact C-N 3.29Å; P109-A111 PolarHBondContact O-N 3.24Å; A111-T113 VanDerWaalsContact C-N 3.31Å; A111-T113 PolarHBondContact O-N 2.96Å
112T42.5Very low41.9Very low119 Ų119141.6 Ų141.673%0.7376%0.76SS**  trans-9079.4163.242.10000107.6V114T112-V114 PolarHBondContact O-N 3.47Å
113T38.8Very low42.1Very low122 Ų122142.2 Ų142.275%0.74876%0.763SS**  trans-67.6106154.8-37.40000105.3A111 E115A111-T113 VanDerWaalsContact C-N 3.31Å; A111-T113 PolarHBondContact O-N 2.96Å; T113-E115 PolarHBondContact O-N 3.33Å
114V43.4Very low41.5Very low118 Ų118141.3 Ų141.372%0.71577%0.765SS**  trans-73.288.6167.8178.90000105.4T112 V116T112-V114 PolarHBondContact O-N 3.47Å; V114-V116 VanDerWaalsContact C-N 3.31Å; V114-V116 HydrophobicContact CG1-CG2 4.04Å; V114-V116 PolarHBondContact O-N 2.76Å
115E38.6Very low41.4Very low177 Ų177141.7 Ų141.783%0.82776%0.764SS**  trans-65.9102.6157.4-83.5-154.8153.800106.7T113 S117T113-E115 PolarHBondContact O-N 3.33Å; E115-S117 PolarHBondContact O-N 3.49Å
116V42.7Very low41.5Very low122 Ų122139.5 Ų139.574%0.73976%0.762SS**  trans-64.993164.5-178.30000105.6V114 P118V114-V116 VanDerWaalsContact C-N 3.31Å; V114-V116 HydrophobicContact CG1-CG2 4.04Å; V114-V116 PolarHBondContact O-N 2.76Å; V116-P118 WeakPolarHBondContact O-CD 3.46Å
117S35.3Very low41.6Very low75 Ų75142.2 Ų142.252%0.52477%0.769SS.*  trans-56.8122.8173.4-173.90000108.3E115 M119E115-S117 PolarHBondContact O-N 3.49Å; S117-M119 PolarHBondContact O-N 3.02Å
118P44.3Very low41.5Very low97 Ų97136.2 Ų136.263%0.6376%0.761SS**G310 helixtrans-71.213-175.927.6-33000113.7V116 F120V116-P118 WeakPolarHBondContact O-CD 3.46Å; P118-F120 PolarHBondContact O-N 3.39Å
119M41.4Very low41.4Very low162 Ų162138 Ų13880%0.79877%0.766SS**G310 helixtrans-78.7-0.6-171.9-147.1169.5179.300114.5S117S117-M119 PolarHBondContact O-N 3.02Å
120F45.3Very low41.4Very low195 Ų195138.8 Ų138.886%0.85577%0.765SS**G310 helixtrans-110.910.7179-69.9-74.9000114.6P118P118-F120 PolarHBondContact O-N 3.39Å
121Q43.7Very low41.4Very low166 Ų166138.8 Ų138.878%0.77676%0.76SS**SBendtrans-892.1-179.7-87.2-179.4-10.400115.5
122N43.4Very low41.4Very low149 Ų149141.1 Ų141.180%0.79776%0.762SS**  trans-119.514.2-173.1-69.5-32.7000115.9A124N122-A124 PolarHBondContact O-N 3.48Å
123L41.3Very low41.2Very low179 Ų179144.5 Ų144.594%0.93777%0.766SS**  trans-101.364174.5-105.373.4000110.8
124A39Very low41.2Very low81 Ų81141.9 Ų141.967%0.66976%0.763SS**  trans-142.791.9168.900000107.5N122N122-A124 PolarHBondContact O-N 3.48Å
125K39.9Very low41.1Very low193 Ų193143.6 Ų143.684%0.83977%0.768SS**  trans147.7102166.4-84.2159.5-167.1-166.40106.2
126D41.7Very low41.4Very low166 Ų166142.3 Ų142.389%0.88877%0.767SS**  176.3144.4128.6-80.7-18000109.7
127D45.6Very low41.6Very low158 Ų158146.9 Ų146.985%0.84577%0.771SS**  trans-59.2160.6-160.6-91.8-50.8000117
128P39.6Very low42Very low116 Ų116149.2 Ų149.275%0.75378%0.782SS**  trans-89.7108.817934.6-25.8000110
129E45.9Very low41.8Very low181 Ų181151 Ų15185%0.84679%0.791SS**  trans-146.1118162.2-135.1178.1-173.100111.9
130N40Very low42.1Very low128 Ų128150.5 Ų150.568%0.68479%0.79SS**  trans77.5123.6144.3-119.16.8000121.6
131D39.6Very low42.3Very low128 Ų128150.8 Ų150.868%0.68479%0.791SS**  trans67.9104.1135.5-71.2-18.3000120.2
132D37.8Very low42.5Very low132 Ų132152.9 Ų152.971%0.70680%0.798SS**  82.5122.3113.4-141.721.7000116.9
133K37.4Very low42.4Very low189 Ų189149.1 Ų149.182%0.82280%0.795SS**  trans78.4113.1165.6-51.8176.5-174.3175.90117.4
134G38.6Very low42.4Very low67 Ų67150.4 Ų150.469%0.69179%0.792SS**  trans174.561.5160.500000115.7N136G134-N136 PolarHBondContact O-N 2.97Å
135D42.6Very low42.8Very low154 Ų154156.3 Ų156.382%0.82480%0.803SS**  trans-64.682.1161.5-86.1-19.9000109.5W137D135-W137 PolarHBondContact O-N 2.86Å
136N44.8Very low43.1Very low150 Ų150152.9 Ų152.980%0.80280%0.799SS**  trans-90.877.7-177.2-136.210.1000109.9G134 V138G134-N136 PolarHBondContact O-N 2.97Å; N136-V138 PolarHBondContact O-N 3.23Å
137W46.7Very low43.1Very low218 Ų218150.6 Ų150.683%0.82679%0.791SS**  trans-72.5110.3170-6890.7000109.9D135 T139D135-W137 PolarHBondContact O-N 2.86Å; W137-T139 PolarHBondContact O-N 3.47Å; W137-T139 VanDerWaalsContact O-N 3.11Å
138V43.2Very low42.7Very low124 Ų124149.9 Ų149.975%0.75279%0.787SS**  trans-7499172.2179.80000109.5N136 I140N136-V138 PolarHBondContact O-N 3.23Å; V138-I140 HydrophobicContact CG1-CG1 4.26Å; V138-I140 PolarHBondContact O-N 2.95Å
139T40Very low42.7Very low134 Ų134153.5 Ų153.582%0.82279%0.794SS**  trans-74.6108.416833.50000111.1W137W137-T139 PolarHBondContact O-N 3.47Å; W137-T139 VanDerWaalsContact O-N 3.11Å
140I48.9Very low42.2Very low152 Ų152155.4 Ų155.478%0.77979%0.793SS**  trans-84.5116170.5-50174.7000108.5V138 K142V138-I140 HydrophobicContact CG1-CG1 4.26Å; V138-I140 PolarHBondContact O-N 2.95Å; I140-K142 PolarHBondContact O-N 3.38Å
141K48.6Very low42.4Very low201 Ų201153.3 Ų153.387%0.87479%0.787SS**  trans-59.7115.9173.9-80.4-176.7174.6176.30110.2G143K141-G143 PolarHBondContact O-N 3.37Å; K141-G143 VanDerWaalsContact O-N 3.16Å
142K47.2Very low42.4Very low210 Ų210156 Ų15691%0.91379%0.792SS**  trans-62.8112.9166.8-96.7-176.5176.4174.10109.4I140 K144I140-K142 PolarHBondContact O-N 3.38Å; K142-K144 PolarHBondContact O-N 3.1Å
143G43.1Very low42.8Very low71 Ų71159 Ų15973%0.73280%0.795SS**  trans-57.4131.6166.200000111.1K141 K145K141-G143 PolarHBondContact O-N 3.37Å; K141-G143 VanDerWaalsContact O-N 3.16Å; G143-K145 PolarHBondContact O-N 3.21Å; G143-K145 VanDerWaalsContact O-N 3.17Å
144K39.9Very low43.2Very low205 Ų205160.3 Ų160.389%0.89180%0.801SS**  trans-58.6106.3-179.1-159.6175.1-173.2178.70110.1K142K142-K144 PolarHBondContact O-N 3.1Å
145K48.4Very low43.5Very low205 Ų205165.5 Ų165.589%0.89181%0.807SS**  trans-91.5109.7165.3-80.9-171.6176.4-177.20108.8G143 T147G143-K145 PolarHBondContact O-N 3.21Å; G143-K145 VanDerWaalsContact O-N 3.17Å; K145-T147 PolarHBondContact O-N 3.32Å
146T46.2Very low43.6Very low122 Ų122162.4 Ų162.475%0.74880%0.802SS**  trans-57.9113.9165.841.20000110.6
147T40.2Very low43.7Very low117 Ų117162.7 Ų162.772%0.71880%0.802SS**  43.2126.9127.1-39.60000120K145K145-T147 PolarHBondContact O-N 3.32Å
148D37.7Very low43.8Very low143 Ų143161.6 Ų161.677%0.76580%0.804SS**  trans68.786.5153.8-65.9-18.7000119.5
149Q39.1Very low44Very low193 Ų193163.7 Ų163.790%0.90281%0.805SS**  -162.2114121.3-105.3170.664.800109P151Q149-P151 WeakPolarHBondContact O-CD 3.38Å
150R35.9Very low44.1Very low221 Ų221163 Ų16383%0.83480%0.801SS**  trans-99.2103.3174.4-176.4-175.5-170.2-177.35.7108.3
151P45.4Very low44Very low84 Ų84163.9 Ų163.955%0.54580%0.799SS.*  trans-87.5116.8163.412.24.6000108.9Q149 Y153Q149-P151 WeakPolarHBondContact O-CD 3.38Å; P151-Y153 HydrophobicContact CB-CD2 3.8Å; P151-Y153 HydrophobicContact CB-CE2 3.33Å; P151-Y153 HydrophobicContact CG-CD2 4.46Å; P151-Y153 HydrophobicContact CG-CE2 3.99Å; P151-Y153 PolarHBondContact O-N 3.27Å; P151-Y153 VanDerWaalsContact O-N 3.15Å
152K39.5Very low43.7Very low183 Ų183160.6 Ų160.680%0.79680%0.796SS**  trans-67.8102.1165.8-70.6177.9177.3176.60108.2
153Y44.6Very low43.5Very low196 Ų196157.9 Ų157.977%0.76979%0.79SS**  trans-111.6112.5161.9-64-67.6000108.8P151 E155P151-Y153 HydrophobicContact CB-CD2 3.8Å; P151-Y153 HydrophobicContact CB-CE2 3.33Å; P151-Y153 HydrophobicContact CG-CD2 4.46Å; P151-Y153 HydrophobicContact CG-CE2 3.99Å; P151-Y153 PolarHBondContact O-N 3.27Å; P151-Y153 VanDerWaalsContact O-N 3.15Å; Y153-E155 PolarHBondContact O-N 3.5Å
154K46.2Very low43.4Very low217 Ų217161.7 Ų161.794%0.94379%0.792SS**  trans-73.695162.4-73.4-175.8174.9-173.80106.5
155E46.4Very low43.4Very low176 Ų176157.3 Ų157.382%0.82279%0.787SS**  trans-85.7114.3168.3-100.6-179.916600109.3Y153 I157Y153-E155 PolarHBondContact O-N 3.5Å; E155-I157 PolarHBondContact O-N 2.86Å
156A43.7Very low43.1Very low88 Ų88155.6 Ų155.673%0.72778%0.782SS**  trans-61.6114.1166.500000108.4K158A156-K158 PolarHBondContact O-N 3.32Å
157I46.9Very low42.9Very low156 Ų156155.2 Ų155.280%0.878%0.779SS**  trans-61.3103.8171.3-61.5169000106.9E155 E159E155-I157 PolarHBondContact O-N 2.86Å; I157-E159 HydrophobicContact CG2-CG 4.42Å; I157-E159 PolarHBondContact O-N 3.14Å
158K49.3Very low42.9Very low196 Ų196157.1 Ų157.185%0.85278%0.783SS**  trans-85.1100.3165.8-79.7-176.5176.8179.10107.2A156 T160A156-K158 PolarHBondContact O-N 3.32Å; K158-T160 PolarHBondContact O-N 3.49Å
159E46.9Very low43Very low168 Ų168156.3 Ų156.379%0.78578%0.784SS**  trans-55.4122.8173-69.2179.5163.300110.8I157 K161I157-E159 HydrophobicContact CG2-CG 4.42Å; I157-E159 PolarHBondContact O-N 3.14Å; E159-K161 PolarHBondContact O-N 3.37Å; E159-K161 VanDerWaalsContact O-N 3.13Å
160T43Very low43Very low118 Ų118152.2 Ų152.272%0.72478%0.776SS**  trans-70.1100.1169.232.50000109.4K158 T162K158-T160 PolarHBondContact O-N 3.49Å; T160-T162 PolarHBondContact O-N 3.26Å; T160-T162 VanDerWaalsContact O-N 3.13Å
161K46.5Very low43.2Very low172 Ų172151.7 Ų151.775%0.74878%0.78SS**  trans-61.8109.7171.3-70.5-174.3176.1-171.40110.5E159E159-K161 PolarHBondContact O-N 3.37Å; E159-K161 VanDerWaalsContact O-N 3.13Å
162T41.4Very low42.9Very low131 Ų131151 Ų15180%0.80479%0.789SS**  trans-86.7118.8166.6-19.20000107.6T160T160-T162 PolarHBondContact O-N 3.26Å; T160-T162 VanDerWaalsContact O-N 3.13Å
163I44.2Very low42.8Very low154 Ų154150.9 Ų150.979%0.7979%0.791SS**  trans-85.7113.5179.4-62.1167.7000107.5
164I40.9Very low42.7Very low151 Ų151149.2 Ų149.277%0.77480%0.795SS**  trans-97.1122.8166.1-58.7173.6000106.5E166I164-E166 PolarHBondContact O-N 3.25Å
165S39Very low42.1Very low112 Ų112142.2 Ų142.278%0.78379%0.785SS**  trans-80.4104.1177.4-49.90000109.2
166E42.6Very low41.8Very low170 Ų170142.1 Ų142.179%0.79478%0.784SS**  trans-90.7132.5174.5-152.9171.4-15800110.8I164I164-E166 PolarHBondContact O-N 3.25Å
167V41.8Very low41.6Very low114 Ų114143.9 Ų143.969%0.69178%0.781SS**  trans-84.6110.5178.3174.10000108.1T169V167-T169 PolarHBondContact O-N 2.96Å
168I40.5Very low41.3Very low156 Ų156144.1 Ų144.180%0.878%0.779SS**  trans-78.3109.1174.8-57.6169000108.1
169T39.6Very low40.8Very low127 Ų127141.8 Ų141.878%0.77978%0.775SS**  trans-85.8104161.841.90000108.5V167 K171V167-T169 PolarHBondContact O-N 2.96Å; T169-K171 PolarHBondContact O-N 2.98Å
170S39.5Very low40.1Very low106 Ų106140 Ų14074%0.74178%0.776SS**  trans-70.5115.8171.156.80000109.5G172S170-G172 PolarHBondContact O-N 3.04Å; S170-G172 VanDerWaalsContact O-N 3.1Å
171K40.4Very low39.9Very low211 Ų211138.5 Ų138.592%0.91778%0.775SS**  trans-72.996.7166.6-153.8-179.1-175.1-173.90107.2T169 E173T169-K171 PolarHBondContact O-N 2.98Å; K171-E173 PolarHBondContact O-N 2.93Å
172G38.2Very low39.2Very low70 Ų70136 Ų13672%0.72278%0.779SS**  trans-76.1104.6170.900000109.1S170 N174S170-G172 PolarHBondContact O-N 3.04Å; S170-G172 VanDerWaalsContact O-N 3.1Å; G172-N174 PolarHBondContact O-N 2.8Å
173E36.3Very low39.2Very low179 Ų179136.2 Ų136.284%0.83678%0.78SS**  trans-68.1111.9160.2-177179.3170.700107.8K171K171-E173 PolarHBondContact O-N 2.93Å
174N42.5Very low38.8Very low161 Ų161137.8 Ų137.886%0.86178%0.784SS**  trans177.2104.8162.3-86.7-20.3000102.9G172G172-N174 PolarHBondContact O-N 2.8Å
175G35Very low38.7Very low71 Ų71136.1 Ų136.173%0.73279%0.786SS**  103.2123.264.200000106.6
176E38.9Very low38.3Very low173 Ų173134.6 Ų134.681%0.80879%0.788SS**  trans85.997.3148.9-126.2165.4-175.500119.7
177N39.5Very low38Very low125 Ų125132.6 Ų132.667%0.66879%0.787SS**  65.3145.9120.5-54.9-17.4000123.1
178H40.9Very low37.7Very low161 Ų161136.1 Ų136.175%0.74580%0.796SS**  trans87.898.1160-60.9-73.6000116.9
179L38.7Very low38.2Very low147 Ų147134.3 Ų134.377%0.7780%0.795SS**  62.210882.5-85.8154.5000113.8
180V33.8Very low38.3Very low132 Ų132134.1 Ų134.180%0.879%0.793SS**  39.3117.8127.4-176.80000116.9
181A38.2Very low38.6Very low85 Ų85134.7 Ų134.770%0.70279%0.794SS**  177.9133.6114.300000111.2
182S31.8Very low39Very low121 Ų121132.9 Ų132.985%0.84679%0.794SS**  trans-54.8141.4161.2-640000111
183T40.3Very low39.5Very low134 Ų134139.1 Ų139.182%0.82280%0.801SS**  trans-147.4109.6154-20.10000108.2
184E36.9Very low39.8Very low187 Ų187135 Ų13587%0.87480%0.798SS**  trans-53.4130158.9-63.9170.5141.300109
185S38.9Very low40.4Very low116 Ų116132.4 Ų132.481%0.81179%0.792SS**  171.8135.8128.8670000108.7V187S185-V187 PolarHBondContact O-N 3.42Å
186G30.8Very low41.4Very low81 Ų81138.5 Ų138.584%0.83580%0.798SS**  trans-63.1120.6-172.300000113
187V35.8Very low42.6Very low127 Ų127139.5 Ų139.577%0.7780%0.8SS**  trans-142.8110.5146-179.80000104.8S185 P189S185-V187 PolarHBondContact O-N 3.42Å; V187-P189 WeakPolarHBondContact O-CD 3.41Å
188E35Very low44.2Very low188 Ų188141 Ų14188%0.87981%0.807SS**  trans-57.7122.8170.2-82.9-154.3151.400109.6
189P50.6Low45.4Very low119 Ų119138.4 Ų138.477%0.77380%0.804SS**  trans-100108160.318.32.9000107.9V187V187-P189 WeakPolarHBondContact O-CD 3.41Å
190V41.9Very low47.2Very low122 Ų122137.3 Ų137.374%0.73981%0.806SS**  trans-6.2124.2157.7-179.70000114.1L192V190-L192 PolarHBondContact O-N 3.03Å
191P46.6Very low49.2Very low119 Ų119136.4 Ų136.477%0.77380%0.801SS**  trans-65.6108.3-179.926-31000109.7K193P191-K193 PolarHBondContact O-N 2.87Å
192L48.5Very low50.9Low172 Ų172137.7 Ų137.790%0.90180%0.802SS**  trans-59.3108.6168.2-78.7168.5000108.1V190 A194V190-L192 PolarHBondContact O-N 3.03Å; L192-A194 PolarHBondContact O-N 3.4Å; L192-A194 VanDerWaalsContact O-N 3.14Å
193K49.3Very low53Low202 Ų202140.9 Ų140.988%0.87880%0.803SS**  trans-36.7113.6179.2-69176.4176.21770112.1P191 S195P191-K193 PolarHBondContact O-N 2.87Å; K193-S195 PolarHBondContact O-N 3.42Å
194A42.3Very low54.7Low92 Ų92141 Ų14176%0.7680%0.798SS**  trans11.383.3151.200000115.3L192 K196L192-A194 PolarHBondContact O-N 3.4Å; L192-A194 VanDerWaalsContact O-N 3.14Å; A194-K196 PolarHBondContact O-N 3.28Å
195S53.9Low56.4Low106 Ų106136.3 Ų136.374%0.74178%0.784SS**  trans-62.1111.5156.172.40000106.2K193 K197K193-S195 PolarHBondContact O-N 3.42Å; S195-K197 PolarHBondContact O-N 2.87Å
196K56.2Low58Low199 Ų199137.7 Ų137.787%0.86579%0.787SS**  trans-53.4102.7174.8-71.1177.4177.3179.50107.9A194 L198A194-K196 PolarHBondContact O-N 3.28Å; K196-L198 PolarHBondContact O-N 3.33Å
197K64.5Low59.7Low195 Ų195143 Ų14385%0.84878%0.783SS**PPolyproline II helixtrans-54.5124.1171.5-76.7-176.2176.7-177.70106.6S195S195-K197 PolarHBondContact O-N 2.87Å
198L74Confident61.2Low157 Ų157146.4 Ų146.482%0.82279%0.788SS**PPolyproline II helixtrans-54.5144.3173.5-72.4166.8000108.4K196K196-L198 PolarHBondContact O-N 3.33Å
199P66.3Low62.4Low105 Ų105143 Ų14368%0.68279%0.785SS**PPolyproline II helixtrans-54.9140.1173.224.7-32.8000108.8V201P199-V201 PolarHBondContact O-N 3.47Å
200P75.2Confident62.8Low124 Ų124140.8 Ų140.881%0.80578%0.776SS**PPolyproline II helixtrans-57.5125.8177.723-31.4000109.2
201V76.5Confident63.4Low113 Ų113140.8 Ų140.869%0.68578%0.776SS**PPolyproline II helixtrans-66.1128.8173.3179.10000107.3P199 Q203P199-V201 PolarHBondContact O-N 3.47Å; V201-Q203 PolarHBondContact O-N 3.04Å
202P74.5Confident63.5Low113 Ų113143.7 Ų143.773%0.73478%0.777SS**PPolyproline II helixtrans-59.5124.4176.423.2-31.4000109.2I204P202-I204 PolarHBondContact O-N 3.3Å
203Q75.9Confident63.9Low187 Ų187144.5 Ų144.587%0.87478%0.776SS**PPolyproline II helixtrans-68.5123.3175.2-70179.7100108.5V201V201-Q203 PolarHBondContact O-N 3.04Å
204I74.9Confident64.2Low137 Ų137139 Ų13970%0.70376%0.763SS**PPolyproline II helixtrans-66.2130.7171.6-59.2170.3000106.7P202 T206P202-I204 PolarHBondContact O-N 3.3Å; I204-T206 PolarHBondContact O-N 3.11Å
205P72.6Confident65Low89 Ų89142.7 Ų142.758%0.57877%0.77SS**PPolyproline II helixtrans-53.9130.1175.9-23.431.8000110.6Y207P205-Y207 VanDerWaalsContact O-CD2 3.26Å; P205-Y207 WeakPolarHBondContact O-CD2 3.13Å; P205-Y207 PolarHBondContact O-N 2.81Å
206T72.7Confident65.6Low144 Ų144139.2 Ų139.288%0.88375%0.752SS**  trans-68102.3174.8-37.30000108.6I204 K208I204-T206 PolarHBondContact O-N 3.11Å; T206-K208 PolarHBondContact O-N 3.18Å
207Y66.4Low66.5Low192 Ų192136.8 Ų136.875%0.75375%0.748SS**  trans-70.6126.1170.4-68.3-86.4000108.5P205 S209P205-Y207 VanDerWaalsContact O-CD2 3.26Å; P205-Y207 WeakPolarHBondContact O-CD2 3.13Å; P205-Y207 PolarHBondContact O-N 2.81Å; Y207-S209 PolarHBondContact O-N 3.26Å
208K67.2Low67.2Low200 Ų200139.3 Ų139.387%0.8775%0.752SS**  trans-61.4122.6165.5-72.3-173.4178.1-176.30106.8T206 A210T206-K208 PolarHBondContact O-N 3.18Å; K208-A210 VanDerWaalsContact C-N 3.3Å; K208-A210 PolarHBondContact O-N 2.95Å
209S59.9Low67.2Low117 Ų117139.4 Ų139.482%0.81875%0.748SS**  trans-59.893.7176.8-169.30000109Y207 V211Y207-S209 PolarHBondContact O-N 3.26Å; S209-V211 PolarHBondContact O-N 3Å
210A59.3Low67.6Low71 Ų71141.1 Ų141.159%0.58775%0.747SS**  trans-84.390.7169.800000106K208 F212K208-A210 VanDerWaalsContact C-N 3.3Å; K208-A210 PolarHBondContact O-N 2.95Å; A210-F212 VanDerWaalsContact C-N 3.27Å; A210-F212 VanDerWaalsContact O-CD2 3.27Å; A210-F212 WeakPolarHBondContact O-CD2 3.38Å; A210-F212 PolarHBondContact O-N 3.06Å
211V54.1Low67.5Low123 Ų123140.7 Ų140.775%0.74574%0.742SS**  trans27.762.4160.6-166.90000112.8S209 E213S209-V211 PolarHBondContact O-N 3Å; V211-E213 HydrophobicContact CG1-CG 4.12Å; V211-E213 PolarHBondContact O-N 3.2Å
212F49.3Very low67.2Low179 Ų179144.5 Ų144.579%0.78574%0.744SS**  trans-88.3100.8163.5-92.5-86.8000105.2A210 S214A210-F212 VanDerWaalsContact C-N 3.27Å; A210-F212 VanDerWaalsContact O-CD2 3.27Å; A210-F212 WeakPolarHBondContact O-CD2 3.38Å; A210-F212 PolarHBondContact O-N 3.06Å; F212-S214 PolarHBondContact O-N 3.18Å
213E56.1Low66.7Low189 Ų189144.4 Ų144.488%0.88375%0.746SS**  trans-69.333.6172.7-66.5-177148.100112.5V211V211-E213 HydrophobicContact CG1-CG 4.12Å; V211-E213 PolarHBondContact O-N 3.2Å
214S56.6Low65.7Low87 Ų87140.8 Ų140.861%0.60874%0.741SS**  trans-141.390.9176.5-170.70000107.6F212 G216F212-S214 PolarHBondContact O-N 3.18Å; S214-G216 PolarHBondContact O-N 3.11Å
215D60Low65Low169 Ų169144.1 Ų144.190%0.90475%0.751SS**  trans-59.982.4151.7-84.9-23000106D217D215-D217 PolarHBondContact O-N 3.5Å
216G65.8Low64.3Low34 Ų34149.4 Ų149.435%0.35177%0.765SS.*  trans-57130.2-179.800000109.2S214 W218S214-G216 PolarHBondContact O-N 3.11Å; G216-W218 PolarHBondContact O-N 3.35Å; G216-W218 PolarHBondContact O-NE1 3.1Å
217D75.9Confident63.4Low148 Ų148145.9 Ų145.979%0.79176%0.757SS**  trans-61.6106.5175.4-85.1-30000109.8D215D215-D217 PolarHBondContact O-N 3.5Å
218W78.6Confident62.8Low247 Ų247147.8 Ų147.894%0.93676%0.763SS**  trans-82.1118.8173.5-64.394.9000109.5G216G216-W218 PolarHBondContact O-N 3.35Å; G216-W218 PolarHBondContact O-NE1 3.1Å
219H73.6Confident62.4Low160 Ų160147.8 Ų147.874%0.74176%0.763SS**  trans-95.5126171.9-64.5-51.1000111.1V221H219-V221 PolarHBondContact O-N 3.32Å; H219-V221 VanDerWaalsContact O-N 3.1Å
220E74.4Confident62.2Low140 Ų140147.9 Ų147.965%0.65476%0.759SS**  trans-65.5109.2172.8-170.4-173.8179.400110R222E220-R222 HydrophobicContact CG-CG 4.05Å; E220-R222 PolarHBondContact O-N 3.47Å; E220-R222 WeakPolarHBondContact OE1-CG 3.43Å; E220-R222 IonicContact OE1-CZ 2.98Å; E220-R222 IonicContact OE1-NE 2.69Å; E220-R222 PolarHBondContact OE1-NE 3.37Å; E220-R222 IonicContact OE1-NH2 2.9Å; E220-R222 PolarHBondContact OE1-NH2 3.14Å; E220-R222 IonicContact OE2-CZ 3.18Å; E220-R222 IonicContact OE2-NE 3.4Å; E220-R222 IonicContact OE2-NH2 3.56Å; E220-R222 PolarHBondContact OE2-NH2 3.41Å
221V74.3Confident61.9Low115 Ų115151 Ų15170%0.69777%0.77SS**  trans-92.985.3173.1-173.90000108.9H219 S223H219-V221 PolarHBondContact O-N 3.32Å; H219-V221 VanDerWaalsContact O-N 3.1Å; V221-S223 PolarHBondContact O-N 3.21Å
222R69.2Low62.4Low193 Ų193154.7 Ų154.773%0.72878%0.776SS**  trans-67126.4170.7-73.5-172.3176.514213.9110.3E220E220-R222 HydrophobicContact CG-CG 4.05Å; E220-R222 PolarHBondContact O-N 3.47Å; E220-R222 WeakPolarHBondContact OE1-CG 3.43Å; E220-R222 IonicContact OE1-CZ 2.98Å; E220-R222 IonicContact OE1-NE 2.69Å; E220-R222 PolarHBondContact OE1-NE 3.37Å; E220-R222 IonicContact OE1-NH2 2.9Å; E220-R222 PolarHBondContact OE1-NH2 3.14Å; E220-R222 IonicContact OE2-CZ 3.18Å; E220-R222 IonicContact OE2-NE 3.4Å; E220-R222 IonicContact OE2-NH2 3.56Å; E220-R222 PolarHBondContact OE2-NH2 3.41Å
223S63.6Low62.7Low111 Ų111158.8 Ų158.878%0.77680%0.798SS**  trans-66.1137.516659.40000109.5V221 K225V221-S223 PolarHBondContact O-N 3.21Å; S223-K225 PolarHBondContact O-N 3.38Å
224S56Low63Low111 Ų111157.3 Ų157.378%0.77679%0.794SS**  trans-63112.217768.80000108.8K226S224-K226 PolarHBondContact O-N 2.92Å
225K60Low63.4Low208 Ų208161 Ų16190%0.90480%0.803SS**  trans-60.998.8174-165.5175.4-174.2175.30108.3S223 G227S223-K225 PolarHBondContact O-N 3.38Å; K225-G227 PolarHBondContact O-N 2.91Å
226K57.4Low63.6Low200 Ų200160.6 Ų160.687%0.8780%0.798SS**  trans-69.797.8179.5-148.3176.7-170.4179.40107.6S224 R228S224-K226 PolarHBondContact O-N 2.92Å; K226-R228 PolarHBondContact O-N 3.46Å; K226-R228 VanDerWaalsContact O-N 3.09Å
227G54.2Low63.4Low70 Ų70168 Ų16872%0.72282%0.824SS**  trans-60109.717700000110.5K225 K229K225-G227 PolarHBondContact O-N 2.91Å; G227-K229 PolarHBondContact O-N 3.22Å
228R53Low62.7Low231 Ų231169.3 Ų169.387%0.87283%0.826SS**  trans-73.5106.7168.3-172.2177.6-177.7178.3-0.2107.3K226 T230K226-R228 PolarHBondContact O-N 3.46Å; K226-R228 VanDerWaalsContact O-N 3.09Å; R228-T230 PolarHBondContact O-N 3.46Å
229K60.3Low61.6Low200 Ų200164.1 Ų164.187%0.8782%0.819SS**  trans-71.3115.5164.6-72.8-173.9177.3-177.10107.8G227G227-K229 PolarHBondContact O-N 3.22Å
230T54.7Low60.7Low119 Ų119164.4 Ų164.473%0.7382%0.824SS**PPolyproline II helixtrans-77.5127.216240.40000107.9R228R228-T230 PolarHBondContact O-N 3.46Å
231V52.2Low59.7Low137 Ų137166.2 Ų166.283%0.8384%0.837SS**PPolyproline II helixtrans-79.4123.3166.2176.70000106.1
232K64.7Low58.5Low200 Ų200170.5 Ų170.587%0.8785%0.849SS**PPolyproline II helixtrans-71.1126.4167.9-75.8-174.9171.7-175.30108.1
233Q56.4Low57.5Low266 Ų266168.5 Ų168.5100%1.24386%0.86SS**  trans-76.80156.6-83.1-175.3-48.500109.4

Retrieved 233 of 233 residues in 148 ms (Link to these results)